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LAMMPS Mail List Date Index


There are 75689 messages in 22343 threads in the archives.

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April 15, 2018
19:56 Re: [lammps-users] COM g(r) of Polymer molecular Chuanxing Zhan
15:18 Re: [lammps-users] Kokkos version for gran/hooke/history Stefan Paquay
14:47 Re: [lammps-users] Angular velocities in principal axes frame Stefan Paquay
14:04 Re: [lammps-users] Angular velocities in principal axes frame Maurice de Koning
11:39 Re: [lammps-users] Angular velocities in principal axes frame Giacomo Fiorin

April 14, 2018
10:43 [lammps-users] Angular velocities in principal axes frame Maurice de Koning
09:03 Re: [lammps-users] problem in fix indent Axel Kohlmeyer
08:35 Re: [lammps-users] problem in fix indent Vijay Reddy
08:13 Re: [lammps-users] problem in fix indent Axel Kohlmeyer
07:58 [lammps-users] problem in fix indent Vijay Reddy
03:28 Re: [lammps-users] how to apply purely repulsive potential? Anders Hafreager
02:44 [lammps-users] how to apply purely repulsive potential? soroosh mo

April 13, 2018
21:21 Re: [lammps-users] How do I model Couette Flow in a NVT system with a void space Axel Kohlmeyer
21:06 Re: [lammps-users] How do I model Couette Flow in a NVT system with a void space 罗爽
18:06 Re: [lammps-users] Kokkos version for gran/hooke/history Denis Taniguchi
17:18 Re: [lammps-users] About accesing pair potential. Giacomo Fiorin
16:52 Re: [lammps-users] COM g(r) of Polymer molecular Axel Kohlmeyer
16:23 Re: [lammps-users] COM g(r) of Polymer molecular Chuanxing Zhan
16:08 [lammps-users] About accesing pair potential. Arun Bikram Thapa
13:10 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Giacomo Fiorin
12:39 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Pascal Brault
12:27 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Moore, Stan
12:21 Re: [lammps-users] Kokkos version for gran/hooke/history Moore, Stan
12:17 Re: [lammps-users] Create multiple angles of different angletypes with "fix bond/create" Jacob Gissinger
12:07 Re: [lammps-users] On multi/harmonic dihedrals Axel Kohlmeyer
11:04 Re: [lammps-users] How to access the group averaged position at a certain step? Axel Kohlmeyer
10:56 Re: [lammps-users] COM g(r) of Polymer molecular Axel Kohlmeyer
10:40 [lammps-users] COM g(r) of Polymer molecular Chuanxing Zhan
10:32 [lammps-users] Create multiple angles of different angletypes with "fix bond/create" Tim Lodewyckx
10:15 [lammps-users] Need help with understanding the run start/stop implement Chilakalapudi, Syamal Praneeth (INT)
10:13 [lammps-users] On multi/harmonic dihedrals Nicola Molinari
09:40 Re: [lammps-users] copy_arrays example in developer guide out of date? Axel Kohlmeyer
09:04 Re: [lammps-users] Accessing number of bonds in python operated LAMMPS or length of internal LAMMPS data array Axel Kohlmeyer
08:42 Re: [lammps-users] Accessing number of bonds in python operated LAMMPS or length of internal LAMMPS data array Robert Meißner
08:35 [lammps-users] How to access the group averaged position at a certain step? Peter Chu
08:31 [lammps-users] Kokkos version for gran/hooke/history Denis Taniguchi
07:39 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Axel Kohlmeyer
07:13 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Steve Plimpton
07:12 [lammps-users] Pressure induced phase transition Metadynamics with PLUMED Matej Badin
06:58 Re: [lammps-users] How do I model Couette Flow in a NVT system with a void space Axel Kohlmeyer
06:53 Re: [lammps-users] Accessing number of bonds in python operated LAMMPS or length of internal LAMMPS data array Axel Kohlmeyer
06:40 Re: [lammps-users] How do I model Couette Flow in a NVT system with a void space 罗爽
06:22 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Axel Kohlmeyer
06:14 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Axel Kohlmeyer
05:53 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Giacomo Fiorin
05:51 [lammps-users] Accessing number of bonds in python operated LAMMPS or length of internal LAMMPS data array Robert Meißner
05:49 Re: [lammps-users] How do I model Couette Flow in a NVT system with a void space Giacomo Fiorin
05:47 Re: [lammps-users] lammps-users Digest, Vol 143, Issue 53 Noam Bernstein
04:37 Re: [lammps-users] question Axel Kohlmeyer
04:19 Re: [lammps-users] question ehsan gowdini
04:18 Re: [lammps-users] question ehsan gowdini
03:13 Re: [lammps-users] question Axel Kohlmeyer
03:11 Re: [lammps-users] question Axel Kohlmeyer
03:10 Re: [lammps-users] using si.meam.spline Axel Kohlmeyer
02:39 [lammps-users] question ehsan gowdini
00:06 [lammps-users] using si.meam.spline Digvijay Yadav

April 12, 2018
23:22 [lammps-users] How do I model Couette Flow in a NVT system with a void space 罗爽
19:18 Re: [lammps-users] fix NPT and fix move liyi bai
15:23 Re: [lammps-users] [EXTERNAL] Re: keeping up with API changes for github version Moore, Stan
14:07 Re: [lammps-users] [EXTERNAL] Re: Triclinic box with pppm/tip4p and MPI Axel Kohlmeyer
11:34 Re: [lammps-users] How stress is computed when forces are velocity dependent? Arham Amouei
10:10 Re: [lammps-users] [EXTERNAL] Re: Inquiry on mu-P-T ensemble Thompson, Aidan
10:05 Re: [lammps-users] keeping up with API changes for github version Axel Kohlmeyer
10:00 Re: [lammps-users] keeping up with API changes for github version Steve Plimpton
09:55 Re: [lammps-users] Error on "Invalid atom type in fix deposit" Steve Plimpton
09:52 Re: [lammps-users] keeping up with API changes for github version Giacomo Fiorin
09:51 Re: [lammps-users] How stress is computed when forces are velocity dependent? Steve Plimpton
09:29 Re: [lammps-users] Question about using r-respa integrator Pengyu Huang
09:28 [lammps-users] get id of the any atom of the group Al web
09:17 [lammps-users] keeping up with API changes for github version Noam Bernstein
08:51 [lammps-users] issues in system equilibration Mohit Sharma
08:38 [lammps-users] About simulating Water-vapor system. Rubayat Bin Shahadat
07:40 Re: [lammps-users] Reg. anatase nanorod structure stabilization ABHINAV SHUKLA
07:32 Re: [lammps-users] fix NPT and fix move Axel Kohlmeyer
07:02 Re: [lammps-users] fix NPT and fix move liyi bai
04:31 [lammps-users] Error on "Invalid atom type in fix deposit" MASATO KOIZUMI
03:56 Re: [lammps-users] Inquiry on mu-P-T ensemble Wahab Mirco
03:09 Re: [lammps-users] Does write_coeff work for bond_style hybrid? Axel Kohlmeyer
03:02 Re: [lammps-users] fix NPT and fix move Axel Kohlmeyer
03:00 [lammps-users] Does write_coeff work for bond_style hybrid? Tim Lodewyckx
02:59 [lammps-users] Inquiry on mu-P-T ensemble MASATO KOIZUMI
02:57 Re: [lammps-users] Reg. anatase nanorod structure stabilization Axel Kohlmeyer
02:54 Re: [lammps-users] fix NPT and fix move liyi bai
02:47 Re: [lammps-users] Question about using r-respa integrator Axel Kohlmeyer
02:41 Re: [lammps-users] Spatial temperature distribution Axel Kohlmeyer
02:38 Re: [lammps-users] fix NPT and fix move Axel Kohlmeyer
02:36 Re: [lammps-users] create molecules using create_atoms random keyword Axel Kohlmeyer
02:00 [lammps-users] create molecules using create_atoms random keyword 화학공학과/대학원생
00:06 Re: [lammps-users] fix NPT and fix move liyi bai

April 11, 2018
22:30 Re: [lammps-users] Spatial temperature distribution Nader Ameli
22:13 Re: [lammps-users] Question about using r-respa integrator Pengyu Huang
21:49 Re: [lammps-users] fix NPT and fix move Axel Kohlmeyer
20:49 Re: [lammps-users] fix NPT and fix move liyi bai
16:20 Re: [lammps-users] Kinetic energy oscillations with granular & fix deform riccardo . artoni
15:02 [lammps-users] Reg. anatase nanorod structure stabilization ABHINAV SHUKLA
14:41 Re: [lammps-users] Kinetic energy oscillations with granular & fix deform Eric Murphy
13:32 Re: [lammps-users] [EXTERNAL] Re: Triclinic box with pppm/tip4p and MPI Moore, Stan
13:26 Re: [lammps-users] Compute rdf commad g(r) Chuanxing Zhan
13:03 [lammps-users] How stress is computed when forces are velocity dependent? Arham Amouei
12:41 Re: [lammps-users] Compute rdf commad g(r) Axel Kohlmeyer
11:44 [lammps-users] Compute rdf commad g(r) Chuanxing Zhan
11:11 Re: [lammps-users] Question about using r-respa integrator Axel Kohlmeyer
11:04 [lammps-users] Question about using r-respa integrator Pengyu Huang
10:27 Re: [lammps-users] pair-style-code-question Diaz,Adrian
09:56 Re: [lammps-users] pair-style-code-question Axel Kohlmeyer
09:40 [lammps-users] pair-style-code-question Diaz,Adrian
08:39 Re: [lammps-users] Fracture mechanism Axel Kohlmeyer
08:25 [lammps-users] Fracture mechanism Khourshaei Shar, Ali
08:15 Re: [lammps-users] Spatial temperature distribution Axel Kohlmeyer
08:12 Re: [lammps-users] Spatial temperature distribution Nader Ameli
08:10 Re: [lammps-users] Spatial temperature distribution Axel Kohlmeyer
08:00 Re: [lammps-users] Spatial temperature distribution Nader Ameli
07:43 Re: [lammps-users] fix NPT and fix move Axel Kohlmeyer
07:35 [lammps-users] fix NPT and fix move liyi bai
06:45 Re: [lammps-users] boundary 'p p p' and 's p p' , giving same potential energy Axel Kohlmeyer
06:08 Re: [lammps-users] boundary 'p p p' and 's p p' , giving same potential energy Anil Mangla
05:50 Re: [lammps-users] Kinetic energy oscillations with granular & fix deform riccardo . artoni
05:42 Re: [lammps-users] Pair potential hybrid Axel Kohlmeyer
05:29 Re: [lammps-users] Spatial temperature distribution Axel Kohlmeyer
05:26 Re: [lammps-users] boundary 'p p p' and 's p p' , giving same potential energy Axel Kohlmeyer
03:52 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
02:10 Re: [lammps-users] boundary 'p p p' and 's p p' , giving same potential energy Anil Mangla
00:04 [lammps-users] Spatial temperature distribution Nader Ameli

April 10, 2018
21:36 [lammps-users] Pair potential hybrid hossain khan
15:57 Re: [lammps-users] Kinetic energy oscillations with granular & fix deform Eric Murphy
14:59 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling David Nicholson
14:39 [lammps-users] Kinetic energy oscillations with granular & fix deform riccardo . artoni
14:17 Re: [lammps-users] Lattice custom + basis command for binary alloy ch xu
14:11 Re: [lammps-users] Lattice custom + basis command for binary alloy Axel Kohlmeyer
14:04 [lammps-users] Lattice custom + basis command for binary alloy ch xu
13:51 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
13:27 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling David Nicholson
10:00 Re: [lammps-users] boundary 'p p p' and 's p p' , giving same potential energy Axel Kohlmeyer
09:57 Re: [lammps-users] eam/alloy potential usage Axel Kohlmeyer
09:46 [lammps-users] boundary 'p p p' and 's p p' , giving same potential energy Anil Mangla
08:02 [lammps-users] eam/alloy potential usage Emel Gürbüz
01:44 [lammps-users] mu-P-T ensemble MASATO KOIZUMI
01:16 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande

April 09, 2018
23:47 Re: [lammps-users] [EXTERNAL] Re: GCMC can not fully fill a box with particles for high MC movement frequency Han Liu
20:39 Re: [lammps-users] Apply multiple pairs of force Axel Kohlmeyer
20:23 [lammps-users] Apply multiple pairs of force Wen Zhang
13:19 Re: [lammps-users] Applying a fix after some initial run Quang Ha
12:20 Re: [lammps-users] create a box of BMIM-Tf2N Ionic liquid Axel Kohlmeyer
12:11 [lammps-users] create a box of BMIM-Tf2N Ionic liquid Granite Tait
11:48 Re: [lammps-users] multiple use of fix GCMC Axel Kohlmeyer
11:25 [lammps-users] multiple use of fix GCMC 화학공학과/대학원생
10:10 Re: [lammps-users] Applying a fix after some initial run Axel Kohlmeyer
09:59 [lammps-users] Applying a fix after some initial run Quang Ha
09:29 Re: [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Axel Kohlmeyer
09:16 [lammps-users] TUTORIAL: "Modeling Supra-molecular Structures with LAMMPS" - JULY 9-13 Axel Kohlmeyer
09:07 Re: [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Pengyu Huang
09:01 Re: [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Pengyu Huang
08:41 Re: [lammps-users] How to store initial pressure component Axel Kohlmeyer
08:12 [lammps-users] How to store initial pressure component Khourshaei Shar, Ali
06:01 Re: [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Axel Kohlmeyer
05:53 Re: [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Tim Lodewyckx
04:55 Re: [lammps-users] Pair_coeff Axel Kohlmeyer
04:51 Re: [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Axel Kohlmeyer
03:35 Re: [lammps-users] Pair_coeff Imanuel Kristanto
03:11 [lammps-users] Minimization: Stopping criterion = quadratic factors are zero Tim Lodewyckx
02:59 [lammps-users] Pair_coeff Mehran Tohidi

April 08, 2018
19:11 Re: [lammps-users] FW: Restart Problem Axel Kohlmeyer
18:26 Re: [lammps-users] FW: Restart Problem Trung Nguyen
11:34 Re: [lammps-users] FW: Restart Problem Mostafa Mohamed Abdelsayed Mohamed Elabyouki
10:56 Re: [lammps-users] Invalid pair style (../force.cpp:175) Axel Kohlmeyer
09:38 [lammps-users] Invalid pair style (../force.cpp:175) CHABBA Hanae
05:26 Re: [lammps-users] A error: Fix mvv/dpd requires atom attribute vest Axel Kohlmeyer
02:46 [lammps-users] A error: Fix mvv/dpd requires atom attribute vest 徐放
02:43 Re: [lammps-users] FW: Restart Problem Trung Nguyen
01:38 [lammps-users] FW: Restart Problem Mostafa Mohamed Abdelsayed Mohamed Elabyouki

April 07, 2018
15:45 Re: [lammps-users] BKS potential of a-silica Zhao Fan
13:34 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
07:59 Re: [lammps-users] REST2 simulations Steve Plimpton
07:57 Re: [lammps-users] tip3p water_NPT Steve Plimpton
07:53 Re: [lammps-users] BKS potential of a-silica Steve Plimpton
07:51 Re: [lammps-users] Temperature profile of the two phases system in NVT Steve Plimpton
01:56 Re: [lammps-users] REST2 simulations Axel Kohlmeyer
00:30 [lammps-users] REST2 simulations divyabharathi korlepara

April 06, 2018
17:33 Re: [lammps-users] Temperature is blowing up in NPT and NVT Sonibare, Kolawole
09:21 Re: [lammps-users] crosslinked polymer with low-density problem calculated by dreiding Axel Kohlmeyer
09:11 Re: [lammps-users] crosslinked polymer with low-density problem calculated by dreiding 徐浩
07:27 Re: [lammps-users] crosslinked polymer with low-density problem calculated by dreiding Axel Kohlmeyer
07:03 [lammps-users] crosslinked polymer with low-density problem calculated by dreiding 徐浩

April 05, 2018
22:26 Re: [lammps-users] How to use parallel simulation with ReaxFF method Axel Kohlmeyer
21:46 Re: [lammps-users] How to use parallel simulation with ReaxFF method edwin joseph me16d404
14:49 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Thompson, Aidan
11:57 Re: [lammps-users] Error:lost atoms Axel Kohlmeyer
11:55 Re: [lammps-users] Error:lost atoms bahman daneshian
11:33 Re: [lammps-users] Error:lost atoms bahman daneshian
11:18 Re: [lammps-users] tip3p water_NPT Cunzhi Zhang
11:12 Re: [lammps-users] BKS potential of a-silica Zhao Fan
11:11 Re: [lammps-users] Error:lost atoms Axel Kohlmeyer
11:10 Re: [lammps-users] Error:lost atoms bahman daneshian
10:58 Re: [lammps-users] Error:lost atoms Axel Kohlmeyer
10:48 Re: [lammps-users] Error:lost atoms Axel Kohlmeyer
10:43 [lammps-users] Error:lost atoms bahman daneshian
10:19 Re: [lammps-users] BKS potential of a-silica Axel Kohlmeyer
10:11 Re: [lammps-users] BKS potential of a-silica Zhao Fan
10:08 Re: [lammps-users] tip3p water_NPT Steve Plimpton
10:06 Re: [lammps-users] how to add a couple force to i,j particles? Axel Kohlmeyer
10:02 Re: [lammps-users] Triclinic box with pppm/tip4p and MPI Steve Plimpton
10:01 Re: [lammps-users] BKS potential of a-silica Steve Plimpton
10:01 Re: [lammps-users] how to add a couple force to i,j particles? Diaz,Adrian
09:59 Re: [lammps-users] Lennard-Jones potential between different atom types Steve Plimpton
09:56 Re: [lammps-users] Temperature profile of the two phases system in NVT Steve Plimpton
09:50 Re: [lammps-users] Tersoff potential question Steve Plimpton
09:27 Re: [lammps-users] ERROR: Numeric index is out of bounds Axel Kohlmeyer
08:47 [lammps-users] tip3p water_NPT Cunzhi Zhang
07:51 [lammps-users] ERROR: Numeric index is out of bounds Lodewyckx, Tim
04:46 Re: [lammps-users] ERROR on proc 0: 1-3 bond count is inconsistent Axel Kohlmeyer
03:56 [lammps-users] ERROR on proc 0: 1-3 bond count is inconsistent Lodewyckx, Tim
01:00 Re: [lammps-users] Compute temp/profile with fix shake Fahim Faraji

April 04, 2018
23:48 [lammps-users] crosslinked polymer with low-density calculated than dreiding 徐浩
17:52 Re: [lammps-users] randomly choose atoms to form a group Zhao Fan
16:25 Re: [lammps-users] randomly choose atoms to form a group Axel Kohlmeyer
16:23 Re: [lammps-users] randomly choose atoms to form a group Axel Kohlmeyer
15:49 Re: [lammps-users] randomly choose atoms to form a group Zhao Fan
14:50 Re: [lammps-users] Triclinic box with pppm/tip4p and MPI Axel Kohlmeyer
14:25 Re: [lammps-users] BKS potential of a-silica Zhao Fan
14:23 Re: [lammps-users] BKS potential of a-silica Axel Kohlmeyer
14:20 Re: [lammps-users] BKS potential of a-silica Zhao Fan
14:16 Re: [lammps-users] BKS potential of a-silica Axel Kohlmeyer
14:15 Re: [lammps-users] BKS potential of a-silica Zhao Fan
13:41 Re: [lammps-users] Compute temp/profile with fix shake Axel Kohlmeyer
13:39 Re: [lammps-users] Compute temp/profile with fix shake Fahim Faraji
13:32 Re: [lammps-users] BKS potential of a-silica Axel Kohlmeyer
13:31 Re: [lammps-users] randomly choose atoms to form a group Axel Kohlmeyer
13:27 Re: [lammps-users] Compute temp/profile with fix shake Axel Kohlmeyer
13:21 Re: [lammps-users] Compute temp/profile with fix shake Fahim Faraji
12:56 Re: [lammps-users] Adding USER-COLVARS package Lunna Li
12:38 [lammps-users] randomly choose atoms to form a group Zhao Fan
12:30 [lammps-users] BKS potential of a-silica Zhao Fan
11:37 Re: [lammps-users] Lennard-Jones potential between different atom types Axel Kohlmeyer
11:35 Re: [lammps-users] Lennard-Jones potential between different atom types Axel Kohlmeyer
11:32 Re: [lammps-users] Adding USER-COLVARS package Axel Kohlmeyer
11:22 [lammps-users] Triclinic box with pppm/tip4p and MPI Maurice de Koning
11:18 Re: [lammps-users] Compute temp/profile with fix shake Axel Kohlmeyer
11:05 [lammps-users] Adding USER-COLVARS package Lunna Li
11:03 [lammps-users] Lennard-Jones potential between different atom types Lodewyckx, Tim
10:56 [lammps-users] Temperature profile of the two phases system in NVT Xinyu You
10:48 [lammps-users] Temperature profile of the two phases system in NVT Xinyu You
09:30 Re: [lammps-users] NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
07:16 [lammps-users] Compute temp/profile with fix shake Fahim Faraji

April 03, 2018
22:44 Re: [lammps-users] Custom fix doesn't work in parallel Axel Kohlmeyer
22:20 Re: [lammps-users] Custom fix doesn't work in parallel Nagarajan Karthik
20:43 Re: [lammps-users] Tersoff potential question Axel Kohlmeyer
20:41 Re: [lammps-users] Bad allocation of large system Axel Kohlmeyer
20:38 Re: [lammps-users] difficulty in constructing Al2O3 Axel Kohlmeyer
20:36 Re: [lammps-users] How to make attractive force zero to certain group of atoms Axel Kohlmeyer
17:28 [lammps-users] How to make attractive force zero to certain group of atoms Mahmud, Khandakar Abu Hasan
17:06 Re: [lammps-users] Help modify Makefile Abdullah Alateeqi
15:32 Re: [lammps-users] temper/npt and fix npt/nph Lunna Li
14:59 [lammps-users] difficulty in constructing Al2O3 maryam akbari
14:36 Re: [lammps-users] temper/npt and fix npt/nph David Stelter
12:56 Re: [lammps-users] Bad allocation of large system Lynn Huilin Ye
12:50 Re: [lammps-users] temper/npt and fix npt/nph Lunna Li
12:33 [lammps-users] temper/npt and fix npt/nph Lunna Li
12:25 Re: [lammps-users] Bad allocation of large system Axel Kohlmeyer
12:19 [lammps-users] Bad allocation of large system Lynn Huilin Ye
11:35 Re: [lammps-users] how to add a couple force to i,j particles? Diaz,Adrian
11:27 [lammps-users] Tersoff potential question Jaeyun Moon
10:04 Re: [lammps-users] Temperature is blowing up in NPT and NVT Sonibare, Kolawole
09:52 Re: [lammps-users] Temperature is blowing up in NPT and NVT Sonibare, Kolawole
08:30 Re: [lammps-users] piecewise harmonic potential Axel Kohlmeyer
08:19 Re: [lammps-users] piecewise harmonic potential Lodewyckx, Tim
07:31 Re: [lammps-users] how to add a couple force to i,j particles? Steve Plimpton
05:29 Re: [lammps-users] Temperature is blowing up in NPT and NVT Axel Kohlmeyer
05:23 Re: [lammps-users] piecewise harmonic potential Axel Kohlmeyer
04:07 [lammps-users] piecewise harmonic potential Lodewyckx, Tim
03:17 [lammps-users] Temperature is blowing up in NPT and NVT Sonibare, Kolawole

April 02, 2018
14:06 Re: [lammps-users] Results from OpenKIM Survey Hao Chen
14:03 Re: [lammps-users] Results from OpenKIM Survey Ellad Tadmor
14:02 Re: [lammps-users] Custom fix doesn't work in parallel Giacomo Fiorin
13:58 Re: [lammps-users] Results from OpenKIM Survey Hao Chen
13:57 Re: [lammps-users] Results from OpenKIM Survey Axel Kohlmeyer
13:54 Re: [lammps-users] Results from OpenKIM Survey Hao Chen
13:50 Re: [lammps-users] Results from OpenKIM Survey Axel Kohlmeyer
13:17 Re: [lammps-users] Results from OpenKIM Survey Hao Chen
13:16 Re: [lammps-users] How to assign rotational temperature to a gas. Axel Kohlmeyer
11:47 [lammps-users] How to assign rotational temperature to a gas. Bhanuday Sharma
09:45 Re: [lammps-users] Results from OpenKIM Survey Pascal Brault
09:44 Re: [lammps-users] [EXTERNAL] Re: LAMMPS is slower than expected Axel Kohlmeyer
09:35 Re: [lammps-users] [EXTERNAL] Re: LAMMPS is slower than expected Moore, Stan
09:15 Re: [lammps-users] Help modify Makefile Axel Kohlmeyer
09:10 Re: [lammps-users] Help modify Makefile Abdullah Alateeqi
09:04 Re: [lammps-users] Graphene Thermal conductivity Axel Kohlmeyer
08:38 Re: [lammps-users] Custom fix doesn't work in parallel yacine hacker
08:36 Re: [lammps-users] Help modify Makefile Axel Kohlmeyer
08:33 Re: [lammps-users] Custom fix doesn't work in parallel Axel Kohlmeyer
03:00 [lammps-users] Custom fix doesn't work in parallel Nagarajan Karthik

April 01, 2018
19:21 [lammps-users] Help modify Makefile Abdullah Alateeqi
16:21 Re: [lammps-users] VDW as a table Axel Kohlmeyer
12:59 [lammps-users] VDW as a table Vadim Sultanov
11:03 Re: [lammps-users] LAMMPS is slower than expected Anders Hafreager
10:12 Re: [lammps-users] LAMMPS is slower than expected Axel Kohlmeyer
10:06 Re: [lammps-users] LAMMPS is slower than expected Thomas Hayes
10:03 Re: [lammps-users] LAMMPS is slower than expected Axel Kohlmeyer
09:52 Re: [lammps-users] LAMMPS is slower than expected Thomas Hayes
08:22 [lammps-users] Graphene Thermal conductivity Karanam Gururaj
06:08 Re: [lammps-users] Difference in electrostatic energy calculated by MS and LAMMPS 徐浩
05:34 Re: [lammps-users] LAMMPS is slower than expected Axel Kohlmeyer
05:14 [lammps-users] LAMMPS is slower than expected Thomas Hayes

March 31, 2018
18:52 Re: [lammps-users] Regarding graphene thermal conductivity Axel Kohlmeyer
15:52 Re: [lammps-users] MSD in LAMMPS Axel Kohlmeyer
14:11 [lammps-users] Results from OpenKIM Survey Ellad Tadmor
13:58 [lammps-users] MSD in LAMMPS Lu Wang
09:11 Re: [lammps-users] question about group dynamic Pascal Brault
07:57 Re: [lammps-users] question about group dynamic Steve Plimpton
07:24 [lammps-users] Regarding graphene thermal conductivity Karanam Gururaj
03:14 Re: [lammps-users] Fix rigid: Bad principal moments Juan Zhou
03:04 Re: [lammps-users] Fix rigid: Bad principal moments Axel Kohlmeyer
02:52 Re: [lammps-users] Fix rigid: Bad principal moments Axel Kohlmeyer
02:49 [lammps-users] question about group dynamic Pascal Brault

March 30, 2018
23:37 Re: [lammps-users] Fix rigid: Bad principal moments Juan Zhou
21:40 [lammps-users] No response after "SHAKE stats (type/ave/delta) on step 348" while insert TIP3P water ??????
16:50 Re: [lammps-users] Fix rigid: Bad principal moments Andrew Jewett
14:34 Re: [lammps-users] delete_atom / velocity loop Steve Plimpton
09:52 Re: [lammps-users] Fix rigid: Bad principal moments Axel Kohlmeyer
09:17 [lammps-users] Fix rigid: Bad principal moments Juan Zhou
07:55 Re: [lammps-users] Warning: force values in table are inconsistent with -dE/dr. Giacomo Fiorin
07:48 Re: [lammps-users] Warning: force values in table are inconsistent with -dE/dr. Axel Kohlmeyer
07:47 Re: [lammps-users] Error: Unknown atom style Chandra Prakash
07:37 Re: [lammps-users] Warning: force values in table are inconsistent with -dE/dr. Giacomo Fiorin
07:32 Re: [lammps-users] Error: Unknown atom style Axel Kohlmeyer
07:28 Re: [lammps-users] Error: Unknown atom style Chandra Prakash
05:24 Re: [lammps-users] Parameters for Tersoff Steve Plimpton
05:12 [lammps-users] Warning: force values in table are inconsistent with -dE/dr. Vijayan, Prabhu
00:15 Re: [lammps-users] Error: Unknown atom style Imanuel Kristanto

March 29, 2018
23:41 Re: [lammps-users] Error: Unknown atom style Chandra Prakash
23:36 Re: [lammps-users] Error: Unknown atom style Imanuel Kristanto
22:53 Re: [lammps-users] Error: Unknown atom style Imanuel Kristanto
22:45 [lammps-users] Error: Unknown atom style Chandra Prakash
20:09 Re: [lammps-users] How do I model a long soft atom chain in LAMMPS? Axel Kohlmeyer
19:56 Re: [lammps-users] How do I model a long soft atom chain in LAMMPS? Andrew Jewett
18:57 Re: [lammps-users] How do I model a long soft atom chain in LAMMPS? Andrew Jewett
17:55 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output William Pisani
16:39 [lammps-users] How do I model a long soft atom chain in LAMMPS? Uke Shaltay
16:15 Re: [lammps-users] Material's structure after thermal relaxation with NPT Chowdhury, Sanjib Chandra
16:00 Re: [lammps-users] Material's structure after thermal relaxation with NPT Axel Kohlmeyer
15:15 [lammps-users] Material's structure after thermal relaxation with NPT Jeong, Jae Young
14:55 Re: [lammps-users] About neighboring proc for comm tiled? Hao Chen
14:53 Re: [lammps-users] About neighboring proc for comm tiled? Axel Kohlmeyer
14:43 Re: [lammps-users] About neighboring proc for comm tiled? Hao Chen
13:42 Re: [lammps-users] About neighboring proc for comm tiled? Diaz,Adrian
13:17 Re: [lammps-users] Tersoff_2 Ray Shan
12:58 Re: [lammps-users] About neighboring proc for comm tiled? Hao Chen
12:07 Re: [lammps-users] Tersoff_2 Ray Shan
09:52 Re: [lammps-users] Parameters for Tersoff Axel Kohlmeyer
09:42 Re: [lammps-users] Parameters for Tersoff Khourshaei Shar, Ali
09:22 Re: [lammps-users] Parameters for Tersoff Axel Kohlmeyer
09:07 Re: [lammps-users] Parameters for Tersoff Khourshaei Shar, Ali
08:34 Re: [lammps-users] Specifying 1-4 interactions explicitely Axel Kohlmeyer
08:28 Re: [lammps-users] Parameters for Tersoff Axel Kohlmeyer
08:23 Re: [lammps-users] Parameters for Tersoff Axel Kohlmeyer
08:20 Re: [lammps-users] Specifying 1-4 interactions explicitely Lu Wang
08:13 Re: [lammps-users] Size of simulation box Axel Kohlmeyer
08:08 Re: [lammps-users] Size of simulation box Steve Plimpton
08:04 Re: [lammps-users] About neighboring proc for comm tiled? Steve Plimpton
08:04 Re: [lammps-users] Specifying 1-4 interactions explicitely Axel Kohlmeyer
07:51 Re: [lammps-users] Questions about the calculations of PMF using 'fix smd' Axel Kohlmeyer
07:49 [lammps-users] Tersoff_2 Khourshaei Shar, Ali
07:43 Re: [lammps-users] Difference in electrostatic energy calculated by MS and LAMMPS Axel Kohlmeyer
06:04 Re: [lammps-users] Regarding the Graphene Thermal conductivity Giacomo Fiorin
05:47 [lammps-users] Parameters for Tersoff Khourshaei Shar, Ali
05:15 [lammps-users] Regarding the Graphene Thermal conductivity Karanam Gururaj
03:34 [lammps-users] Difference in electrostatic energy calculated by MS and LAMMPS 徐浩
02:51 [lammps-users] Specifying 1-4 interactions explicitely Lu Wang
02:19 [lammps-users] Size of simulation box Sara Mosallanejad
02:04 Re: [lammps-users] How should I insert one molecule into the box? Wei Chen
01:32 Re: [lammps-users] How should I insert one molecule into the box? Wei Chen

March 28, 2018
23:45 [lammps-users] Questions about the calculations of PMF using 'fix smd' chenbo
21:55 Re: [lammps-users] About neighboring proc for comm tiled? Hao Chen
21:52 [lammps-users] About neighboring proc for comm tiled? Hao Chen
14:33 Re: [lammps-users] creating Al2O3 structure Axel Kohlmeyer
13:55 [lammps-users] creating Al2O3 structure maryam akbari
12:45 Re: [lammps-users] communication-flag Diaz,Adrian
12:31 Re: [lammps-users] communication-flag Hao Chen
12:27 Re: [lammps-users] communication-flag Diaz,Adrian
12:04 Re: [lammps-users] How should I insert one molecule into the box? Jacob Gissinger
10:59 Re: [lammps-users] Poiseuille flow - High temperature on wall atoms Steve Plimpton
10:55 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output Axel Kohlmeyer
09:50 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output William Pisani
09:04 Re: [lammps-users] srp with triclinic box Axel Kohlmeyer
08:44 Re: [lammps-users] communication-flag Diaz,Adrian
06:01 [lammps-users] (no subject) soukaina louerdi
05:08 Re: [lammps-users] Regarding NPT ensemble Jeams Anderson
04:57 Re: [lammps-users] srp with triclinic box Axel Kohlmeyer
04:50 Re: [lammps-users] communication-flag Axel Kohlmeyer
03:49 Re: [lammps-users] How should I insert one molecule into the box? Wei Chen
01:11 [lammps-users] communication-flag Diaz,Adrian
00:09 Re: [lammps-users] Poiseuille flow - High temperature on wall atoms Gafoor cee pee

March 27, 2018
17:51 Re: [lammps-users] srp with triclinic box John Willows
17:48 [lammps-users] srp with triclinic box John Willows
16:22 Re: [lammps-users] writing potential and forces from previous steps Axel Kohlmeyer
15:13 Re: [lammps-users] writing potential and forces from previous steps ahmed sengab
10:08 Re: [lammps-users] Initially nonphysical pressure Hoang-Thien Luu
08:51 Re: [lammps-users] Averaging over local variables Steve Plimpton
08:39 Re: [lammps-users] suitable number of atom swap after each 100 md steps Steve Plimpton
07:55 Re: [lammps-users] Initially nonphysical pressure Axel Kohlmeyer
07:50 Re: [lammps-users] Initially nonphysical pressure Khourshaei Shar, Ali
07:44 Re: [lammps-users] Initially nonphysical pressure Axel Kohlmeyer
07:38 [lammps-users] Initially nonphysical pressure Khourshaei Shar, Ali
07:08 Re: [lammps-users] Regarding NPT ensemble Giacomo Fiorin
00:42 Re: [lammps-users] extend lammps to create a new per atom variable Axel Kohlmeyer

March 26, 2018
23:35 [lammps-users] extend lammps to create a new per atom variable elene shopova
21:06 Re: [lammps-users] Regarding NPT ensemble Jeams Anderson
18:45 Re: [lammps-users] Nanotube deforming at the fixed ends Axel Kohlmeyer
18:31 Re: [lammps-users] Nanotube deforming at the fixed ends Debu Pal
18:21 Re: [lammps-users] Nanotube deforming at the fixed ends Axel Kohlmeyer
18:15 Re: [lammps-users] Broke single graphene layer for relaxation Axel Kohlmeyer
18:14 Re: [lammps-users] Nanotube deforming at the fixed ends Debu Pal
18:10 Re: [lammps-users] Nanotube deforming at the fixed ends Axel Kohlmeyer
17:58 Re: [lammps-users] Nanotube deforming at the fixed ends Debu Pal
15:50 Re: [lammps-users] writing potential and forces from previous steps Axel Kohlmeyer
15:42 Re: [lammps-users] writing potential and forces from previous steps ahmed sengab
15:11 Re: [lammps-users] writing potential and forces from previous steps Axel Kohlmeyer
14:26 [lammps-users] writing potential and forces from previous steps ahmed sengab
12:42 Re: [lammps-users] [Non-DoD Source] AIREBO: parallel simulations (UNCLASSIFIED) Kaushik Joshi
10:35 Re: [lammps-users] [Non-DoD Source] AIREBO: parallel simulations (UNCLASSIFIED) Shumeyko, Christopher M CTR USARMY RDECOM ARL (US)
09:43 Re: [lammps-users] "hbondchk failed" while using REAX/C Moore, Stan
09:35 [lammps-users] Open positions in Biomolecular Science Windus, Theresa L [CHEM]
09:20 [lammps-users] Broke single graphene layer for relaxation Jeong, Jae Young
08:48 Re: [lammps-users] NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
08:44 [lammps-users] AIREBO: parallel simulations Kaushik Joshi
06:02 Re: [lammps-users] Regarding NPT ensemble Axel Kohlmeyer
05:43 Re: [lammps-users] Regarding NPT ensemble Jeams Anderson
04:42 Re: [lammps-users] Computing and/or saving only unlike pairs using property/local and pair/local Axel Kohlmeyer
04:25 [lammps-users] Computing and/or saving only unlike pairs using property/local and pair/local Wissam

March 25, 2018
22:22 Re: [lammps-users] Averaging over local variables Axel Kohlmeyer
22:19 Re: [lammps-users] Averaging over local variables Jack Goldman
22:10 Re: [lammps-users] Averaging over local variables Axel Kohlmeyer
21:57 Re: [lammps-users] Averaging over local variables Jack Goldman
21:51 Re: [lammps-users] Averaging over local variables Axel Kohlmeyer
21:45 Re: [lammps-users] Nanotube deforming at the fixed ends Giacomo Fiorin
21:44 [lammps-users] Averaging over local variables Jack Goldman
19:41 Re: [lammps-users] pair_style hybrid reax/c lj/cut --Version 16March2018 Ray Shan
19:07 Re: [lammps-users] How should I insert one molecule into the box? Wei Chen
18:59 Re: [lammps-users] How should I insert one molecule into the box? Wei Chen
15:23 [lammps-users] suitable number of atom swap after each 100 md steps Keshab Bashyal
13:53 Re: [lammps-users] Nanotube deforming at the fixed ends Debu Pal
13:23 Re: [lammps-users] Nanotube deforming at the fixed ends Giacomo Fiorin
12:42 Re: [lammps-users] Nanotube deforming at the fixed ends Debu Pal
12:35 Re: [lammps-users] Nanotube deforming at the fixed ends George Ray
12:32 Re: [lammps-users] Nanotube deforming at the fixed ends George Ray
12:02 Re: [lammps-users] Nanotube deforming at the fixed ends Giacomo Fiorin
08:59 [lammps-users] pair_style hybrid reax/c lj/cut --Version 16March2018 Ankit Mishra

March 24, 2018
18:02 Re: [lammps-users] Serial version Axel Kohlmeyer
17:51 Re: [lammps-users] dump custom (using equal-style variable) Axel Kohlmeyer
17:41 [lammps-users] dump custom (using equal-style variable) Stephan Grein
13:55 Re: [lammps-users] "hbondchk failed" while using REAX/C Axel Kohlmeyer
12:16 [lammps-users] "hbondchk failed" while using REAX/C George Ray
11:55 [lammps-users] Serial version Mahmood Naderan
11:44 [lammps-users] Nanotube deforming at the fixed ends Debu Pal
07:35 Re: [lammps-users] Chemical potential and fugacity problems in fix_gcmc Juan Zhou
07:07 Re: [lammps-users] Minimizing Multiple times in a simulation Steve Plimpton
00:03 Re: [lammps-users] Fix Deform and Fix NVE Ensemble MASATO KOIZUMI

March 23, 2018
21:51 Re: [lammps-users] Fix Deform and Fix NVE Ensemble Axel Kohlmeyer
21:47 Re: [lammps-users] Error involving hybrid Tersoff and LJ Axel Kohlmeyer
21:34 Re: [lammps-users] [EXT] RE: Strange the geometry of materials after calculating VACF Jeong, Jae Young
20:30 [lammps-users] copy_arrays example in developer guide out of date? Tiantian Zheng
20:16 Re: [lammps-users] Fix Deform and Fix NVE Ensemble Chowdhury, Sanjib Chandra
19:27 [lammps-users] Fix Deform and Fix NVE Ensemble MASATO KOIZUMI
18:10 Re: [lammps-users] Error involving hybrid Tersoff and LJ Santosh Mogurampelly
17:53 Re: [lammps-users] Error involving hybrid Tersoff and LJ George Ray
17:22 Re: [lammps-users] How should I insert one molecule into the box? Jacob Gissinger
16:59 Re: [lammps-users] How should I insert one molecule into the box? Andrew Jewett
16:46 Re: [lammps-users] Define net charge on molecule while using QEq Ray Shan
16:38 Re: [lammps-users] Fw: Question ofcombiningcomputercluster_atomandcoord_atom command Ray Shan
16:34 Re: [lammps-users] ReaxFF for charged system Ray Shan
16:33 Re: [lammps-users] Error involving hybrid Tersoff and LJ Axel Kohlmeyer
16:32 Re: [lammps-users] Define net charge on molecule while using QEq Ray Shan
16:07 Re: [lammps-users] Error involving hybrid Tersoff and LJ George Ray
15:36 Re: [lammps-users] Error involving hybrid Tersoff and LJ Axel Kohlmeyer
15:21 [lammps-users] Error involving hybrid Tersoff and LJ George Ray
14:47 Re: [lammps-users] Unable to set variable value from the python function using fix python/invoke Axel Kohlmeyer
13:59 Re: [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Axel Kohlmeyer
13:53 Re: [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Manish Solanki
13:50 Re: [lammps-users] [EXTERNAL] Chemical potential and fugacity problems in fix_gcmc Thompson, Aidan
11:57 Re: [lammps-users] pre-equilibration for inhomogeneous system Axel Kohlmeyer
11:45 Re: [lammps-users] pre-equilibration for inhomogeneous system Lu Wang
11:43 Re: [lammps-users] pre-equilibration for inhomogeneous system Lu Wang
11:29 Re: [lammps-users] Lost atoms error after step decrease in box length Lu Wang
11:16 Re: [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Axel Kohlmeyer
11:00 Re: [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Axel Kohlmeyer
10:08 Re: [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Manish Solanki
09:45 Re: [lammps-users] Lost atoms error after step decrease in box length Axel Kohlmeyer
09:27 [lammps-users] Lost atoms error after step decrease in box length Anil Mangla
09:09 Re: [lammps-users] Incomplete run Axel Kohlmeyer
09:00 Re: [lammps-users] Incomplete run Mahmood Naderan
08:57 [lammps-users] Minimizing Multiple times in a simulation Morrissey, Liam S.
08:54 Re: [lammps-users] Building a Fe-Cr Lattice Input Morrissey, Liam S.
08:53 Re: [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Steve Plimpton
08:50 Re: [lammps-users] Fw: Question ofcombiningcomputercluster_atomandcoord_atom command Steve Plimpton
08:49 Re: [lammps-users] Incomplete run Axel Kohlmeyer
08:47 [lammps-users] Incomplete run Mahmood Naderan
08:46 Re: [lammps-users] Regarding NPT ensemble Steve Plimpton
08:05 Re: [lammps-users] pre-equilibration for inhomogeneous system Pengyu Huang
07:54 Re: [lammps-users] Modification of pair style Axel Kohlmeyer
07:46 Re: [lammps-users] pre-equilibration for inhomogeneous system Axel Kohlmeyer
07:44 Re: [lammps-users] Modification of pair style Nagarajan Karthik
07:34 Re: [lammps-users] pre-equilibration for inhomogeneous system Pengyu Huang
07:08 Re: [lammps-users] pre-equilibration for inhomogeneous system Axel Kohlmeyer
07:00 [lammps-users] pre-equilibration for inhomogeneous system Pengyu Huang
06:59 Re: [lammps-users] Modification of pair style Axel Kohlmeyer
06:51 Re: [lammps-users] Modification of pair style Nagarajan Karthik
04:56 Re: [lammps-users] ReaxFF for charged system vaishali a
04:28 Re: [lammps-users] ReaxFF for charged system Axel Kohlmeyer
04:25 Re: [lammps-users] Update dipoles in ellipsoids Axel Kohlmeyer
03:40 Re: [lammps-users] Define net charge on molecule while using QEq ??????
03:38 Re: [lammps-users] Define net charge on molecule while using QEq ??????
03:33 Re: [lammps-users] About Pair style BOP requires comm ghost cutoff 3x larger than 372364 Axel Kohlmeyer
03:24 Re: [lammps-users] ReaxFF for charged system Pascal Brault
02:33 [lammps-users] About Pair style BOP requires comm ghost cutoff 3x larger than 372364 ? ??
01:50 Re: [lammps-users] Define net charge on molecule while using QEq Ray Shan
01:14 [lammps-users] ReaxFF for charged system vaishali a
00:53 [lammps-users] Update dipoles in ellipsoids Vikas Kumar

March 22, 2018
21:41 Re: [lammps-users] Unable to set variable value from the python function using fix python/invoke Birva Patel
21:36 Re: [lammps-users] Define net charge on molecule while using QEq Ray Shan
21:31 Re: [lammps-users] [EXT] RE: Strange the geometry of materials after calculating VACF Chowdhury, Sanjib Chandra
20:47 [lammps-users] Error: Bond missing on Proc / Angle missing on Proc Manish Solanki
20:10 Re: [lammps-users] [EXT] RE: Strange the geometry of materials after calculating VACF Jeong, Jae Young
19:34 Re: [lammps-users] Define net charge on molecule while using QEq ??????
14:05 Re: [lammps-users] Strange the geometry of materials after calculating VACF Chowdhury, Sanjib Chandra
13:56 Re: [lammps-users] Define net charge on molecule while using QEq Ray Shan
13:37 [lammps-users] Strange the geometry of materials after calculating VACF Jeong, Jae Young
13:26 Re: [lammps-users] NPT pressure problem Axel Kohlmeyer
12:57 Re: [lammps-users] NPT pressure problem Lu Wang
11:17 Re: [lammps-users] Chemical potential and fugacity problems in fix_gcmc Axel Kohlmeyer
10:16 Re: [lammps-users] NPT pressure problem Axel Kohlmeyer
10:11 Re: [lammps-users] Unable to set variable value from the python function using fix python/invoke Axel Kohlmeyer
09:47 Re: [lammps-users] Unable to set variable value from the python function using fix python/invoke Birva Patel
09:26 Re: [lammps-users] [EXTERNAL] Re: Different LJ mixing rules for atom types Axel Kohlmeyer
09:18 Re: [lammps-users] [EXTERNAL] Re: Different LJ mixing rules for atom types Moore, Stan
09:14 Re: [lammps-users] Different LJ mixing rules for atom types Stefan Paquay
09:09 Re: [lammps-users] Different LJ mixing rules for atom types Lu Wang
09:05 Re: [lammps-users] NPT pressure problem Jeams Anderson
09:05 Re: [lammps-users] Different LJ mixing rules for atom types Giacomo Fiorin
09:01 Re: [lammps-users] [EXTERNAL] Re: pair_style lj/smooth/linear with gpu Stefan Paquay
08:59 Re: [lammps-users] [EXTERNAL] Re: ADP potential and possibility of using GPU acceleration Moore, Stan
08:56 Re: [lammps-users] [EXTERNAL] Re: lammps on current AMD gpus Moore, Stan
08:55 [lammps-users] Different LJ mixing rules for atom types Lu Wang
08:53 Re: [lammps-users] [EXTERNAL] Re: pair_style lj/smooth/linear with gpu Moore, Stan
08:50 Re: [lammps-users] [EXTERNAL] Re: Building reax Moore, Stan
08:50 Re: [lammps-users] Unable to set variable value from the python function using fix python/invoke Giacomo Fiorin
08:40 Re: [lammps-users] NPT pressure problem Giacomo Fiorin
05:03 [lammps-users] Chemical potential and fugacity problems in fix_gcmc 周娟
04:08 Re: [lammps-users] Building reax Anders Hafreager
03:52 Re: [lammps-users] Building reax Mahmood Naderan
03:40 [lammps-users] Unable to set variable value from the python function using fix python/invoke Birva Patel
02:03 Re: [lammps-users] Building reax Anders Hafreager
01:56 Re: [lammps-users] Building reax Mahmood Naderan
01:40 Re: [lammps-users] Building reax Anders Hafreager
01:31 Re: [lammps-users] Building reax Mahmood Naderan
01:18 Re: [lammps-users] Building reax Anders Hafreager
01:11 Re: [lammps-users] Building reax Mahmood Naderan
00:33 Re: [lammps-users] Fw: Question ofcombiningcomputercluster_atomandcoord_atom command Wade Tian

March 21, 2018
23:13 [lammps-users] Reg: auto correlation function ZEESHAN AHMED
23:06 [lammps-users] NPT pressure problem Jeams Anderson
20:55 [lammps-users] How to calculate stress from bulk pressure Md. Imrul Reza Shishir
19:13 Re: [lammps-users] Define net charge on molecule while using QEq ??????
15:10 Re: [lammps-users] pair_style lj/smooth/linear with gpu Axel Kohlmeyer
14:31 [lammps-users] pair_style lj/smooth/linear with gpu Vinay Vaibhav
14:12 Re: [lammps-users] Building reax Axel Kohlmeyer
13:54 [lammps-users] Building reax Mahmood Naderan
12:32 [lammps-users] Problems with compute ti Rodolfo Leite
12:17 Re: [lammps-users] Define net charge on molecule while using QEq Ray Shan
12:14 Re: [lammps-users] Fwd: Au Young's modulus Ray Shan
11:57 Re: [lammps-users] An inquiry about compute msd/chunk command. A. M.M
10:11 Re: [lammps-users] Compilation Error when using DFFT_FFTW3 and DFFT_SINGLE Axel Kohlmeyer
10:05 Re: [lammps-users] lammps on current AMD gpus Axel Kohlmeyer
09:35 [lammps-users] lammps on current AMD gpus Patrick Duchstein
09:29 Re: [lammps-users] An inquiry about compute msd/chunk command. Stefan Paquay
09:26 [lammps-users] Compilation Error when using DFFT_FFTW3 and DFFT_SINGLE Juri Selvåg
09:08 Re: [lammps-users] An inquiry about compute msd/chunk command. A. M.M
08:54 Re: [lammps-users] An inquiry about compute msd/chunk command. Stefan Paquay
08:49 Re: [lammps-users] An inquiry about compute msd/chunk command. A. M.M
08:41 Re: [lammps-users] reax example Axel Kohlmeyer
07:48 [lammps-users] reax example Mahmood Naderan
07:40 Re: [lammps-users] LAMMPS getting stuck in the first step when using fix balance rcb Steve Plimpton
07:38 Re: [lammps-users] An inquiry about compute msd/chunk command. Steve Plimpton
07:35 Re: [lammps-users] An inquiry about compute msd/chunk command. Stefan Paquay
07:31 Re: [lammps-users] Fw: Question of combiningcomputercluster_atomandcoord_atom command Steve Plimpton
06:15 Re: [lammps-users] An inquiry about compute msd/chunk command. A. M.M
05:35 Re: [lammps-users] Report Bugs on Topo Tool Axel Kohlmeyer
05:20 Re: [lammps-users] Fwd: different components of pot Energy are zero for ADP Axel Kohlmeyer
05:17 Re: [lammps-users] Report Bugs on Topo Tool Axel Kohlmeyer
05:02 [lammps-users] Regarding NPT ensemble Jeams Anderson
04:19 [lammps-users] Report Bugs on Topo Tool Lu Wang
03:53 [lammps-users] Fwd: different components of pot Energy are zero for ADP Anil Mangla
03:24 Re: [lammps-users] Fix style shake Mahmood Naderan
03:05 Re: [lammps-users] Overdrive tutorial Axel Kohlmeyer
03:02 Re: [lammps-users] Fix style shake Axel Kohlmeyer
02:58 Re: [lammps-users] How should I insert one molecule into the box? Wei Chen
02:52 Re: [lammps-users] Lj/cut/coul/cut vs. lj/cut/coul/long Axel Kohlmeyer
02:49 Re: [lammps-users] new stable release of LAMMPS Pascal Brault
02:43 [lammps-users] Fix style shake Mahmood Naderan
02:20 [lammps-users] Overdrive tutorial Mahmood Naderan
01:53 [lammps-users] Chemical potential and fugacity problems in fix_gcmc 周娟
01:53 Re: [lammps-users] new stable release of LAMMPS Pascal Brault
00:26 Re: [lammps-users] How should I insert one molecule into the box? Andrew Jewett
00:18 [lammps-users] Define net charge on molecule while using QEq ??????

March 20, 2018
23:42 [lammps-users] Lj/cut/coul/cut vs. lj/cut/coul/long Lu Wang
20:03 Re: [lammps-users] Fw: Question of combiningcomputercluster_atomandcoord_atom command Wade Tian
19:38 Re: [lammps-users] How should I insert one molecule into the box? chenwei
19:23 [lammps-users] LAMMPS getting stuck in the first step when using fix balance rcb wubao
17:07 Re: [lammps-users] General LJ Potential Stefan Paquay
14:49 Re: [lammps-users] Number of atoms Mahmood Naderan
14:11 Re: [lammps-users] General LJ Potential Axel Kohlmeyer
14:11 [lammps-users] Fwd: Au Young's modulus Molecular Dynamics
14:04 [lammps-users] Au Young's modulus Molecular Dynamics
14:01 [lammps-users] General LJ Potential Lu Wang
13:50 Re: [lammps-users] different components of pot Energy are zero for ADP Steve Plimpton
13:47 [lammps-users] new stable release of LAMMPS Steve Plimpton
12:54 [lammps-users] An inquiry about compute msd/chunk command. A. M.M
11:53 Re: [lammps-users] Number of atoms Axel Kohlmeyer
11:40 Re: [lammps-users] Number of atoms Mahmood Naderan
11:29 Re: [lammps-users] Number of atoms Axel Kohlmeyer
11:02 [lammps-users] Number of atoms Mahmood Naderan
10:17 Re: [lammps-users] different components of pot Energy are zero for ADP Axel Kohlmeyer
09:38 [lammps-users] different components of pot Energy are zero for ADP Anil Mangla
08:43 Re: [lammps-users] Building a Fe-Cr Lattice Input Axel Kohlmeyer
08:39 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Axel Kohlmeyer
07:58 Re: [lammps-users] Poiseuille flow - High temperature on wall atoms Steve Plimpton
07:22 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Pascal Brault
07:20 Re: [lammps-users] Building a Fe-Cr Lattice Input Morrissey, Liam S.
06:29 Re: [lammps-users] Modification of pair style Axel Kohlmeyer
06:24 Re: [lammps-users] How should I insert one molecule into the box? Axel Kohlmeyer
06:23 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Axel Kohlmeyer
04:04 [lammps-users] How should I insert one molecule into the box? chenwei
03:47 [lammps-users] Modification of pair style Nagarajan Karthik
02:51 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Pascal Brault

March 19, 2018
08:54 Re: [lammps-users] Fw: Question of combining computercluster_atomandcoord_atom command Axel Kohlmeyer
08:47 Re: [lammps-users] NPT equilibration Axel Kohlmeyer
08:34 Re: [lammps-users] Material studio to VMD Axel Kohlmeyer
08:18 Re: [lammps-users] Bond atoms missing Steve Plimpton
08:07 Re: [lammps-users] pair style lj/cut/coul/wolf ? pair style lj/cut/coul/dsf ? Steve Plimpton
06:16 [lammps-users] NPT equilibration Neda Rafiee
06:11 Re: [lammps-users] Bond atoms missing Giacomo Fiorin
05:28 Re: [lammps-users] Compute saed command - help. Emmanuel Skountzos
05:15 Re: [lammps-users] Compute saed command - help. Shawn Coleman
02:16 [lammps-users] Compute saed command - help. Emmanuel Skountzos

March 18, 2018
21:58 [lammps-users] Fw: Question of combining computercluster_atomandcoord_atom command Wade Tian
21:47 [lammps-users] Question of combining computer cluster_atomandcoord_atom command Wade
20:04 [lammps-users] Material studio to VMD Sara Mosallanejad
12:46 [lammps-users] Bond atoms missing Kara Fong
06:51 Re: [lammps-users] ADP potential and possibility of using GPU acceleration Axel Kohlmeyer

March 17, 2018
20:54 [lammps-users] Shear Stress due to frozen atoms Ayush Suhane
20:20 Re: [lammps-users] ADP potential and possibility of using GPU acceleration Yi Wang
19:29 Re: [lammps-users] pair style lj/cut/coul/wolf ? pair style lj/cut/coul/dsf ? Sridhar,S Arun Srikant
19:22 Re: [lammps-users] Dislocation Minimization Ayush Suhane
19:04 Re: [lammps-users] Mpi4py v3 Steve Plimpton
19:04 Re: [lammps-users] Dislocation Minimization Steve Plimpton
19:02 Re: [lammps-users] pair style lj/cut/coul/wolf ? pair style lj/cut/coul/dsf ? Steve Plimpton
18:56 Re: [lammps-users] Contradiction in implementation of Tersoff potential Steve Plimpton
18:53 Re: [lammps-users] Question of combining computer cluster_atom and coord_atom command Steve Plimpton
18:51 Re: [lammps-users] [EXTERNAL] Re: Incorrect forces calculated by ReaxC for uncorrected bonds Steve Plimpton
18:45 Re: [lammps-users] Dislocation Minimization Ayush Suhane
12:29 Re: [lammps-users] ADP potential and possibility of using GPU acceleration Axel Kohlmeyer
12:24 Re: [lammps-users] pair style lj/cut/coul/wolf ? pair style lj/cut/coul/dsf ? Axel Kohlmeyer
11:44 [lammps-users] ADP potential and possibility of using GPU acceleration Yi Wang
11:03 Re: [lammps-users] pair style lj/cut/coul/wolf ? pair style lj/cut/coul/dsf ? Sridhar,S Arun Srikant

March 16, 2018
20:14 [lammps-users] pair style lj/cut/coul/wolf ? pair style lj/cut/coul/dsf ? Sridhar,S Arun Srikant
15:40 Re: [lammps-users] Deleting part of the atoms Axel Kohlmeyer
15:11 Re: [lammps-users] Deleting part of the atoms Henrik Hariman
14:33 Re: [lammps-users] ERROR: All pair coeffs are not set Axel Kohlmeyer
14:05 [lammps-users] ERROR: All pair coeffs are not set SATYARANJAN BISWAL
13:36 Re: [lammps-users] script developers used for potential Axel Kohlmeyer
13:35 Re: [lammps-users] Deleting part of the atoms Axel Kohlmeyer
13:32 Re: [lammps-users] script developers used for potential Khourshaei Shar, Ali
13:31 [lammps-users] Deleting part of the atoms Henrik Hariman
13:29 Re: [lammps-users] script developers used for potential Axel Kohlmeyer
13:04 Re: [lammps-users] script developers used for potential Axel Kohlmeyer
12:47 [lammps-users] script developers used for potential Khourshaei Shar, Ali

March 15, 2018
15:59 [lammps-users] Contradiction in implementation of Tersoff potential Khourshaei Shar, Ali
08:49 Re: [lammps-users] Fwd: GPU package on Windows Axel Kohlmeyer
08:42 [lammps-users] Fwd: GPU package on Windows Cao Thang, Nguyen
08:17 Re: [lammps-users] Inelastic collisions with PD in lammps Steve Plimpton
08:13 Re: [lammps-users] Variable & non-periodic NPT Steve Plimpton
08:12 Re: [lammps-users] GPU package on Windows Axel Kohlmeyer
07:09 [lammps-users] GPU package on Windows Cao Thang, Nguyen
03:57 [lammps-users] Question of combining computer cluster_atom and coord_atom command Wade Tian

March 14, 2018
23:58 Re: [lammps-users] Variable & non-periodic NPT Anders Hafreager
23:47 Re: [lammps-users] Variable & non-periodic NPT Lamm Gro
23:16 Re: [lammps-users] Variable & non-periodic NPT Anders Hafreager
23:13 Re: [lammps-users] Variable & non-periodic NPT Lamm Gro
23:04 [lammps-users] Poiseuille flow - High temperature on wall atoms Gafoor cee pee
22:33 Re: [lammps-users] Variable & non-periodic NPT Anders Hafreager
20:08 Re: [lammps-users] Variable & non-periodic NPT Lamm Gro
14:19 [lammps-users] Inelastic collisions with PD in lammps benjamin geller
13:45 Re: [lammps-users] How to config input file for 2 LJ particles? Axel Kohlmeyer
13:31 Re: [lammps-users] How to config input file for 2 LJ particles? Axel Kohlmeyer
13:25 Re: [lammps-users] How to config input file for 2 LJ particles? Johana Nopel
13:21 Re: [lammps-users] How to config input file for 2 LJ particles? Johana Nopel
13:05 Re: [lammps-users] Building a Fe-Cr Lattice Input Axel Kohlmeyer
12:57 [lammps-users] Building a Fe-Cr Lattice Input Morrissey, Liam S.
12:52 Re: [lammps-users] How to config input file for 2 LJ particles? Axel Kohlmeyer
12:51 Re: [lammps-users] How to config input file for 2 LJ particles? Johana Nopel
12:27 Re: [lammps-users] How to config input file for 2 LJ particles? Giacomo Fiorin
12:20 Re: [lammps-users] How to config input file for 2 LJ particles? Johana Nopel
11:10 Re: [lammps-users] How to config input file for 2 LJ particles? Axel Kohlmeyer
11:03 Re: [lammps-users] Dislocation Minimization Julien Guénolé
10:59 [lammps-users] How to config input file for 2 LJ particles? dsa gsd
10:51 Re: [lammps-users] Dislocation Minimization Ayush Suhane
09:31 Re: [lammps-users] Variable & non-periodic NPT Axel Kohlmeyer
09:26 Re: [lammps-users] delete_atom / velocity loop Axel Kohlmeyer
07:20 Re: [lammps-users] Question about the calculation of extracted energy from thermostat Steve Plimpton
07:16 Re: [lammps-users] Dislocation Minimization Steve Plimpton
07:10 Re: [lammps-users] Regarding lattice command Steve Plimpton
07:07 Re: [lammps-users] delete_atom / velocity loop Steve Plimpton
06:55 Re: [lammps-users] Variable & non-periodic NPT Steve Plimpton
04:32 [lammps-users] Question about the calculation of extracted energy from thermostat Xinyu You
02:35 Re: [lammps-users] REMD restart files divyabharathi korlepara
01:33 [lammps-users] Dislocation Minimization Ayush Suhane

March 13, 2018
23:26 Re: [lammps-users] Regarding lattice command Sharma MD
23:13 Re: [lammps-users] delete_atom / velocity loop Anders Hafreager
22:53 Re: [lammps-users] Variable & non-periodic NPT Lamm Gro
21:57 Re: [lammps-users] delete_atom / velocity loop Axel Kohlmeyer
21:10 Re: [lammps-users] delete_atom / velocity loop Henrik Hariman
20:52 Re: [lammps-users] delete_atom / velocity loop Axel Kohlmeyer
19:54 Re: [lammps-users] delete_atom / velocity loop Henrik Hariman
17:56 Re: [lammps-users] delete_atom / velocity loop Steve Plimpton
17:53 Re: [lammps-users] Fixed criteria command for the energy minimum Steve Plimpton
17:52 Re: [lammps-users] Problem on deposition of oxygen molecule on iron substrate using ReaxFF potential Steve Plimpton
17:51 Re: [lammps-users] Regarding lattice command Steve Plimpton
17:49 Re: [lammps-users] Variable & non-periodic NPT Steve Plimpton
17:46 Re: [lammps-users] Question about new Fix command Steve Plimpton
15:58 Re: [lammps-users] crashes during DBH equilibration Axel Kohlmeyer
15:55 Re: [lammps-users] crashes during DBH equilibration Robert Hoy
15:55 Re: [lammps-users] create_bonds with style single/improper Axel Kohlmeyer
15:50 [lammps-users] delete_atom / velocity loop Henrik Hariman
15:17 Re: [lammps-users] create_bonds with style single/improper Bernard ROUSSEAU
14:20 Re: [lammps-users] create_bonds with style single/improper Axel Kohlmeyer
13:27 [lammps-users] Fixed criteria command for the energy minimum Granite Tait
12:21 Re: [lammps-users] create_bonds with style single/improper Axel Kohlmeyer
12:16 Re: [lammps-users] Importance of shake Axel Kohlmeyer
12:15 [lammps-users] create_bonds with style single/improper Bernard ROUSSEAU
11:34 [lammps-users] Regarding lattice command Sharma MD
10:48 [lammps-users] Importance of shake Lu Wang
10:23 Re: [lammps-users] Problem on deposition of oxygen molecule on iron substrate using ReaxFF potential Mehrdad Mirzaei
10:15 [lammps-users] Problem on deposition of oxygen molecule on iron substrate using ReaxFF potential Mehrdad Mirzaei
10:07 Re: [lammps-users] Very Small Parameters Axel Kohlmeyer
10:05 Re: [lammps-users] Very Small Parameters Lu Wang
10:01 Re: [lammps-users] Very Small Parameters Axel Kohlmeyer
09:59 Re: [lammps-users] 答复: How to insert interstitial atoms in a 'side out' reigon Axel Kohlmeyer
09:58 Re: [lammps-users] Very Small Parameters Lu Wang
09:58 Re: [lammps-users] 答复: How to insert interstitial atoms in a 'side out' reigon Axel Kohlmeyer
09:53 Re: [lammps-users] REMD restart files Axel Kohlmeyer
09:48 Re: [lammps-users] Very Small Parameters Axel Kohlmeyer
09:45 Re: [lammps-users] Very Small Parameters Giacomo Fiorin
01:40 [lammps-users] Variable & non-periodic NPT Lamm Gro
01:29 [lammps-users] Question about new Fix command Wade Tian
01:15 [lammps-users] REMD restart files divyabharathi korlepara
00:23 [lammps-users] Very Small Parameters Lu Wang
00:16 [lammps-users] (no subject) Lu Wang

March 12, 2018
20:19 [lammps-users] 答复: How to insert interstitial atoms in a 'side out' reigon Peter Chu
18:16 Re: [lammps-users] Coarse grained (mW) water-graphene system Giacomo Fiorin
15:20 Re: [lammps-users] "ERROR: Not all per-type masses are set" whenusing molecule command inserting TIP4P water molecule Axel Kohlmeyer
15:10 Re: [lammps-users] [EXTERNAL] Re: Incorrect forces calculated by ReaxC for uncorrected bonds Tomáš Trnka
12:51 Re: [lammps-users] How to insert interstitial atoms in a 'side out' reigon Axel Kohlmeyer
12:49 Re: [lammps-users] [EXTERNAL] Re: Incorrect forces calculated by ReaxC for uncorrected bonds Tomáš Trnka
12:08 Re: [lammps-users] [EXTERNAL] Re: Incorrect forces calculated by ReaxC for uncorrected bonds Thompson, Aidan
11:38 [lammps-users] Coarse grained (mW) water-graphene system Shuang LUO
11:31 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Steve Plimpton
11:23 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds H. Metin Aktulga
11:16 Re: [lammps-users] cooling due to heat transfer Steve Plimpton
11:14 Re: [lammps-users] displacement Steve Plimpton
11:08 Re: [lammps-users] Segmentation fault with GCMC Axel Kohlmeyer
10:32 Re: [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Axel Kohlmeyer
09:58 [lammps-users] Segmentation fault with GCMC Tran Le
08:21 Re: [lammps-users] installing lamps Pascal Brault
08:08 Re: [lammps-users] installing lamps Axel Kohlmeyer
07:58 Re: [lammps-users] installing lamps Pascal Brault
06:24 [lammps-users] Incorrect forces calculated by ReaxC for uncorrected bonds Tomáš Trnka
06:18 Re: [lammps-users] The simulation crashes but I don't gey any error message Giacomo Fiorin
04:21 Re: [lammps-users] meam file format Axel Kohlmeyer
03:11 [lammps-users] meam file format 柳子凡
03:00 Re: [lammps-users] Minimization of multi-layered graphene Mockele Nkrumah
02:57 Re: [lammps-users] Minimization of multi-layered graphene Mockele Nkrumah
02:09 [lammps-users] How to insert interstitial atoms in a 'side out' reigon Peter Chu

March 11, 2018
21:47 Re: [lammps-users] Incorrect args for pair coefficients (../pair_meamc.cpp:213) Axel Kohlmeyer
20:58 [lammps-users] Incorrect args for pair coefficients (../pair_meamc.cpp:213) 柳子凡
19:05 Re: [lammps-users] Query Majid Shahbabaei
17:22 Re: [lammps-users] Compute indent force in peri atom_style Axel Kohlmeyer
14:43 [lammps-users] Compute indent force in peri atom_style rushi gite
11:20 Re: [lammps-users] Thermal Conductivity of CNT Ray Shan
08:22 Re: [lammps-users] "ERROR: Not all per-type masses are set" when using molecule command inserting TIP4P water molecule Axel Kohlmeyer
08:19 Re: [lammps-users] Minimization of multi-layered graphene Axel Kohlmeyer
08:15 Re: [lammps-users] Pressure values for liquid Ar L-J interaction Axel Kohlmeyer
00:27 Re: [lammps-users] Thermal Conductivity of CNT sudhansu srivastava

March 10, 2018
23:22 [lammps-users] Pressure values for liquid Ar L-J interaction Ankit Mishra
22:39 Re: [lammps-users] Thermal Conductivity of CNT Ray Shan
12:27 [lammps-users] Young's modulus Jim Jones
09:11 [lammps-users] Minimization of multi-layered graphene Mockele Nkrumah
05:39 [lammps-users] Thermal Conductivity of CNT sudhansu srivastava
05:08 [lammps-users] The simulation crashes but I don't gey any error message Rafael Maglia
05:04 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
04:32 [lammps-users] "ERROR: Not all per-type masses are set" when using molecule command inserting TIP4P water molecule ??????
04:30 [lammps-users] fix langevin and diffisivity Bo Gong

March 09, 2018
19:25 Re: [lammps-users] Fwd: simulation of magnetic dipoles Steve Plimpton
19:22 Re: [lammps-users] how is this *.eam.alloy-file in setfl format? Steve Plimpton
15:26 Re: [lammps-users] cooling due to heat transfer Qiangqiang Sun
15:24 [lammps-users] displacement Jim Jones
15:10 Re: [lammps-users] installing lamps Pascal Brault
14:58 Re: [lammps-users] cooling due to heat transfer Axel Kohlmeyer
14:54 Re: [lammps-users] installing lamps Axel Kohlmeyer
14:53 [lammps-users] cooling due to heat transfer Qiangqiang Sun
14:48 Re: [lammps-users] installing lamps Pascal Brault
14:38 Re: [lammps-users] installing lamps Axel Kohlmeyer
13:14 Re: [lammps-users] Regd. TiO2 nanorod equilibriation crash Axel Kohlmeyer
11:16 [lammps-users] Regd. TiO2 nanorod equilibriation crash ABHINAV SHUKLA
09:42 [lammps-users] installing lamps Pascal Brault
09:33 Re: [lammps-users] problem with boundary or velocity command Axel Kohlmeyer
09:25 Re: [lammps-users] [EXTERNAL] Re: NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Thompson, Aidan
08:37 Re: [lammps-users] problem with boundary or velocity command bahman daneshian
08:32 Re: [lammps-users] Charge differences restarting qeq run Michael Humbert
08:32 Re: [lammps-users] question about iso keywork in fix npt command Steve Plimpton
08:28 Re: [lammps-users] Charge differences restarting qeq run Steve Plimpton
08:24 Re: [lammps-users] problem with boundary or velocity command Steve Plimpton
07:33 Re: [lammps-users] Query Agilio Padua
07:25 Re: [lammps-users] NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Giacomo Fiorin
06:58 Re: [lammps-users] Query Axel Kohlmeyer
06:17 Re: [lammps-users] crashes during DBH equilibration Axel Kohlmeyer
05:58 [lammps-users] crashes during DBH equilibration Robert Hoy
04:53 Re: [lammps-users] Access cutoff+skin from within a fix Anders Hafreager
04:25 [lammps-users] Access cutoff+skin from within a fix Frank Zack
02:58 Re: [lammps-users] problem with boundary or velocity command bahman daneshian
01:54 [lammps-users] NPT with anisotropic cell fluctuations: conserved quantity and ensemble sampling Steven Vandenbrande
00:59 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Nagarajan Karthik

March 08, 2018
13:37 Re: [lammps-users] Update a chunk compute Khalid Abdelaziz
12:49 Re: [lammps-users] lammps for sandbox simulation Stefan Paquay
12:42 [lammps-users] lammps for sandbox simulation Irwandi Nurdin
12:19 Re: [lammps-users] Update a chunk compute Axel Kohlmeyer
11:11 Re: [lammps-users] Interatomic potential preference Stefan Paquay
10:17 Re: [lammps-users] Update a chunk compute Khalid Abdelaziz
08:49 Re: [lammps-users] Update a chunk compute Axel Kohlmeyer
08:24 Re: [lammps-users] Update a chunk compute Khalid Abdelaziz
08:00 Re: [lammps-users] Interatomic potential preference Steve Plimpton
07:59 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Steve Plimpton
07:57 Re: [lammps-users] problem with boundary or velocity command Steve Plimpton
07:57 Re: [lammps-users] Update a chunk compute Steve Plimpton
07:53 [lammps-users] Interatomic potential preference Khourshaei Shar, Ali
05:27 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Nagarajan Karthik
05:19 Re: [lammps-users] Help Axel Kohlmeyer
03:30 Re: [lammps-users] problem with boundary or velocity command bahman daneshian
02:36 [lammps-users] shear stresses are different from liquid and sliding slab Hongyu Gao

March 07, 2018
22:29 [lammps-users] Help GOPIKA MUKUNDAN
18:57 [lammps-users] Query Majid Shahbabaei
13:53 [lammps-users] Update a chunk compute Khalid Abdelaziz
11:55 Re: [lammps-users] Energy Statics Eng
11:32 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Axel Kohlmeyer
11:17 Re: [lammps-users] water data file creation in windows Ray Shan
09:38 Re: [lammps-users] creating molecules Axel Kohlmeyer
09:34 Re: [lammps-users] Mpi4py v3 Axel Kohlmeyer
08:27 Re: [lammps-users] problem with boundary or velocity command Steve Plimpton
08:16 Re: [lammps-users] water data file creation in windows Stefan Paquay
07:54 Re: [lammps-users] Performance Variability in LAMMPS Abid Muslim Malik
07:33 [lammps-users] water data file creation in windows Sara Mosallanejad
06:04 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Nagarajan Karthik

March 06, 2018
22:11 [lammps-users] creating molecules Pengyu Huang
15:26 [lammps-users] Mpi4py v3 Noam Bernstein
14:19 Re: [lammps-users] Meso-scale Polarizable Model Axel Kohlmeyer
13:42 Re: [lammps-users] Performance Variability in LAMMPS Axel Kohlmeyer
12:39 [lammps-users] Performance Variability in LAMMPS Abid Muslim Malik
12:31 Re: [lammps-users] Elements order in pair_coeff for MEAM Steve Plimpton
11:48 Re: [lammps-users] Elements order in pair_coeff for MEAM Julien Guénolé
11:23 Re: [lammps-users] Elements order in pair_coeff for MEAM Axel Kohlmeyer
11:10 Re: [lammps-users] Energy Axel Kohlmeyer
10:41 Re: [lammps-users] Energy Statics Eng
10:40 [lammps-users] Meso-scale Polarizable Model Joshua Cordon
10:27 [lammps-users] problem with boundary or velocity command bahman daneshian
10:15 Re: [lammps-users] Displacing type of atoms if condition is met Pascal Brault
09:57 Re: [lammps-users] Elements order in pair_coeff for MEAM Julien Guénolé
09:45 Re: [lammps-users] Elements order in pair_coeff for MEAM Axel Kohlmeyer
08:19 Re: [lammps-users] How to add magnetic field in lammps Steve Plimpton
08:17 Re: [lammps-users] apply electric field on ellipsoids(without charge) Steve Plimpton
08:14 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Steve Plimpton
07:40 [lammps-users] Convective heat transfer in a 2D nanochanel Qiangqiang Sun
07:28 Re: [lammps-users] Modifying atom properties of clustered system Imanuel Kristanto
06:50 Re: [lammps-users] Modifying atom properties of clustered system Axel Kohlmeyer
06:11 Re: [lammps-users] Modifying atom properties of clustered system Imanuel Kristanto
05:43 Re: [lammps-users] Modifying atom properties of clustered system Axel Kohlmeyer
03:14 Re: [lammps-users] Problem in calculating thermal conductivity Chilakalapudi, Syamal Praneeth (INT)
01:27 Re: [lammps-users] Problem in calculating thermal conductivity Michał Kański
01:20 [lammps-users] Problem in calculating thermal conductivity Barnali Bhattacharya

March 05, 2018
21:58 Re: [lammps-users] apply electric field on ellipsoids(without charge) Vikas Kumar
21:20 Re: [lammps-users] Modifying atom properties of clustered system Imanuel Kristanto
19:35 Re: [lammps-users] How to specify Cu(111) surface as deposition surface Torotot Boy
18:48 Re: [lammps-users] Modifying atom properties of clustered system Axel Kohlmeyer
16:30 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Nagarajan Karthik
15:17 Re: [lammps-users] Convective heat transfer in a 2D nanochanel Eric Murphy
13:12 Re: [lammps-users] Langevin dynamics Eivind Bering
11:49 Re: [lammps-users] Langevin dynamics Stefan Paquay
10:56 Re: [lammps-users] Convective heat transfer in a 2D nanochanel Eric Murphy
10:34 Re: [lammps-users] regarding strain calculation Julien Guénolé
10:27 Re: [lammps-users] Bug Report on the log file Axel Kohlmeyer
10:23 [lammps-users] Bug Report on the log file Lu Wang
10:08 [lammps-users] Langevin dynamics Eivind Bering
08:55 Re: [lammps-users] regarding strain calculation bahman daneshian
08:54 Re: [lammps-users] apply electric field on ellipsoids(without charge) Steve Plimpton
08:48 Re: [lammps-users] How to specify Cu(111) surface as deposition surface Steve Plimpton
08:45 Re: [lammps-users] apply electric field on ellipsoids(without charge) Axel Kohlmeyer
08:44 Re: [lammps-users] Implementation of novel boundary conditions in LAMMPS Steve Plimpton
08:42 Re: [lammps-users] apply electric field on ellipsoids(without charge) Steve Plimpton
08:35 Re: [lammps-users] Fwd: Error in parallel GCMC simulation Steve Plimpton
08:32 Re: [lammps-users] regarding strain calculation Steve Plimpton
08:32 Re: [lammps-users] regarding strain calculation Julien Guénolé
08:22 Re: [lammps-users] Elements order in pair_coeff for MEAM Julien Guénolé
07:41 Re: [lammps-users] MEAM problem Julien Guénolé
06:38 [lammps-users] MEAM problem 柳子凡
02:40 [lammps-users] How to specify Cu(111) surface as deposition surface Torotot Boy
00:41 Re: [lammps-users] measuring electrophoretic heating Axel Kohlmeyer

March 04, 2018
23:25 Re: [lammps-users] pair_style hybrid reax/c lj/cut Anders Hafreager
23:20 [lammps-users] measuring electrophoretic heating Manoj Dhiman
23:14 Re: [lammps-users] Regd. TiO2 interatomic potential ABHINAV SHUKLA
22:56 Re: [lammps-users] Regd. TiO2 interatomic potential Pascal Brault
22:17 [lammps-users] Modifying atom properties of clustered system Imanuel Kristanto
21:48 [lammps-users] pair_style hybrid reax/c lj/cut Ankit Mishra
18:47 [lammps-users] Regd. TiO2 interatomic potential ABHINAV SHUKLA
17:12 [lammps-users] Implementation of novel boundary conditions in LAMMPS Nagarajan Karthik
09:04 Re: [lammps-users] apply electric field on ellipsoids(without charge) Axel Kohlmeyer
08:06 [lammps-users] apply electric field on ellipsoids(without charge) Vikas Kumar
03:53 [lammps-users] Fwd: Estimation on computational capacity Axel Kohlmeyer
00:43 Re: [lammps-users] Estimation on computational capacity Axel Kohlmeyer
00:27 [lammps-users] Estimation on computational capacity Amir Hossein Saeedi
00:19 Re: [lammps-users] Energy Axel Kohlmeyer
00:16 Re: [lammps-users] Energy Anders Hafreager

March 03, 2018
22:53 Re: [lammps-users] Converting multiple restart file to a datafile Axel Kohlmeyer
22:50 Re: [lammps-users] Energy Axel Kohlmeyer
10:34 [lammps-users] Energy Statics Eng

March 02, 2018
13:27 [lammps-users] TUTORIAL: "Modeling Supra-molecular Structures with LAMMPS" - JULY 9-13 Giacomo Fiorin
11:03 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Steve Plimpton
07:28 [lammps-users] Converting multiple restart file to a datafile Lu Wang
05:14 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Michael Lamparski
05:06 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Axel Kohlmeyer
02:43 [lammps-users] regarding strain calculation bahman daneshian

March 01, 2018
23:18 Re: [lammps-users] Fwd: Error in parallel GCMC simulation Mengzi Zhou
10:29 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Michael Lamparski
10:08 Re: [lammps-users] [chibaf/lammps-22Feb18] fatal error: 'Eigen/Eigen' file not found (#1) CHIBAFumihiro
09:36 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Markus Höhnerbach
08:54 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Steve Plimpton
08:46 Re: [lammps-users] Quasi-static stretching at 0K Steve Plimpton
08:44 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Steve Plimpton
08:37 Re: [lammps-users] ERROR on proc 0: Out of range atoms - cannot compute PPPM (../pppm.cpp:1937) Joanna Rudzka
07:38 Re: [lammps-users] Temperature profile for 2D flow Eric Murphy
07:31 [lammps-users] Elements order in pair_coeff for MEAM Julien Guénolé
07:31 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Axel Kohlmeyer
06:52 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Michael Lamparski
03:55 [lammps-users] Temperature profile for 2D flow Qiangqiang Sun
01:49 Re: [lammps-users] dump molfile Axel Kohlmeyer
01:45 [lammps-users] dump molfile Lu Wang
01:23 Re: [lammps-users] Fwd: Error in parallel GCMC simulation Anders Hafreager
01:13 [lammps-users] Fwd: Error in parallel GCMC simulation Mengzi Zhou
00:11 Re: [lammps-users] Missing Atoms When Using Restart File with PBC Axel Kohlmeyer

February 28, 2018
23:29 Re: [lammps-users] Fixing LAMMPS' thread-safety issues Axel Kohlmeyer
23:00 [lammps-users] Fixing LAMMPS' thread-safety issues Michael Lamparski
22:03 [lammps-users] How to calculate edge energy of 2D monolayer? Md. Imrul Reza Shishir
15:39 [lammps-users] Missing Atoms When Using Restart File with PBC Deangelis, Alfred N
11:19 Re: [lammps-users] Potential for Carbon-Nitrogen interaction. Ray Shan
11:02 Re: [lammps-users] LATTE installation problem Fernando Yrazu
10:16 Re: [lammps-users] Avoiding division by zero Khalid Abdelaziz
10:01 Re: [lammps-users] Potential for Carbon-Nitrogen interaction. Pascal Brault
09:52 [lammps-users] Potential for Carbon-Nitrogen interaction. Md. Imrul Reza Shishir
09:34 [lammps-users] Group Leader Position in Computational Materials Science Bitzek, Erik
09:24 Re: [lammps-users] LATTE installation problem Axel Kohlmeyer
09:14 Re: [lammps-users] Avoiding division by zero Jan Fikar
09:12 Re: [lammps-users] ERROR on proc 0: Out of range atoms - cannot compute PPPM (../pppm.cpp:1937) Axel Kohlmeyer
09:08 [lammps-users] Avoiding division by zero Khalid Abdelaziz
08:58 Re: [lammps-users] ERROR on proc 0: Out of range atoms - cannot compute PPPM (../pppm.cpp:1937) Joanna Rudzka
08:36 Re: [lammps-users] Intel package Steve Plimpton
08:34 Re: [lammps-users] problem in the output dump file particles coordinates exceeding the box length Steve Plimpton
08:33 Re: [lammps-users] ERROR on proc 0: Out of range atoms - cannot compute PPPM (../pppm.cpp:1937) Steve Plimpton
08:07 Re: [lammps-users] Free HPC Cluster Titusi Forum

February 27, 2018
17:35 [lammps-users] LATTE installation problem Fernando Yrazu
14:11 Re: [lammps-users] lammps_spc/e water Cunzhi Zhang
12:57 Re: [lammps-users] NEB Emile Maras
11:57 Re: [lammps-users] How to redirect screen output when running lammps from Python Axel Kohlmeyer
11:52 Re: [lammps-users] How to redirect screen output when running lammps from Python Giacomo Fiorin
11:48 Re: [lammps-users] Is it possible to deform the simulation box in certain direction without changing the volume of the box? Axel Kohlmeyer
11:42 [lammps-users] Is it possible to deform the simulation box in certain direction without changing the volume of the box? Wusheng Zhang
11:41 Re: [lammps-users] NEB Axel Kohlmeyer
11:37 Re: [lammps-users] NEB Leila Khalili
11:35 Re: [lammps-users] lammps_spc/e water Axel Kohlmeyer
11:20 Re: [lammps-users] How to redirect screen output when running lammps from Python Axel Kohlmeyer
11:13 Re: [lammps-users] How to redirect screen output when running lammps from Python Giacomo Fiorin
10:52 Re: [lammps-users] Intel package Axel Kohlmeyer
10:43 Re: [lammps-users] lammps_spc/e water Khalid Abdelaziz
10:39 Re: [lammps-users] Lammps for beginner Axel Kohlmeyer
10:39 Re: [lammps-users] Lammps for beginner Axel Kohlmeyer
10:38 Re: [lammps-users] using fix property/atom with write/read_restart Axel Kohlmeyer
10:36 [lammps-users] Lammps for beginner Sandeep Kumar Singh
10:34 [lammps-users] Lammps for beginner Sandeep Kumar Singh
09:54 [lammps-users] using fix property/atom with write/read_restart Quang Ha
09:33 Re: [lammps-users] NEB Axel Kohlmeyer
08:28 [lammps-users] problem in the output dump file particles coordinates exceeding the box length Nandlal Pingua
08:17 Re: [lammps-users] ERROR on proc 0: Out of range atoms - cannot compute PPPM (../pppm.cpp:1937) Joanna Rudzka
07:29 [lammps-users] ERROR on proc 0: Out of range atoms - cannot compute PPPM (../pppm.cpp:1937) Joanna Rudzka

February 26, 2018
19:58 [lammps-users] Intel package kimia montazeri
14:37 [lammps-users] NEB Leila Khalili

February 24, 2018
13:49 [lammps-users] Lammps on macOS - installing lammps-22Feb18 on macOS High Sierra CHIBAFumihiro
11:59 Re: [lammps-users] How to confine argon particles in a T-region with periodic boundary conditions Axel Kohlmeyer
11:24 Re: [lammps-users] Ubuntu executables Giacomo Fiorin
11:17 Re: [lammps-users] Error in parallel GCMC simulation Steve Plimpton
11:15 Re: [lammps-users] How to confine argon particles in a T-region with periodic boundary conditions Steve Plimpton
11:10 Re: [lammps-users] Inquiry on Uses of Bond_styles Steve Plimpton
11:05 Re: [lammps-users] A question about USER-INTEL package in LAMMPS Steve Plimpton
11:00 Re: [lammps-users] Thermal Conductivity - Green-kubo Steve Plimpton
10:58 Re: [lammps-users] Quasi-static stretching at 0K Steve Plimpton
10:54 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Steve Plimpton
06:12 Re: [lammps-users] Adding Hydrogen Atoms to a Box of Aluminum Axel Kohlmeyer
06:05 Re: [lammps-users] A question about USER-INTEL package in LAMMPS Axel Kohlmeyer
05:59 Re: [lammps-users] Expected integer parameter in input script or data file (../improper_cvff.cpp:304) Axel Kohlmeyer
03:43 [lammps-users] Ubuntu executables Rajesh
02:17 [lammps-users] A question about USER-INTEL package in LAMMPS Huang
01:36 Re: [lammps-users] [EXTERNAL] High pressure in simulation of carbon nano-particle inside water. Manoj Dhiman

February 23, 2018
17:15 Re: [lammps-users] deformation in copper walls m n
16:46 [lammps-users] Expected integer parameter in input script or data file (../improper_cvff.cpp:304) Granite Tait
16:29 Re: [lammps-users] Some common sense question Axel Kohlmeyer
16:22 Re: [lammps-users] deformation in copper walls Axel Kohlmeyer
16:11 Re: [lammps-users] Multiple read_data. Axel Kohlmeyer
14:46 Re: [lammps-users] Some common sense question Chuanxing Zhan
14:36 [lammps-users] Multiple read_data. Felipe Pérez
12:29 Re: [lammps-users] deformation in copper walls Giacomo Fiorin
12:24 Re: [lammps-users] deformation in copper walls m n
12:17 Re: [lammps-users] Adding Hydrogen Atoms to a Box of Aluminum Morrissey, Liam S.
12:15 Re: [lammps-users] deformation in copper walls Giacomo Fiorin
11:53 Re: [lammps-users] deformation in copper walls m n
10:54 Re: [lammps-users] deformation in copper walls Giacomo Fiorin
10:47 Re: [lammps-users] deformation in copper walls m n
10:40 Re: [lammps-users] deformation in copper walls Giacomo Fiorin
10:35 [lammps-users] deformation in copper walls m n
09:29 Re: [lammps-users] Thermal Conductivity - Green-kubo Faraz Saleem
08:35 Re: [lammps-users] read_data for a stress strain curve Axel Kohlmeyer
08:28 Re: [lammps-users] read_data for a stress strain curve Morrissey, Liam S.
08:27 Re: [lammps-users] Adding Hydrogen Atoms to a Box of Aluminum Axel Kohlmeyer
07:38 Re: [lammps-users] Adding Hydrogen Atoms to a Box of Aluminum Morrissey, Liam S.
02:33 Re: [lammps-users] Stress Strain Plot from read data Axel Kohlmeyer
02:33 Re: [lammps-users] Adding Hydrogen Atoms to a Box of Aluminum Axel Kohlmeyer
02:31 Re: [lammps-users] Some common sense question Axel Kohlmeyer
02:26 Re: [lammps-users] read_data for a stress strain curve Axel Kohlmeyer

February 22, 2018
21:19 Re: [lammps-users] Water Andrew Jewett
20:56 Re: [lammps-users] LAMMPS Dihedral_table question Andrew Jewett
20:19 Re: [lammps-users] Obtaining Specific Output for Dihedral Angle Values Andrew Jewett
16:11 [lammps-users] Some common sense question Chuanxing Zhan
16:08 [lammps-users] Quasi-static stretching at 0K Bingyu Cui
15:14 [lammps-users] read_data for a stress strain curve Morrissey, Liam S.
13:02 Re: [lammps-users] Is it possible to add an indidual atom to a lattice Ray Shan
12:55 Re: [lammps-users] Is it possible to add an indidual atom to a lattice Ray Shan
11:46 [lammps-users] Is it possible to add an indidual atom to a lattice Morrissey, Liam S.
06:59 [lammps-users] Obtaining Specific Output for Dihedral Angle Values Charles Belina
06:54 Re: [lammps-users] surface defect in multi-layer system of different metals Vijay Reddy
06:37 Re: [lammps-users] Water Wahab Mirco
05:59 Re: [lammps-users] Water Stefan Paquay
03:28 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Axel Kohlmeyer
03:11 [lammps-users] Water Mehran Tohidi

February 21, 2018
17:09 Re: [lammps-users] bond-angle-Dihedral Coeffs Andrew Jewett
12:37 Re: [lammps-users] bond-angle-Dihedral Coeffs Giacomo Fiorin
12:14 Re: [lammps-users] Issue Replicating Energy Vol Curves with COMB potential for HfO2 systems Ray Shan
11:26 [lammps-users] bond-angle-Dihedral Coeffs Henrik Hariman
11:14 [lammps-users] Stress Strain Plot from read data Morrissey, Liam S.
11:09 [lammps-users] Adding Hydrogen Atoms to a Box of Aluminum Morrissey, Liam S.
11:08 Re: [lammps-users] Wrong data file generated by charmm2lammps.pl and also by vmd topotools for Alanine dipeptide Axel Kohlmeyer
10:00 Re: [lammps-users] xmgrace log lammps Steve Plimpton
09:59 Re: [lammps-users] HPC Axel Kohlmeyer
09:58 Re: [lammps-users] surface defect in multi-layer system of different metals Steve Plimpton
09:54 Re: [lammps-users] doing precise calculation while sampling trajectories Steve Plimpton
09:44 Re: [lammps-users] HPC Hao Chen
09:42 [lammps-users] Issue Replicating Energy Vol Curves with COMB potential for HfO2 systems Jonathan Kaufman
08:05 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS ouyang
07:40 [lammps-users] HPC Amir Hossein Saeedi
05:11 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Andrew Rohskopf
04:41 [lammps-users] HPC Lu Wang
04:10 Re: [lammps-users] Wrong data file generated by charmm2lammps.pl and also by vmd topotools for Alanine dipeptide Madhur Aggarwal
01:16 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS ouyang
01:02 Re: [lammps-users] Radiation damage in core shell Axel Kohlmeyer

February 20, 2018
16:54 Re: [lammps-users] surface defect in multi-layer system of different metals Andrew Jewett
12:44 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Andrew Rohskopf
12:15 Re: [lammps-users] surface defect in multi-layer system of different metals Axel Kohlmeyer
11:50 Re: [lammps-users] Radiation damage in core shell Steve Plimpton
11:47 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Steve Plimpton
11:40 Re: [lammps-users] How can finds the index number of particular atoms after equilibration Steve Plimpton
11:34 Re: [lammps-users] Question on compute temp and compute temp/deform Steve Plimpton
11:30 Re: [lammps-users] How to redirect lammps screen output when running in Python Steve Plimpton
10:42 [lammps-users] Free HPC Cluster Lu Wang
09:11 Re: [lammps-users] Lammps related workshop in 2018 summer ? Dezhao Huang
08:49 Re: [lammps-users] Lammps related workshop in 2018 summer ? Giacomo Fiorin
08:12 Re: [lammps-users] orientorder/atom dot product histogram Abdullah Alateeqi
08:02 [lammps-users] doing precise calculation while sampling trajectories Murray Daw
07:14 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS ouyang
06:53 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Huang
06:36 [lammps-users] surface defect in multi-layer system of different metals Vijay Reddy
05:55 Re: [lammps-users] How can finds the index number of particular atoms after equilibration Axel Kohlmeyer
04:11 Re: [lammps-users] Hysteresis in a peridynamics indentation simulation Axel Kohlmeyer
03:59 Re: [lammps-users] Question on compute temp and compute temp/deform Axel Kohlmeyer
03:57 Re: [lammps-users] orientorder/atom dot product histogram Axel Kohlmeyer
03:37 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Axel Kohlmeyer
03:24 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Huang
03:08 Re: [lammps-users] newton pair on Axel Kohlmeyer
03:06 Re: [lammps-users] Wrong data file generated by charmm2lammps.pl and also by vmd topotools for Alanine dipeptide Axel Kohlmeyer
03:01 Re: [lammps-users] question about LAMMPS Axel Kohlmeyer
02:56 Re: [lammps-users] How to redirect lammps screen output when running in Python Axel Kohlmeyer
02:53 Re: [lammps-users] non-neutral system Axel Kohlmeyer
02:52 Re: [lammps-users] non-neutral system Axel Kohlmeyer
02:44 Re: [lammps-users] installing lammps on ubuntu Axel Kohlmeyer
01:46 [lammps-users] installing lammps on ubuntu Ali Akbar
01:07 Re: [lammps-users] non-neutral system Andrew Jewett
00:44 [lammps-users] Hysteresis in a peridynamics indentation simulation JARED RIVERA

February 19, 2018
23:58 Re: [lammps-users] Wrong data file generated by charmm2lammps.pl and also by vmd topotools for Alanine dipeptide Madhur Aggarwal
23:07 Re: [lammps-users] Creating a water box using lammps perl script Prasad Rama
20:13 [lammps-users] How to redirect lammps screen output when running in Python anyy zsj
19:18 [lammps-users] question about LAMMPS 정대웅
17:50 Re: [lammps-users] Creating a water box using lammps perl script Andrew Jewett
17:02 Re: [lammps-users] Thermal Conductivity - Green-kubo Argon Example Andrew Rohskopf
16:51 Re: [lammps-users] Thermal Conductivity - Green-kubo Argon Example Andrew Rohskopf
15:55 Re: [lammps-users] Buckingham potential Stefan Paquay
15:15 [lammps-users] non-neutral system Jo
14:56 Re: [lammps-users] Thermal Conductivity - Green-kubo Deangelis, Alfred N
14:23 [lammps-users] Thermal Conductivity - Green-kubo Faraz Saleem
14:10 Re: [lammps-users] Running on Multiple GPU Axel Kohlmeyer
13:09 Re: [lammps-users] Buckingham potential Faraz Saleem
13:07 [lammps-users] newton pair on kimia montazeri
11:31 Re: [lammps-users] Set two atom types for O and H in one system Shiwei Zhang
11:13 [lammps-users] Thermal Conductivity - Green-kubo Argon Example Faraz Saleem
10:30 Re: [lammps-users] How can finds the index number of particular atoms after equilibration Andrew Jewett
09:01 [lammps-users] how to modify msi2lmp tool to create data files with atom_style charge Ευάγγελος Βογιατζής
07:39 [lammps-users] How to redirect screen output when running lammps from Python anyy zsj
03:54 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS ouyang
03:47 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Birva Patel
01:32 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Axel Kohlmeyer

February 18, 2018
22:28 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Birva Patel
22:11 Re: [lammps-users] Compute cluster/atom error on LAMMPS Windows version (latest patch 5Feb18) Imanuel Kristanto
22:01 [lammps-users] Running on Multiple GPU Lu Wang
19:44 [lammps-users] How can finds the index number of particular atoms after equilibration Jeams Anderson
16:10 [lammps-users] Question on compute temp and compute temp/deform Timothy John O'Sullivan
12:47 [lammps-users] lammps_spc/e water Cunzhi Zhang
11:01 Re: [lammps-users] Pressure Calculation , Reax/c Michał Kański
00:50 [lammps-users] How can finds the index number of particular atoms after equilibration Jeams Anderson
00:27 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Axel Kohlmeyer
00:08 [lammps-users] orientorder/atom dot product histogram Abdullah Alateeqi

February 17, 2018
22:41 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Birva Patel

February 16, 2018
23:04 [lammps-users] Radiation damage in core shell hossain khan
21:46 [lammps-users] Thermal Conductivity - Green-kubo Argon Example Faraz Saleem
20:04 [lammps-users] Lammps related workshop in 2018 summer ? Dezhao Huang
11:30 Re: [lammps-users] Pressure Calculation , Reax/c Ray Shan
09:31 Re: [lammps-users] Pressure Calculation , Reax/c Axel Kohlmeyer
09:24 Re: [lammps-users] Pressure Calculation , Reax/c Dundar Yilmaz
08:41 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Axel Kohlmeyer
07:48 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS ouyang
07:36 Re: [lammps-users] question about LAMMPS Murray Daw
07:04 [lammps-users] Creating a water box using lammps perl script Prasad Rama
02:30 Re: [lammps-users] Cluster size distribution Axel Kohlmeyer
02:22 Re: [lammps-users] Pressure Calculation , Reax/c Axel Kohlmeyer
02:20 Re: [lammps-users] Calculating drift velocity Axel Kohlmeyer
02:18 [lammps-users] Cluster size distribution Manish Anand
02:17 Re: [lammps-users] question about LAMMPS Axel Kohlmeyer
02:09 Re: [lammps-users] Pair style hybrid - more than one type of water molecule Axel Kohlmeyer
02:07 Re: [lammps-users] Set two atom types for O and H in one system Axel Kohlmeyer
01:57 Re: [lammps-users] getting result nan in output file Axel Kohlmeyer
01:51 Re: [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Axel Kohlmeyer
01:49 Re: [lammps-users] Fix atoms Axel Kohlmeyer
01:46 Re: [lammps-users] Viscosity Calculation using in.wall.2d Axel Kohlmeyer
01:30 Re: [lammps-users] xmgrace log lammps Axel Kohlmeyer
01:24 Re: [lammps-users] core shell Axel Kohlmeyer
01:17 Re: [lammps-users] error in lammps input script Axel Kohlmeyer
01:13 Re: [lammps-users] next stable version Axel Kohlmeyer
01:09 Re: [lammps-users] Charge differences restarting qeq run Axel Kohlmeyer
01:00 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Axel Kohlmeyer
00:58 [lammps-users] mailing list interruption Axel Kohlmeyer

February 15, 2018
22:15 [lammps-users] Pressure Calculation , Reax/c Dundar Yilmaz
21:32 [lammps-users] Cluster size distribution Manish Anand
18:20 [lammps-users] Set two atom types for O and H in one system Shiwei Zhang
15:12 [lammps-users] question about LAMMPS Murray Daw
14:13 [lammps-users] Pair style hybrid - more than one type of water molecule kimia montazeri
13:13 Re: [lammps-users] Charge differences restarting qeq run Michael Humbert
10:15 [lammps-users] next stable version Scott Brozell
03:29 [lammps-users] error in lammps input script SATYARANJAN BISWAL
03:28 Re: [lammps-users] getting result nan in output file Vijay Choyal
01:02 [lammps-users] xmgrace log lammps Djelel Djelloul

February 14, 2018
14:53 [lammps-users] Calculating drift velocity Jo
13:14 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS ouyang
10:57 Re: [lammps-users] Energy conservation problem regrading REBO potential in LAMMPS Axel Kohlmeyer
08:30 Re: [lammps-users] Compute cluster/atom error on LAMMPS Windows version (latest patch 5Feb18) Axel Kohlmeyer
04:00 [lammps-users] Fix atoms Statics Eng
00:55 [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Birva Patel

February 13, 2018
23:08 [lammps-users] core shell hossain khan
21:58 [lammps-users] Multiple groups of atoms of a molecule need to be identified as rigid/small Birva Patel
18:20 Re: [lammps-users] Compute cluster/atom error on LAMMPS Windows version (latest patch 5Feb18) Imanuel Kristanto
17:35 [lammps-users] Viscosity Calculation using in.wall.2d Emma Tran
11:17 Re: [lammps-users] Segmentation fault when using extract_compute() in python wrapper Axel Kohlmeyer
10:08 Re: [lammps-users] Temperature profile Stefan Paquay
09:45 Re: [lammps-users] Compute cluster/atom error on LAMMPS Windows version (latest patch 5Feb18) Axel Kohlmeyer
07:58 [lammps-users] Compute cluster/atom error on LAMMPS Windows version (latest patch 5Feb18) Imanuel Kristanto
07:13 Re: [lammps-users] Error when using "bond_style hybrid harmonic zero" Axel Kohlmeyer
06:59 [lammps-users] Error when using "bond_style hybrid harmonic zero" Amin Koochaki
02:11 Re: [lammps-users] ST2 water simulated with lammps? Axel Kohlmeyer
01:48 Re: [lammps-users] (no subject) Axel Kohlmeyer

February 12, 2018
22:15 [lammps-users] (no subject) hossain khan
21:21 Re: [lammps-users] Bond_style command applied only to certain atoms Stefan Paquay
20:30 [lammps-users] Bond_style command applied only to certain atoms MASATO KOIZUMI
11:55 Re: [lammps-users] Segmentation fault when using extract_compute() in python wrapper Axel Kohlmeyer
11:30 [lammps-users] Segmentation fault when using extract_compute() in python wrapper Chilakalapudi, Syamal Praneeth (INT)
10:54 [lammps-users] Open postdoc positions in the Prendergast Group at Berkeley Lab's Molecular Foundry David Prendergast
10:22 [lammps-users] ST2 water simulated with lammps? Gyorgy Hantal
09:13 Re: [lammps-users] Lammps Manual Running error Axel Kohlmeyer
08:45 Re: [lammps-users] Lammps Manual Running error Stefan Paquay
07:14 Re: [lammps-users] Lammps Manual Running error Axel Kohlmeyer
07:09 Re: [lammps-users] Lammps Manual Running error Sandeep Kumar Singh
07:05 Re: [lammps-users] Lammps Manual Running error Axel Kohlmeyer
07:01 Re: [lammps-users] Lammps Manual Running error Sandeep Kumar Singh
06:38 Re: [lammps-users] How to suppress out-plane dilatation and distortion for a 2D deformation? Axel Kohlmeyer
05:48 Re: [lammps-users] Define molecule from the read_data data file for the fix gcmc. Axel Kohlmeyer
04:24 [lammps-users] Define molecule from the read_data data file for the fix gcmc. Birva Patel
03:03 Re: [lammps-users] fix NPT for a triclinic Axel Kohlmeyer
02:48 Re: [lammps-users] fix ave/time and compute dipole/chunk Axel Kohlmeyer
02:28 Re: [lammps-users] constant potential energy Anders Hafreager
02:26 Re: [lammps-users] constant potential energy Axel Kohlmeyer
00:18 [lammps-users] constant potential energy neda Sanchuli
00:16 [lammps-users] (no subject) neda Sanchuli

February 11, 2018
17:23 [lammps-users] fix ave/time and compute dipole/chunk Khalid Abdelaziz
16:35 [lammps-users] Temperature profile Qiangqiang Sun
10:01 Re: [lammps-users] nph and lengevin fix replication issues Axel Kohlmeyer
08:01 Re: [lammps-users] error in lammps input script Axel Kohlmeyer
07:45 Re: [lammps-users] Fix vector compute does not calculate a vector Axel Kohlmeyer
07:38 Re: [lammps-users] Must system charge be neutral for performing molecular dynamics simulation? Axel Kohlmeyer
02:51 [lammps-users] Must system charge be neutral for performing molecular dynamics simulation? Amir Hossein Saeedi

February 10, 2018
21:48 [lammps-users] Fix vector compute does not calculate a vector rofiques salehin
13:16 Re: [lammps-users] Can "compute stress/atom" be used to calculate local stress tensor? Giacomo Fiorin
12:13 Re: [lammps-users] Charge differences restarting qeq run Axel Kohlmeyer
11:12 Re: [lammps-users] Can "compute stress/atom" be used to calculate local stress tensor? Arham Amouei
10:37 Re: [lammps-users] Can "compute stress/atom" be used to calculate local stress tensor? Giacomo Fiorin
06:28 [lammps-users] Can "compute stress/atom" be used to calculate local stress tensor? Arham Amouei
00:05 [lammps-users] Inquiry on Uses of Bond_styles MASATO KOIZUMI

February 09, 2018
16:47 [lammps-users] Charge differences restarting qeq run Michael Humbert
12:36 Re: [lammps-users] NPnAT ensemble Axel Kohlmeyer
11:55 Re: [lammps-users] Lammps Manual Running error Ray Shan
11:27 [lammps-users] How to confine argon particles in a T-region with periodic boundary conditions Yahoo / Sent m n
11:22 Re: [lammps-users] How to confine argon particles in a T-region with periodic boundary conditions SATYARANJAN BISWAL
11:19 [lammps-users] How to confine argon particles in a T-region with periodic boundary conditions m n
11:11 [lammps-users] error in lammps input script satyaranjan biswal
11:11 Re: [lammps-users] Lammps Manual Running error Axel Kohlmeyer
11:06 Re: [lammps-users] Lammps Manual Running error Ray Shan
10:55 Re: [lammps-users] Lammps Manual Running error Ray Shan
10:44 [lammps-users] Lammps Manual Running error Sandeep Kumar Singh
10:12 [lammps-users] NPnAT ensemble Amir Hossein Saeedi
08:36 Re: [lammps-users] Many-body DPD with SRP potential Axel Kohlmeyer
07:39 Re: [lammps-users] Many-body DPD with SRP potential Debdip Bhandary
07:21 Re: [lammps-users] Many-body DPD with SRP potential Axel Kohlmeyer
03:56 [lammps-users] nph and lengevin fix replication issues Devonport, Craig
01:35 [lammps-users] Error in parallel GCMC simulation Mengzi Zhou

February 08, 2018
18:34 Re: [lammps-users] [EXTERNAL] Re: Lammps MSST simulation Thompson, Aidan
18:20 Re: [lammps-users] Lammps MSST simulation Ray Shan
17:42 Re: [lammps-users] How to assign random directions to velocities of atoms in a group? Wenqiang Liu
16:18 [lammps-users] GCMC gas adsorption Karteek Kumar
15:23 [lammps-users] Lammps MSST simulation Selesta Oxem
15:03 Re: [lammps-users] Many-body DPD with SRP potential Debdip Bhandary
14:49 Re: [lammps-users] make certain pair_style to be non-periodic in pair_style hybrid/overlay? Khalid Abdelaziz
14:18 Re: [lammps-users] Displacing type of atoms if condition is met Pascal Brault
13:49 Re: [lammps-users] Displacing type of atoms if condition is met Axel Kohlmeyer
13:28 Re: [lammps-users] Displacing type of atoms if condition is met Pascal Brault
13:18 Re: [lammps-users] Displacing type of atoms if condition is met Axel Kohlmeyer
13:13 Re: [lammps-users] Displacing type of atoms if condition is met Pascal Brault
13:05 Re: [lammps-users] make certain pair_style to be non-periodic in pair_style hybrid/overlay? Axel Kohlmeyer
13:02 [lammps-users] make certain pair_style to be non-periodic in pair_style hybrid/overlay? Quang Ha
10:13 Re: [lammps-users] Help needed with fix python/invoke and using python wrapper from it Axel Kohlmeyer
09:53 Re: [lammps-users] Help needed with fix python/invoke and using python wrapper from it Chilakalapudi, Syamal Praneeth (INT)
09:22 Re: [lammps-users] Help needed with fix python/invoke and using python wrapper from it Axel Kohlmeyer
09:09 [lammps-users] Help needed with fix python/invoke and using python wrapper from it Chilakalapudi, Syamal Praneeth (INT)
08:45 Re: [lammps-users] Displacing type of atoms if condition is met Axel Kohlmeyer
06:39 Re: [lammps-users] Displacing type of atoms if condition is met Stefan Paquay
03:53 [lammps-users] Displacing type of atoms if condition is met Pascal Brault

February 07, 2018
10:06 [lammps-users] fix NPT for a triclinic Monir Hosseini Anvari
07:02 Re: [lammps-users] How to assign random directions to velocities of atoms in a group? Axel Kohlmeyer
06:51 Re: [lammps-users] How to assign random directions to velocities of atoms in a group? Wenqiang Liu
06:37 Re: [lammps-users] functional form of interatomic potential currently implemented in lammps Michał Kański
06:37 Re: [lammps-users] functional form of interatomic potential currently implemented in lammps Axel Kohlmeyer
06:34 Re: [lammps-users] Friction between solid and fluid Axel Kohlmeyer
06:16 [lammps-users] Friction between solid and fluid 정대웅
05:51 [lammps-users] functional form of interatomic potential currently implemented in lammps John S. Rivas M.
03:25 Re: [lammps-users] Program Terminating with Error Message Axel Kohlmeyer
03:12 Re: [lammps-users] Program Terminating with Error Message Axel Kohlmeyer

February 06, 2018
22:43 Re: [lammps-users] How to assign random directions to velocities of atoms in a group? Anders Hafreager
18:47 Re: [lammps-users] How to assign random directions to velocities of atoms in a group? Wenqiang Liu
17:05 Re: [lammps-users] parameters in airebo potential file Shenli Zhang
16:45 Re: [lammps-users] parameters in airebo potential file Markus Höhnerbach
16:26 [lammps-users] parameters in airebo potential file Shenli Zhang
14:59 Re: [lammps-users] [EXTERNAL] High pressure in simulation of carbon nano-particle inside water. Manoj Dhiman
14:04 [lammps-users] Program Terminating with Error Message Jit Sarkar
13:17 [lammps-users] Simulation Box with Two Different Widths m n
13:14 Re: [lammps-users] Atoms of same type but different charge. Axel Kohlmeyer
12:55 [lammps-users] Atoms of same type but different charge. Felipe Pérez
11:48 [lammps-users] Simulation Box with Two Different Widths m n
10:17 Re: [lammps-users] How do you consider viscosity? Eric Murphy
09:52 [lammps-users] How to suppress out-plane dilatation and distortion for a 2D deformation? Anubhav Roy
07:34 Re: [lammps-users] How to assign random directions to velocities of atoms in a group? Anders Hafreager
07:30 [lammps-users] How to assign random directions to velocities of atoms in a group? Wenqiang Liu
04:15 Re: [lammps-users] fix move rotate command Axel Kohlmeyer
03:22 Re: [lammps-users] How do you consider viscosity? Axel Kohlmeyer
03:16 Re: [lammps-users] How do you consider viscosity? 정대웅
03:14 Re: [lammps-users] changing type of atom during run Axel Kohlmeyer
02:45 Re: [lammps-users] fix move rotate command Vijay Choyal
02:11 [lammps-users] changing type of atom during run ava arya
01:08 Re: [lammps-users] How do you consider viscosity? Axel Kohlmeyer

February 05, 2018
23:47 [lammps-users] How do you consider viscosity? 정대웅
23:13 Re: [lammps-users] Many-body DPD with SRP potential Debdip Bhandary
23:00 Re: [lammps-users] radiation damage in material Axel Kohlmeyer
22:56 Re: [lammps-users] ERROR: Illegal set command (../set.cpp:517) Axel Kohlmeyer
20:48 [lammps-users] radiation damage in material hossain khan
19:57 [lammps-users] ERROR: Illegal set command (../set.cpp:517) hossain khan
18:54 Re: [lammps-users] [EXTERNAL] combining fix aveforce and fix viscous Thompson, Aidan
18:52 Re: [lammps-users] [EXTERNAL] High pressure in simulation of carbon nano-particle inside water. Thompson, Aidan
18:38 Re: [lammps-users] [EXTERNAL] Pressure not stabilize in certain direction Thompson, Aidan
16:34 Re: [lammps-users] Illegal variable substitution when creating dump from temper command Michał Kański
15:09 [lammps-users] Illegal variable substitution when creating dump from temper command Helen Yao
12:57 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault with GCMC Thompson, Aidan
10:27 Re: [lammps-users] [EXTERNAL] wall boundary condition in dpd Thompson, Aidan
07:45 Re: [lammps-users] Many-body DPD with SRP potential Axel Kohlmeyer
07:33 [lammps-users] Many-body DPD with SRP potential Debdip Bhandary
07:05 Re: [lammps-users] Problem with visualising dipoles in vmd Axel Kohlmeyer
06:55 [lammps-users] Problem with visualising dipoles in vmd puja banerjee
06:51 Re: [lammps-users] Accessing atom properties as an array during run Axel Kohlmeyer
06:42 Re: [lammps-users] Accessing atom properties as an array during run Chilakalapudi, Syamal Praneeth (INT)
06:06 Re: [lammps-users] Accessing atom properties as an array during run Axel Kohlmeyer
05:38 [lammps-users] Accessing atom properties as an array during run Chilakalapudi, Syamal Praneeth (INT)
02:57 [lammps-users] wall boundary condition in dpd ava arya
01:26 Re: [lammps-users] Different results when using same number of cores (32 cores) Axel Kohlmeyer

February 04, 2018
20:36 [lammps-users] Different results when using same number of cores (32 cores) Pengyu Huang
06:38 Re: [lammps-users] How can I apply a external voltage in lammps? Axel Kohlmeyer

February 03, 2018
12:47 Re: [lammps-users] Segmentation fault with GCMC Karteek Kumar
11:41 [lammps-users] How can I apply a external voltage in lammps? NILOUFAR RAJABIYOUN
08:40 Re: [lammps-users] How to use gdb to debug lammps zwzhou
01:22 Re: [lammps-users] Segmentation fault with GCMC Anders Hafreager
00:31 Re: [lammps-users] Morelon potential buck/spline pair style Michał Kański

February 02, 2018
23:01 Re: [lammps-users] How to use gdb to debug lammps Axel Kohlmeyer
22:40 Re: [lammps-users] Segmentation fault with GCMC Karteek Kumar
19:51 [lammps-users] How to use gdb to debug lammps zwzhou
18:59 [lammps-users] Pressure not stabilize in certain direction Md. Imrul Reza Shishir
15:34 Re: [lammps-users] Segmentation fault with GCMC Anders Hafreager
15:31 Re: [lammps-users] Segmentation fault with GCMC Karteek Kumar
15:24 Re: [lammps-users] Segmentation fault with GCMC Anders Hafreager
14:53 [lammps-users] High pressure in simulation of carbon nano-particle inside water. Manoj Dhiman
13:10 [lammps-users] Morelon potential buck/spline pair style Masengale, Sean
12:55 [lammps-users] Segmentation fault with GCMC Karteek Kumar
11:01 [lammps-users] combining fix aveforce and fix viscous Dave Schall
10:52 Re: [lammps-users] empty dump and restart files Monir Hosseini Anvari
09:55 Re: [lammps-users] [EXTERNAL] Can we use Fix phonon command to generate phonon dispersion curves of nanotubes? Thompson, Aidan
09:50 Re: [lammps-users] [EXTERNAL] Inquiry on fx, fy and fz and skin distance Thompson, Aidan
09:45 Re: [lammps-users] [EXTERNAL] Dynamic group for Poiseuille flow Thompson, Aidan
08:12 Re: [lammps-users] Running parallel lammps jobs parallely Stefan Paquay
07:58 [lammps-users] Fw: Running parallel lammps jobs parallely Khalid Abdelaziz
05:25 Re: [lammps-users] fix langevin Bo Gong
05:00 [lammps-users] Inquiry on fx, fy and fz and skin distance MASATO KOIZUMI
04:12 Re: [lammps-users] fix langevin Axel Kohlmeyer
03:49 Re: [lammps-users] No pair wise interaction within a molecule Sandeep Mathew
03:48 Re: [lammps-users] fix langevin Bo Gong
01:49 Re: [lammps-users] fix langevin Axel Kohlmeyer
01:28 Re: [lammps-users] fix langevin Bo Gong
01:01 Re: [lammps-users] Can we use Fix phonon command to generate phonon dispersion curves of nanotubes? Axel Kohlmeyer
00:58 Re: [lammps-users] fix langevin Axel Kohlmeyer
00:56 Re: [lammps-users] Running parallel lammps jobs parallely Axel Kohlmeyer

February 01, 2018
23:16 [lammps-users] Running parallel lammps jobs parallely Ankit Mishra
21:59 [lammps-users] Running parallel lammps jobs parallely Ankit Mishra
20:59 [lammps-users] fix langevin Bo Gong
15:17 [lammps-users] Can we use Fix phonon command to generate phonon dispersion curves of nanotubes? Mohan Surya Raja Elapolu
15:11 [lammps-users] Dynamic group for Poiseuille flow Qiangqiang Sun
14:24 Re: [lammps-users] non periodic Axel Kohlmeyer
14:16 Re: [lammps-users] non periodic Sungwon Park
13:15 Re: [lammps-users] [EXTERNAL] Re: Measure Enthalpy profile – how to add a per-atom compute like a vector Thompson, Aidan
09:09 Re: [lammps-users] Measure Enthalpy profile – how to add a per-atom compute like a vector Sven Auschra
08:39 Re: [lammps-users] non periodic Axel Kohlmeyer
08:30 [lammps-users] non periodic Sungwon Park
07:43 Re: [lammps-users] severe load balance issue Julien Guénolé
07:23 Re: [lammps-users] severe load balance issue Axel Kohlmeyer
07:10 Re: [lammps-users] Measure Enthalpy profile – how to add a per-atom compute like a vector Axel Kohlmeyer
06:57 Re: [lammps-users] Displacement of atoms Julien Guénolé
06:39 Re: [lammps-users] severe load balance issue Julien Guénolé
05:48 [lammps-users] Measure Enthalpy profile – how to add a per-atom compute like a vector Sven Auschra
01:42 Re: [lammps-users] Carbon velocity upon deposition in copper surface Axel Kohlmeyer

January 31, 2018
20:02 [lammps-users] Carbon velocity upon deposition in copper surface Torotot Boy
17:04 Re: [lammps-users] Question regarding free surfaces Axel Kohlmeyer
16:33 Re: [lammps-users] [EXTERNAL] Re: temperature very high Thompson, Aidan
16:25 Re: [lammps-users] [EXTERNAL] Elongational flows using fix nvt/sllod Thompson, Aidan
16:07 [lammps-users] Question regarding free surfaces Monir Hosseini Anvari
15:30 Re: [lammps-users] -DLAMMPS_JPEG Axel Kohlmeyer
15:19 Re: [lammps-users] -DLAMMPS_JPEG Khalid Abdelaziz
15:06 [lammps-users] -DLAMMPS_JPEG Henrik Hariman
08:18 Re: [lammps-users] severe load balance issue Axel Kohlmeyer
07:36 Re: [lammps-users] severe load balance issue Nasiri, Samaneh
05:48 Re: [lammps-users] inquiry about force field implementation Axel Kohlmeyer
05:31 Re: [lammps-users] severe load balance issue Axel Kohlmeyer
05:28 Re: [lammps-users] severe load balance issue Michał Kański
05:01 [lammps-users] severe load balance issue Nasiri, Samaneh
03:08 Re: [lammps-users] Bond inconsistency Axel Kohlmeyer
02:50 Re: [lammps-users] temperature very high Anuradha Singla
02:49 Re: [lammps-users] Bond inconsistency Axel Kohlmeyer
02:45 Re: [lammps-users] Lammps - FIx NPT - Problem Axel Kohlmeyer
02:23 [lammps-users] Bond inconsistency Vijayan, Prabhu
01:51 Re: [lammps-users] dump/vtk command not found MBorreguero
01:50 Re: [lammps-users] dump/vtk command not found Axel Kohlmeyer
01:48 Re: [lammps-users] question about iso keywork in fix npt command Axel Kohlmeyer
00:40 [lammps-users] question about iso keywork in fix npt command xingyun_2018
00:25 [lammps-users] question about iso keywork in fix npt command ruiyan

January 30, 2018
23:53 [lammps-users] dump/vtk command not found MBorreguero
18:30 [lammps-users] Elongational flows using fix nvt/sllod Timothy John O'Sullivan
17:52 Re: [lammps-users] inquiry about force field implementation Khalid Abdelaziz
16:50 [lammps-users] inquiry about force field implementation Shenli Zhang
15:35 Re: [lammps-users] [EXTERNAL] CO2+N2 mixture, supercritical conditions Thompson, Aidan
15:24 Re: [lammps-users] CO2+N2 mixture, supercritical conditions Axel Kohlmeyer
14:37 Re: [lammps-users] Help for using dump molfile KIHOON BANG
14:08 [lammps-users] CO2+N2 mixture, supercritical conditions Daniel Cordier
12:33 Re: [lammps-users] [EXTERNAL] about fix tfmc Thompson, Aidan
12:28 [lammps-users] Help for using dump molfile KIHOON BANG
12:24 Re: [lammps-users] [EXTERNAL] Lost atom in * f * style boundary Thompson, Aidan
09:15 Re: [lammps-users] No pair wise interaction within a molecule Stefan Paquay
09:14 [lammps-users] Lammps - FIx NPT - Problem Tedros Alem Hadush
08:39 [lammps-users] No pair wise interaction within a molecule Sandeep Mathew
06:29 Re: [lammps-users] Einstein crystal Axel Kohlmeyer
06:05 [lammps-users] Einstein crystal pmoreira
03:22 Re: [lammps-users] Issues compiling COUPLE/simple.c Axel Kohlmeyer
03:04 Re: [lammps-users] Negative Lambda 3 for Tersoff/ZBL Axel Kohlmeyer
01:56 Re: [lammps-users] pizza dview.py Axel Kohlmeyer
01:51 [lammps-users] pizza dview.py MBorreguero
00:04 Re: [lammps-users] temperature very high Diaz,Adrian
00:00 Re: [lammps-users] temperature very high Anuradha Singla

January 29, 2018
23:35 Re: [lammps-users] Thermal conductivity in Green-kubo method Axel Kohlmeyer
22:20 Re: [lammps-users] Thermal conductivity in Green-kubo method Ray Shan
21:58 Re: [lammps-users] Thermal conductivity in Green-kubo method Kasra Hesary
14:16 [lammps-users] Issues compiling COUPLE/simple.c Anne Brant
14:09 [lammps-users] Thermal conductivity in Green-kubo method Chuanxing Zhan
13:54 Re: [lammps-users] Buckingham potential Stefan Paquay
13:53 Re: [lammps-users] Buckingham potential Axel Kohlmeyer
13:36 Re: [lammps-users] Atom ID - Modifying lammps Axel Kohlmeyer
12:23 [lammps-users] Buckingham potential Faraz Saleem
12:14 [lammps-users] Atom ID - Modifying lammps Sandesh Kamath
10:52 [lammps-users] Lost atom in * f * style boundary Qiangqiang Sun
10:24 [lammps-users] about fix tfmc Fernanda S Teixeira
08:23 Re: [lammps-users] ERROR: Dump custom variable is not atom-style variable Axel Kohlmeyer
08:04 [lammps-users] ERROR: Dump custom variable is not atom-style variable priyank srivastava
07:54 Re: [lammps-users] Fix rigid: Output Rigid Body Auxiliary File Piskulich, Ezekiel Ashe
03:00 Re: [lammps-users] ERROR: Dump custom variable is not atom-style variable Axel Kohlmeyer
02:07 [lammps-users] ERROR: Dump custom variable is not atom-style variable priyank srivastava
01:40 Re: [lammps-users] lattice and create_atoms command Axel Kohlmeyer

January 28, 2018
23:21 [lammps-users] restart_file neda Sanchuli
11:59 Re: [lammps-users] restart with CMAP option eduardo
09:47 [lammps-users] lattice and create_atoms command 孙强强
08:17 Re: [lammps-users] Regarding ZBL potential Sharma MD
04:04 Re: [lammps-users] Tension test using peridynamics style Axel Kohlmeyer
03:52 [lammps-users] Tension test using peridynamics style rushi gite
03:16 Re: [lammps-users] restart with CMAP option Axel Kohlmeyer
01:55 [lammps-users] Displacement of atoms ‪Meral Sharkas‬ ‪
01:42 [lammps-users] Displacement of atoms ‪Meral Sharkas‬ ‪

January 27, 2018
18:50 Re: [lammps-users] Centro Symmetry Parameter Calculation for BCC-FCC polycrystalline LAMMPS Simulations Valone, Steve
16:13 [lammps-users] restart with CMAP option eduardo
16:04 [lammps-users] Centro Symmetry Parameter Calculation for BCC-FCC polycrystalline LAMMPS Simulations Srivilliputhur, Srinivasan
08:20 Re: [lammps-users] grid infile keywords in Processors command Sungkwang Mun
02:21 Re: [lammps-users] Segmentation fault when using 'fix heat' Anders Hafreager
00:58 Re: [lammps-users] Number of Bond types Axel Kohlmeyer
00:56 Re: [lammps-users] Fix rigid: Output Rigid Body Auxiliary File Axel Kohlmeyer
00:47 Re: [lammps-users] Problems running an instance of LAMMPS (built as a library) with MPI Axel Kohlmeyer
00:44 Re: [lammps-users] Segmentation fault when using 'fix heat' Axel Kohlmeyer

January 26, 2018
17:45 [lammps-users] Problems running an instance of LAMMPS (built as a library) with MPI Roberto Gomes de Aguiar Veiga
15:38 Re: [lammps-users] [EXTERNAL] Re: reax/c running on HPC Moore, Stan
12:43 [lammps-users] Segmentation fault when using 'fix heat' Sushan Nakarmi
10:32 Re: [lammps-users] [EXTERNAL] Re: reax/c running on HPC Moore, Stan
09:57 [lammps-users] Number of Bond types Vijayan, Prabhu
09:16 Re: [lammps-users] reax/c running on HPC Nasiri, Samaneh
09:00 Re: [lammps-users] reax/c running on HPC Stefan Paquay
08:54 [lammps-users] Fix rigid: Output Rigid Body Auxiliary File Piskulich, Ezekiel Ashe
08:48 Re: [lammps-users] calculate the mass center of a droplet in vapor system 罗爽
08:40 Re: [lammps-users] calculate the mass center of a droplet in vapor system Giacomo Fiorin
08:37 Re: [lammps-users] reax/c running on HPC Ray Shan
08:27 [lammps-users] Bin/cylinder Zohreh Ahadi
08:22 Re: [lammps-users] MC example in manual - Metrpolis condition Asaf Farhi
08:20 Re: [lammps-users] MC example in manual - Metrpolis condition Stefan Paquay
08:06 [lammps-users] reax/c running on HPC Nasiri, Samaneh
07:38 Re: [lammps-users] calculate the mass center of a droplet in vapor system Giacomo Fiorin
07:32 Re: [lammps-users] fix langevin and fcm Axel Kohlmeyer
07:26 Re: [lammps-users] Regarding ZBL potential Stefan Paquay
06:36 [lammps-users] fix langevin and fcm Wen Zhang
06:12 [lammps-users] MC example in manual - Metrpolis condition Asaf Farhi
05:14 [lammps-users] calculate the mass center of a droplet in vapor system 罗爽
02:43 Re: [lammps-users] Regarding ZBL potential Axel Kohlmeyer
02:41 Re: [lammps-users] Regarding ZBL potential Sharma MD

January 25, 2018
16:28 Re: [lammps-users] relaxing the sample at zero pressure Keshab Bashyal
14:47 Re: [lammps-users] fix group and NVT Stefan Paquay
14:41 Re: [lammps-users] fix group and NVT Vaidyanathan M.S
14:36 Re: [lammps-users] fix group and NVT Stefan Paquay
14:35 Re: [lammps-users] fix group and NVT Axel Kohlmeyer
14:28 [lammps-users] fix group and NVT Vaidyanathan M.S
12:52 Re: [lammps-users] pair_reax.cpp:521 Ray Shan
11:15 Re: [lammps-users] D2O SPC/E Axel Kohlmeyer
10:57 Re: [lammps-users] D2O SPC/E Stregone
09:45 [lammps-users] D2O SPC/E Adriano Santana Sanchez
08:17 [lammps-users] Negative Lambda 3 for Tersoff/ZBL Rapp, Dennis Michael
07:13 Re: [lammps-users] Pizza.py dump file format Stefan Paquay
07:10 Re: [lammps-users] pair_reax.cpp:521 Stefan Paquay
07:09 Re: [lammps-users] LAMMPS data file using AI-REBO potential Chowdhury, Sanjib Chandra
07:08 Re: [lammps-users] relaxing the sample at zero pressure Stefan Paquay
06:32 Re: [lammps-users] grid infile keywords in Processors command Axel Kohlmeyer
05:59 Re: [lammps-users] Fwd: Issue regarding tri-clinic Axel Kohlmeyer
03:11 Re: [lammps-users] Pizza.py dump file format Axel Kohlmeyer
02:09 [lammps-users] Pizza.py dump file format MBorreguero
01:34 Re: [lammps-users] meaning of comm_forward/comm_reverse Axel Kohlmeyer
01:28 Re: [lammps-users] Fwd: Issue regarding tri-clinic Axel Kohlmeyer

January 24, 2018
22:54 [lammps-users] Fwd: Issue regarding tri-clinic Viral Solanki
19:14 Re: [lammps-users] relaxing the sample at zero pressure Terry Price
19:12 [lammps-users] relaxing the sample at zero pressure Keshab Bashyal
15:11 [lammps-users] meaning of comm_forward/comm_reverse Quang Ha
13:53 Re: [lammps-users] LAMMPS data file using AI-REBO potential Ray Shan
13:34 [lammps-users] LAMMPS data file using AI-REBO potential Shi,Linyuan
13:30 [lammps-users] LAMMPS data file using AI-REBO potential Shi,Linyuan
12:58 [lammps-users] grid infile keywords in Processors command Sungkwang Mun
12:49 Re: [lammps-users] Simulation Box Khalid Abdelaziz
12:41 Re: [lammps-users] Simulation Box Lu Wang
12:24 Re: [lammps-users] Simulation Box Giacomo Fiorin
12:01 Re: [lammps-users] Dipole ERROR: Invalid atom_style command Stefan Paquay
11:53 Re: [lammps-users] Simulation Box Stefan Paquay
11:46 Re: [lammps-users] pair_reax.cpp:521 Stefan Paquay
11:28 [lammps-users] Simulation Box Lu Wang
10:32 [lammps-users] pair_reax.cpp:521 Ka Sa
09:23 [lammps-users] Dipole ERROR: Invalid atom_style command Li, Chuncheng
01:20 Re: [lammps-users] compute chunk/atom command Axel Kohlmeyer
01:14 Re: [lammps-users] Error in simulation Axel Kohlmeyer
01:12 Re: [lammps-users] Angles in data file Axel Kohlmeyer
01:09 Re: [lammps-users] temperature very high Axel Kohlmeyer
01:08 Re: [lammps-users] Raman Spectra using Lammps Axel Kohlmeyer
01:07 Re: [lammps-users] Regarding ZBL potential Axel Kohlmeyer
01:00 Re: [lammps-users] Inquiry on Restart and Fix Deform Axel Kohlmeyer

January 23, 2018
23:36 [lammps-users] temperature very high Anuradha Singla
23:21 [lammps-users] Inquiry on Restart and Fix Deform MASATO KOIZUMI
18:41 Re: [lammps-users] Angles in data file 284237308@...1204...
16:35 Re: [lammps-users] Issue with reax/c/species command Ray Shan
16:27 Re: [lammps-users] empty dump and restart files Ray Shan
11:47 [lammps-users] Regarding ZBL potential Sharma MD
10:24 [lammps-users] empty dump and restart files Monir Hosseini Anvari
09:13 [lammps-users] Issue with reax/c/species command Diego Lopez Barreiro
09:08 Re: [lammps-users] Error in simulation Manish Solanki
08:42 Re: [lammps-users] LammpsInterface.cpp:1540: undefined reference to `typeinfo for LAMMPS_NS::PairEAM' Axel Kohlmeyer
08:38 Re: [lammps-users] Entropy Giacomo Fiorin
08:26 [lammps-users] Raman spectra using Lammps Rajdeep Behera
08:23 [lammps-users] Raman Spectra using Lammps Rajdeep Behera
08:02 [lammps-users] Entropy Lu Wang
06:29 Re: [lammps-users] dump angular velocity for calculating rotational density of state Axel Kohlmeyer
06:26 Re: [lammps-users] fix temp/rescale thermostat Stefan Paquay
06:08 Re: [lammps-users] dump angular velocity for calculating rotational density of state liyi bai
03:28 Re: [lammps-users] Read_restart and FENE Bond Too Long Axel Kohlmeyer
02:14 Re: [lammps-users] Read_restart and FENE Bond Too Long MASATO KOIZUMI
01:28 Re: [lammps-users] Read_restart and FENE Bond Too Long Axel Kohlmeyer
01:22 Re: [lammps-users] Assigning chunk properties to atoms Axel Kohlmeyer
01:21 [lammps-users] Fw: Assigning chunk properties to atoms Khalid Abdelaziz
01:18 Re: [lammps-users] Angles in data file Axel Kohlmeyer
01:15 [lammps-users] Read_restart and FENE Bond Too Long MASATO KOIZUMI
01:13 [lammps-users] Angles in data file 284237308@...1204...
00:55 Re: [lammps-users] Assigning chunk properties to atoms Axel Kohlmeyer
00:52 Re: [lammps-users] dump angular velocity for calculating rotational density of state Axel Kohlmeyer

January 22, 2018
21:08 Re: [lammps-users] dump angular velocity for calculating rotational density of state Giacomo Fiorin
19:20 Re: [lammps-users] dump angular velocity for calculating rotational density of state liyi bai
15:27 Re: [lammps-users] Stabilization Issue of Monolayer MoS2 with fix move command Ray Shan
12:57 Re: [lammps-users] LammpsInterface.cpp:1540: undefined reference to `typeinfo for LAMMPS_NS::PairEAM' Henrik Hariman
12:17 Re: [lammps-users] fix adapt triggers at every 'run' command Nathaniel Shaffer
10:58 [lammps-users] Assigning chunk properties to atoms Khalid Abdelaziz
10:23 Re: [lammps-users] LammpsInterface.cpp:1540: undefined reference to `typeinfo for LAMMPS_NS::PairEAM' Axel Kohlmeyer
10:21 Re: [lammps-users] Error in simulation Axel Kohlmeyer
10:10 Re: [lammps-users] Error in simulation Axel Kohlmeyer
10:09 Re: [lammps-users] coding LAMMPS for interaction laser with hydrogen cluster Axel Kohlmeyer
09:58 [lammps-users] fix temp/rescale thermostat 孙强强
09:09 [lammps-users] compute chunk/atom command Zohreh Ahadi
09:00 [lammps-users] temperature control 孙强强
08:44 Re: [lammps-users] distanceZ Giacomo Fiorin
08:36 Re: [lammps-users] dump angular velocity for calculating rotational density of state Giacomo Fiorin
08:18 [lammps-users] dump angular velocity for calculating rotational density of state liyi bai
08:15 [lammps-users] Vashishta potential Khourshaei Shar, Ali
07:56 [lammps-users] LammpsInterface.cpp:1540: undefined reference to `typeinfo for LAMMPS_NS::PairEAM' Henrik Hariman
07:24 Re: [lammps-users] Units Axel Kohlmeyer
04:34 [lammps-users] distanceZ Alexandra Davila
03:32 [lammps-users] Units Stregone
03:28 Re: [lammps-users] fix adapt triggers at every 'run' command Michał Kański
01:07 Re: [lammps-users] how to define pair_coeff for pair_style reax/c Axel Kohlmeyer
01:04 Re: [lammps-users] Add atoms to a dynamic group Axel Kohlmeyer

January 21, 2018
14:02 [lammps-users] how to define pair_coeff for pair_style reax/c Md. Imrul Reza Shishir
11:34 Re: [lammps-users] Is there a tool in lammps which can restore the atom ID and sort it? Axel Kohlmeyer
11:30 Re: [lammps-users] Is there a tool in lammps which can restore the atom ID and sort it? Stefan Paquay
11:06 [lammps-users] Is there a tool in lammps which can restore the atom ID and sort it? 1185201182

January 20, 2018
13:43 [lammps-users] TIP4P/ice/long and initial data file benjamin geller
09:53 Re: [lammps-users] Error in simulation Anders Hafreager
09:23 Re: [lammps-users] Error in simulation Stefan Paquay
09:22 Re: [lammps-users] Error in simulation Stefan Paquay
09:07 [lammps-users] coding LAMMPS for interaction laser with hydrogen cluster Fatemeh Sadat-e Emamian
03:09 [lammps-users] Add atoms to a dynamic group 罗爽

January 19, 2018
20:55 [lammps-users] Error in simulation Manish Solanki
13:39 [lammps-users] fix adapt triggers at every 'run' command Nathaniel Shaffer
11:32 [lammps-users] Stabilization Issue of Monolayer MoS2 with fix move command Shiddartha Paul
11:24 Re: [lammps-users] diffusion Cu/Cu(001) - reaxff + colvar Giacomo Fiorin
09:29 Re: [lammps-users] Modified velocity verlet algorithm Stefan Paquay
06:27 [lammps-users] Modified velocity verlet algorithm Monika Choudhary
04:43 [lammps-users] Crack propagation module with PDLAMMPS ??
03:55 [lammps-users] diffusion Cu/Cu(001) - reaxff + colvar Alexandra Davila
00:27 Re: [lammps-users] Calculation of inertia for molecule composed of finite size spheres KeepFIT
00:16 [lammps-users] Calculation of inertia for molecule composed of finite size spheres KeepFIT

January 18, 2018
23:12 [lammps-users] doping atoms using Monte Carlo Method Keshab Bashyal
12:49 Re: [lammps-users] diffusion Cu/Cu(001) - reaxff + colvar Giacomo Fiorin
11:00 [lammps-users] NPT fluctuation Lu Wang
09:25 [lammps-users] diffusion Cu/Cu(001) - reaxff + colvar Alexandra Davila
09:16 Re: [lammps-users] Atoms distortion at periodic boundary for some orientation Axel Kohlmeyer
09:13 Re: [lammps-users] Atoms distortion at periodic boundary for some orientation Sharma MD
08:47 Re: [lammps-users] Atoms distortion at periodic boundary for some orientation Axel Kohlmeyer
08:34 [lammps-users] Atoms distortion at periodic boundary for some orientation Sharma MD
08:09 Re: [lammps-users] How to select a random atom in a specify region and knowing its type. Axel Kohlmeyer
08:07 Re: [lammps-users] Atoms out of the simulation box Axel Kohlmeyer
08:05 Re: [lammps-users] error: Non-numeric atom coords - simulation unstable (../domain.cpp:521) with PDLAMMPS Axel Kohlmeyer
08:01 Re: [lammps-users] Read_restart simulating from from the beginning Axel Kohlmeyer
06:26 [lammps-users] error: Non-numeric atom coords - simulation unstable (../domain.cpp:521) with PDLAMMPS ??
04:56 [lammps-users] Atoms out of the simulation box Torotot Boy
00:45 [lammps-users] Read_restart simulating from from the beginning MASATO KOIZUMI

January 17, 2018
20:38 [lammps-users] How to select a random atom in a specify region and knowing its type. Bida Zhu
07:23 Re: [lammps-users] Pressure Fluctuation Axel Kohlmeyer
07:07 [lammps-users] Pressure Fluctuation Lu Wang
07:06 Re: [lammps-users] Immediate Evaluation of atom style Variables Axel Kohlmeyer
07:04 Re: [lammps-users] Can I use two NVT for different group in one simulation? Axel Kohlmeyer
06:59 [lammps-users] Immediate Evaluation of atom style Variables Wise, Ethan Allen
06:57 Re: [lammps-users] Can I use two NVT for different group in one simulation? Yakang JIN
06:39 Re: [lammps-users] Can I use two NVT for different group in one simulation? Axel Kohlmeyer
05:43 [lammps-users] Can I use two NVT for different group in one simulation? Yakang JIN
05:41 [lammps-users] Can I use two NVT for different group in one simulation? Yakang JIN
05:31 Re: [lammps-users] How to add atoms in a region during simulation Axel Kohlmeyer
03:05 Re: [lammps-users] Error in using EAM, AIREBO, LJ in one simulation Michał Kański
02:47 Re: [lammps-users] How to add atoms in a region during simulation Jinhuan Pu

January 16, 2018
22:49 [lammps-users] Error in using EAM, AIREBO, LJ in one simulation Torotot Boy
21:59 [lammps-users] Error in using EAM, AIREBO, LJ in one simulation Torotot Boy
18:44 [lammps-users] Core/shell model with Langevin thermostat Laura Scalfi
18:16 Re: [lammps-users] Hybrid pair_style: All pair coeffs are not set Axel Kohlmeyer
18:13 Re: [lammps-users] kspace_style pppm and triclinic boxes. Axel Kohlmeyer
17:46 [lammps-users] kspace_style pppm and triclinic boxes. Timothy John O'Sullivan
16:19 [lammps-users] Hybrid pair_style: All pair coeffs are not set Amir Behbahanian
16:13 Re: [lammps-users] Setting cut-off and kmax in Ewald summation for alpha-quartz crystal Axel Kohlmeyer
15:26 [lammps-users] Setting cut-off and kmax in Ewald summation for alpha-quartz crystal Bingyu Cui
14:21 Re: [lammps-users] laser ablation of Silicon materials Axel Kohlmeyer
14:20 Re: [lammps-users] How to add atoms in a region during simulation Axel Kohlmeyer
14:09 [lammps-users] How to add atoms in a region during simulation Jinhuan Pu
12:45 [lammps-users] laser ablation of Silicon materials Shalini Singh
12:07 Re: [lammps-users] Unphysical charges when using QEQ/point with multiple run statements Michael Humbert
08:30 [lammps-users] (no subject) sher Mohammad sher
07:00 Re: [lammps-users] Can LAMMPS calculate the tangent modulus of atoms likewise the atomic stress? Axel Kohlmeyer
05:15 Re: [lammps-users] Regd. splining interpolation Axel Kohlmeyer
05:14 Re: [lammps-users] MD Initial Configuration Axel Kohlmeyer
00:42 [lammps-users] Regd. splining interpolation ABHINAV SHUKLA
00:31 [lammps-users] MD Initial Configuration Lu Wang

January 15, 2018
18:55 [lammps-users] chunk/atom and RDF Lamm Gro
15:29 Re: [lammps-users] Can LAMMPS calculate the tangent modulus of atoms likewise the atomic stress? hamid
15:17 Re: [lammps-users] Order of coefficients in pair_coeff for pair_lj Stefan Paquay
14:39 Re: [lammps-users] Can LAMMPS calculate the tangent modulus of atoms likewise the atomic stress? Chowdhury, Sanjib Chandra
14:32 [lammps-users] Can LAMMPS calculate the tangent modulus of atoms likewise the atomic stress? hamid
13:40 Re: [lammps-users] About the *.sw file, formatting the file and error message John S. Rivas M.
12:19 Re: [lammps-users] Can it multiscale peridynamic model with PDLAMMPS? Axel Kohlmeyer
12:14 Re: [lammps-users] About the *.sw file, formatting the file and error message Axel Kohlmeyer
10:33 Re: [lammps-users] MM3 force field with dipoles on bonds Axel Kohlmeyer
09:10 Re: [lammps-users] Order of coefficients in pair_coeff for pair_lj Peter Brommer
09:02 [lammps-users] MM3 force field with dipoles on bonds Riccardo Bertossa
08:37 Re: [lammps-users] Order of coefficients in pair_coeff for pair_lj Nicola Molinari
08:34 [lammps-users] About the *.sw file, formatting the file and error message John S. Rivas M.
08:32 Re: [lammps-users] Order of coefficients in pair_coeff for pair_lj Axel Kohlmeyer
06:19 [lammps-users] Can it multiscale peridynamic model with PDLAMMPS? ??
04:32 Re: [lammps-users] Tables and special bonds + built-in vs. table potential Michał Kański
03:43 [lammps-users] Order of coefficients in pair_coeff for pair_lj Peter Brommer

January 14, 2018
13:35 Re: [lammps-users] errors in input file of lammps Axel Kohlmeyer
13:17 Re: [lammps-users] Inquiry on "Max Bonds/Atom" in Output Data File Axel Kohlmeyer
13:07 Re: [lammps-users] NAnPT Ensemble Axel Kohlmeyer
07:49 [lammps-users] NAnPT Ensemble Lu Wang

January 13, 2018
17:28 [lammps-users] Inquiry on "Max Bonds/Atom" in Output Data File MASATO KOIZUMI
17:07 Re: [lammps-users] errors in input file of lammps Stefan Paquay
13:20 [lammps-users] errors in input file of lammps S.M.Jafari
12:42 Re: [lammps-users] ERROR Axel Kohlmeyer
12:41 Re: [lammps-users] (no subject) Axel Kohlmeyer
12:24 [lammps-users] ERROR S.M.Jafari
12:22 [lammps-users] (no subject) sepehr Pourmorad
02:14 [lammps-users] Question about velocity of system center of mass in fix deform + nvt/SLLOD command yjruan@...4450...

January 12, 2018
14:32 Re: [lammps-users] Unphysical charges when using QEQ/point with multiple run statements Axel Kohlmeyer
13:37 Re: [lammps-users] Unphysical charges when using QEQ/point with multiple run statements Michael Humbert
13:23 Re: [lammps-users] Tables and special bonds + built-in vs. table potential Michał Kański
13:17 Re: [lammps-users] Unphysical charges when using QEQ/point with multiple run statements Ray Shan
12:48 [lammps-users] Unphysical charges when using QEQ/point with multiple run statements Michael Humbert
11:25 [lammps-users] Tables and special bonds + built-in vs. table potential Fabrizio Camerin
03:26 [lammps-users] 3D Poiseuille flow 孙强强

January 11, 2018
18:38 Re: [lammps-users] doping Zr in Cu bicrystal using set command Keshab Bashyal
15:27 Re: [lammps-users] Questions about rerun command Axel Kohlmeyer
15:21 [lammps-users] 回复: Questions about rerun command 1185201182
15:08 Re: [lammps-users] Questions about rerun command Axel Kohlmeyer
15:03 [lammps-users] Questions about rerun command 1185201182
12:42 Re: [lammps-users] Spatial profile of heat flux Abdourahmane Diaw
12:39 Re: [lammps-users] Spatial profile of heat flux Axel Kohlmeyer
12:31 Re: [lammps-users] Spatial profile of heat flux Abdourahmane Diaw
12:18 Re: [lammps-users] Regarding running loops in lammps Axel Kohlmeyer
12:15 Re: [lammps-users] Spatial profile of heat flux Axel Kohlmeyer
12:07 [lammps-users] Regarding running loops in lammps Arun Bikram Thapa
11:57 Re: [lammps-users] Spatial profile of heat flux Abdourahmane Diaw
11:51 Re: [lammps-users] Spatial profile of heat flux Axel Kohlmeyer
11:51 Re: [lammps-users] Spatial profile of heat flux Abdourahmane Diaw
11:48 Re: [lammps-users] Spatial profile of heat flux Abdourahmane Diaw
11:34 Re: [lammps-users] Spatial profile of heat flux Axel Kohlmeyer
11:25 [lammps-users] Spatial profile of heat flux Abdourahmane Diaw
08:52 Re: [lammps-users] barostat and thermostat Giacomo Fiorin
06:01 Re: [lammps-users] changing atom type in bond breaking process Fernanda S Teixeira
04:14 [lammps-users] barostat and thermostat Lu Wang
03:24 [lammps-users] 3D Poiseuille flow of MD by using lammps Qiangqiang Sun

January 10, 2018
23:35 Re: [lammps-users] doping Zr in Cu bicrystal using set command Xiao Jia
20:57 Re: [lammps-users] Inquiry on "1-3, 1-4 Bond Count Inconsistent Error" MASATO KOIZUMI
20:45 Re: [lammps-users] 答复: lmp_mpi.exe has stopped working Axel Kohlmeyer
20:08 [lammps-users] doping Zr in Cu bicrystal using set command Keshab Bashyal
18:43 [lammps-users] 答复: lmp_mpi.exe has stopped working wang man
15:17 Re: [lammps-users] The atoms number in Langevin thermal conductivity calculation Axel Kohlmeyer
15:14 Re: [lammps-users] error :Divide by 0 in variable formula Axel Kohlmeyer
14:38 Re: [lammps-users] lmp_mpi.exe has stopped working Axel Kohlmeyer
14:36 Re: [lammps-users] changing atom type in bond breaking process Axel Kohlmeyer
10:50 Re: [lammps-users] changing atom type in bond breaking process Fernanda S Teixeira
10:29 [lammps-users] lmp_mpi.exe has stopped working wang man
10:22 [lammps-users] problems with “temperature-induced phase transition of NiTi alloy” wang man
10:18 Re: [lammps-users] error :Divide by 0 in variable formula Jan Fikar
09:09 Re: [lammps-users] changing atom type in bond breaking process Axel Kohlmeyer
07:11 Re: [lammps-users] calculating an arbitrary summation Abolfazl Musavi
07:08 [lammps-users] changing atom type in bond breaking process Fernanda S Teixeira
05:42 Re: [lammps-users] compute chunk/atom gives wrong atom count Frank Zack
05:34 Re: [lammps-users] compute chunk/atom gives wrong atom count Axel Kohlmeyer
04:40 [lammps-users] compute chunk/atom gives wrong atom count Frank Zack
04:24 [lammps-users] problems with “temperature-induced phase transition of NiTi alloy” 王满
04:16 Re: [lammps-users] error :Divide by 0 in variable formula Axel Kohlmeyer
03:20 Re: [lammps-users] error :Divide by 0 in variable formula Jan Fikar
03:08 Re: [lammps-users] error :Divide by 0 in variable formula Jan Fikar
03:02 [lammps-users] error :Divide by 0 in variable formula Anuradha Singla

January 09, 2018
23:39 [lammps-users] The atoms number in Langevin thermal conductivity calculation Chuanxing Zhan
22:32 [lammps-users] problems with “temperature-induced phase transition of NiTi alloy” 王满
19:57 Re: [lammps-users] calculating an arbitrary summation Axel Kohlmeyer
11:14 Re: [lammps-users] hybrid/overlay eam, lj/cut and reax/c ERROR: All pair coeffs are not set Axel Kohlmeyer
11:10 Re: [lammps-users] hybrid/overlay eam, lj/cut and reax/c ERROR: All pair coeffs are not set Lianping WU
09:53 Re: [lammps-users] (no subject) Axel Kohlmeyer
09:50 [lammps-users] (no subject) Lianping WU
09:22 Re: [lammps-users] Hydration number Axel Kohlmeyer
09:04 Re: [lammps-users] Hydration number Lu Wang
08:34 Re: [lammps-users] Hydration number Giacomo Fiorin
08:02 Re: [lammps-users] hybrid/overlay eam, lj/cut and reax/c ERROR: All pair coeffs are not set Axel Kohlmeyer
07:11 [lammps-users] hybrid/overlay eam, lj/cut and reax/c ERROR: All pair coeffs are not set Lianping WU
05:11 Re: [lammps-users] what dose compute property/atom command do Axel Kohlmeyer
04:01 [lammps-users] 回复: what dose compute property/atom command do 1185201182
00:26 [lammps-users] Hydration number Lu Wang

January 08, 2018
17:22 [lammps-users] calculating an arbitrary summation Abolfazl Musavi
12:22 Re: [lammps-users] [EXTERNAL] SiC.Vashishta Thompson, Aidan
08:20 Re: [lammps-users] lammps out file for material studio. Sungwon Park
08:19 Re: [lammps-users] fix qeq(total charge constraint) Axel Kohlmeyer
08:18 Re: [lammps-users] lammps out file for material studio. Axel Kohlmeyer
08:15 Re: [lammps-users] lammps out file for material studio. Albert Brown
08:12 Re: [lammps-users] lammps out file for material studio. Sungwon Park
07:00 [lammps-users] Fitting hyperelastic surface on experimental data Asadollahzadeh
05:08 Re: [lammps-users] lammps out file for material studio. Axel Kohlmeyer

January 07, 2018
22:33 Re: [lammps-users] lammps out file for material studio. Albert Brown
15:07 Re: [lammps-users] lammps out file for material studio. Axel Kohlmeyer
14:47 [lammps-users] fix qeq(total charge constraint) Sungwon Park
10:27 Re: [lammps-users] lammps out file for material studio. Albert Brown
10:02 Re: [lammps-users] what dose compute property/atom command do Axel Kohlmeyer
09:50 [lammps-users] 回复: what dose compute property/atom command do 1185201182
09:46 [lammps-users] lammps out file for material studio. Sungwon Park
09:41 Re: [lammps-users] (no subject) Albert Brown
09:11 Re: [lammps-users] what dose compute property/atom command do Axel Kohlmeyer
08:50 [lammps-users] what dose compute property/atom command do 1185201182

January 06, 2018
20:43 Re: [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Wenqiang Liu
20:42 Re: [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Wenqiang Liu
17:27 Re: [lammps-users] (no subject) Axel Kohlmeyer
17:22 Re: [lammps-users] groups with dynamic number of atoms Axel Kohlmeyer
16:55 Re: [lammps-users] Inquiry on "1-3, 1-4 Bond Count Inconsistent Error" Axel Kohlmeyer
16:27 Re: [lammps-users] Inquiry on "1-3, 1-4 Bond Count Inconsistent Error" MASATO KOIZUMI
13:49 Re: [lammps-users] Wrong number of dihedrals after create_bonds single/dihedral Bernard Rousseau
10:48 Re: [lammps-users] Data file Andrew Jewett
09:44 Re: [lammps-users] Inquiry on "1-3, 1-4 Bond Count Inconsistent Error" Axel Kohlmeyer
09:12 Re: [lammps-users] Wrong number of dihedrals after create_bonds single/dihedral Axel Kohlmeyer
07:09 [lammps-users] Wrong number of dihedrals after create_bonds single/dihedral Bernard Rousseau
05:15 [lammps-users] (no subject) Satbir Singh
02:32 [lammps-users] Inquiry on "1-3, 1-4 Bond Count Inconsistent Error" MASATO KOIZUMI
01:22 [lammps-users] groups with dynamic number of atoms Farzane Ramazani

January 05, 2018
16:49 Re: [lammps-users] [EXTERNAL] how to use ewald for tip4p water model? Moore, Stan
15:52 [lammps-users] Symmetry change from Monoclinic to Orthorhombic in Moltemplate or LAMMPS Baig abdullah Al muhit
12:53 Re: [lammps-users] (no subject) Giacomo Fiorin
12:27 [lammps-users] how to use ewald for tip4p water model? seyyed mohammad javad mousavi
11:31 [lammps-users] (no subject) Satbir Singh
10:29 Re: [lammps-users] (no subject) Axel Kohlmeyer
10:06 [lammps-users] (no subject) Satbir Singh
09:12 [lammps-users] Help set priorities for the OpenKIM Project Ellad Tadmor
08:32 Re: [lammps-users] Data file Axel Kohlmeyer
05:51 Re: [lammps-users] how to use tip4p water model for big simulation box? Axel Kohlmeyer
05:06 [lammps-users] how to use tip4p water model for big simulation box? seyyed mohammad javad mousavi
04:41 Re: [lammps-users] Can lammps calculate rotational spectra( rotational density of state) ? Axel Kohlmeyer
04:34 Re: [lammps-users] Can lammps calculate rotational spectra( rotational density of state) ? Stefan Paquay
04:04 Re: [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Axel Kohlmeyer
03:31 Re: [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Michał Kański
01:01 Re: [lammps-users] Can lammps calculate rotational spectra( rotational density of state) ? liyi bai

January 04, 2018
22:32 [lammps-users] Data file Sugan Ya
18:19 Re: [lammps-users] Unsatisfied external latte. Cheeseman, Phillip Allen
17:30 Re: [lammps-users] Unsatisfied external latte. Axel Kohlmeyer
17:22 [lammps-users] Unsatisfied external latte. Cheeseman, Phillip Allen
16:01 Re: [lammps-users] Error Related to Water Evaporation Problem Axel Kohlmeyer
15:10 Re: [lammps-users] [Non-DoD Source] Re: Segmentation fault with Hybrid Pair Style (UNCLASSIFIED) Shumeyko, Christopher M CTR USARMY RDECOM ARL (US)
14:39 Re: [lammps-users] Segmentation fault with Hybrid Pair Style (UNCLASSIFIED) Axel Kohlmeyer
14:26 [lammps-users] Error Related to Water Evaporation Problem Kashyap, Jatin
14:13 [lammps-users] Segmentation fault with Hybrid Pair Style (UNCLASSIFIED) Shumeyko, Christopher M CTR USARMY RDECOM ARL (US)
08:46 Re: [lammps-users] Gpu package + AMD Radeon Axel Kohlmeyer
07:57 Re: [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Wenqiang Liu
07:49 [lammps-users] Gpu package + AMD Radeon click comber
07:44 Re: [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Michał Kański
07:29 [lammps-users] Where can I find the scripts on http://lammps.sandia.gov/scripts.html before? Wenqiang Liu
07:25 Re: [lammps-users] Initial configuration of atoms in PDB Axel Kohlmeyer
06:03 [lammps-users] Initial configuration of atoms in PDB Robert McAllen
05:05 [lammps-users] 答复: Can fix_GCMC only inserte particles in a specified region? Bida Zhu
03:30 Re: [lammps-users] Can fix_GCMC only inserte particles in a specified region? Axel Kohlmeyer
03:23 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output Axel Kohlmeyer
03:19 Re: [lammps-users] ERROR: Invalid thermo keyword in variable formula (../variable.cpp:1512) Axel Kohlmeyer
02:33 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output Stefan Paquay
02:28 [lammps-users] Can fix_GCMC only inserte particles in a specified region? Bida Zhu
00:28 [lammps-users] ERROR: Invalid thermo keyword in variable formula (../variable.cpp:1512) rushi gite

January 03, 2018
22:21 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output William Pisani
12:24 Re: [lammps-users] Inquiry on Bond Section of Write_Data File Axel Kohlmeyer
12:11 Re: [lammps-users] Inquiry on Bond Section of Write_Data File MASATO KOIZUMI
11:56 Re: [lammps-users] Inquiry on Bond Section of Write_Data File Axel Kohlmeyer
11:19 [lammps-users] Inquiry on Bond Section of Write_Data File MASATO KOIZUMI
09:20 Re: [lammps-users] Assigning Force Field Parameters and Partial Charge Axel Kohlmeyer
09:04 Re: [lammps-users] Assigning Force Field Parameters and Partial Charge Robert McAllen
08:47 Re: [lammps-users] please help me Stefan Paquay
05:47 Re: [lammps-users] Setting up run for a very long time and finally get bad termination Wenqiang Liu
04:16 Re: [lammps-users] Setting up run for a very long time and finally get bad termination Axel Kohlmeyer
02:57 Re: [lammps-users] Setting up run for a very long time and finally get bad termination Wenqiang Liu

January 02, 2018
23:44 [lammps-users] please help me Samiya Al-Riyami
19:58 Re: [lammps-users] Can lammps calculate rotational spectra( rotational density of state) ? Axel Kohlmeyer
18:28 Re: [lammps-users] Setting up run for a very long time and finally get bad termination Axel Kohlmeyer
18:13 Re: [lammps-users] Setting up run for a very long time and finally get bad termination Wenqiang Liu
17:40 Re: [lammps-users] Setting up run for a very long time and finally get bad termination Axel Kohlmeyer
17:20 [lammps-users] Setting up run for a very long time and finally get bad termination Wenqiang Liu
15:21 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Axel Kohlmeyer
15:01 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni
13:35 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni
10:57 Re: [lammps-users] [EXTERNAL] Minimum image convention of triclinic boxes Thompson, Aidan
10:42 Re: [lammps-users] Assigning Force Field Parameters and Partial Charge Axel Kohlmeyer
10:19 [lammps-users] Assigning Force Field Parameters and Partial Charge Robert McAllen
10:15 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni
10:09 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Axel Kohlmeyer
08:45 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni
08:39 Re: [lammps-users] Fw:Error in pair_style hybrid and tersoff Axel Kohlmeyer
08:14 [lammps-users] Fw:Error in pair_style hybrid and tersoff abbasabouei@...16...

January 01, 2018
16:15 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni
14:41 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Axel Kohlmeyer
13:49 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni
13:30 Re: [lammps-users] Defining pair_coeff for EAM potential in lammps data file Axel Kohlmeyer
12:21 Re: [lammps-users] How to deal with a complex molecule? Andrew Jewett
11:35 [lammps-users] How to deal with a complex molecule? Robert McAllen
09:39 [lammps-users] Defining pair_coeff for EAM potential in lammps data file Arif Abdullah Rokoni

December 30, 2017
21:43 [lammps-users] Can lammps calculate rotational spectra( rotational density of state) ? liyi bai
19:43 Re: [lammps-users] Data file conversion using charmm2lammps.pl and topo files shows missing bond parameter Mohan Yasodharababu
05:19 Re: [lammps-users] Data file conversion using charmm2lammps.pl and topo files shows missing bond parameter Axel Kohlmeyer
05:08 Re: [lammps-users] qeq/reax and static charges in non-ReaxFF subsystem Axel Kohlmeyer

December 29, 2017
23:47 [lammps-users] qeq/reax and static charges in non-ReaxFF subsystem Vadim Sultanov
20:27 Re: [lammps-users] Data file conversion using charmm2lammps.pl and topo files shows missing bond parameter Mohan Yasodharababu
19:33 Re: [lammps-users] Data file conversion using charmm2lammps.pl and topo files shows missing bond parameter Axel Kohlmeyer
18:45 [lammps-users] Data file conversion using charmm2lammps.pl and topo files shows missing bond parameter Mohan Yasodharababu
08:42 Re: [lammps-users] Using fix print Axel Kohlmeyer
08:25 Re: [lammps-users] Using fix print Gideon Simpson
06:44 Re: [lammps-users] Using fix print Axel Kohlmeyer
06:41 [lammps-users] Using fix print Gideon Simpson

December 28, 2017
15:36 Re: [lammps-users] how to consider the tangential force in wall command Axel Kohlmeyer
08:27 Re: [lammps-users] how to consider the tangential force in wall command hamid
07:53 Re: [lammps-users] (no subject) Axel Kohlmeyer
06:46 [lammps-users] (no subject) neda Sanchuli

December 27, 2017
15:04 Re: [lammps-users] Hydrogen bond Axel Kohlmeyer
14:52 Re: [lammps-users] output the forces Axel Kohlmeyer
14:48 Re: [lammps-users] Fix atom/swap command doesn't work well Axel Kohlmeyer
11:57 Re: [lammps-users] output the forces Dezhao Huang
05:13 Re: [lammps-users] Fix atom/swap command doesn't work well shin kiyohara
04:50 [lammps-users] output the forces 罗 爽

December 26, 2017
22:50 [lammps-users] Hydrogen bond Robert McAllen
12:58 Re: [lammps-users] dear axel, Axel Kohlmeyer
11:42 [lammps-users] dear axel, seyyed mohammad javad mousavi
10:57 Re: [lammps-users] can i use kspace_style ewald for tip4p water model? Axel Kohlmeyer
10:47 Re: [lammps-users] Fix atom/swap command doesn't work well Axel Kohlmeyer
09:59 [lammps-users] can i use kspace_style ewald for tip4p water model? seyyed mohammad javad mousavi
06:50 Re: [lammps-users] how to consider the tangential force in wall command Axel Kohlmeyer
06:43 Re: [lammps-users] Potential file not working Axel Kohlmeyer

December 25, 2017
23:54 [lammps-users] Potential file not working Anuradha Singla
14:23 [lammps-users] how to consider the tangential force in wall command hamid
08:35 Re: [lammps-users] Harmonic wall to control external pressure in non-periodic direction ONOFRIO, Nicolas [AP]
05:29 [lammps-users] Fix atom/swap command doesn't work well shin kiyohara

December 24, 2017
16:08 Re: [lammps-users] Issue with set/fix property/atom Stefan Paquay
16:03 Re: [lammps-users] Issue with set/fix property/atom Stefan Paquay
15:45 Re: [lammps-users] Issue with set/fix property/atom Axel Kohlmeyer
15:00 [lammps-users] Issue with set/fix property/atom Stefan Paquay

December 23, 2017
15:19 Re: [lammps-users] Data file Axel Kohlmeyer
15:13 Re: [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output Axel Kohlmeyer
15:10 Re: [lammps-users] how to use F3C water model in lammps? Axel Kohlmeyer
15:09 Re: [lammps-users] Fix mscg and parallel use via MPI Axel Kohlmeyer
14:15 Re: [lammps-users] Kinetic Process Giacomo Fiorin
14:00 Re: [lammps-users] USER-COLVARS package, i-PI: question about steered md and thermostats Giacomo Fiorin
07:39 [lammps-users] Kinetic Process Robert McAllen
03:09 [lammps-users] how to use F3C water model in lammps? seyyed mohammad javad mousavi
02:19 Re: [lammps-users] How to make a neutral sphere by Lammps bahman daneshian
01:32 Re: [lammps-users] How to make a neutral sphere by Lammps bahman daneshian

December 22, 2017
16:01 [lammps-users] LAMMPS Getting Stuck Prior to Thermo Output William Pisani
07:23 [lammps-users] Fix mscg and parallel use via MPI Henrik Hariman
01:04 [lammps-users] Data file Amir Hossein Saeedi

December 21, 2017
23:17 [lammps-users] Simulating a Kinetic Process Robert McAllen
20:41 Re: [lammps-users] Harmonic wall to control external pressure in non-periodic direction Axel Kohlmeyer
19:57 [lammps-users] Harmonic wall to control external pressure in non-periodic direction ONOFRIO, Nicolas [AP]
17:13 [lammps-users] how is this *.eam.alloy-file in setfl format? Frank Zack
14:33 Re: [lammps-users] Position of timestep command in input file Spearot, Douglas
14:05 Re: [lammps-users] passing string arguments to write_dump Gideon Simpson
13:18 Re: [lammps-users] passing string arguments to write_dump Axel Kohlmeyer
12:55 [lammps-users] passing string arguments to write_dump Gideon Simpson
12:34 Re: [lammps-users] USER-COLVARS package, i-PI: question about steered md and thermostats Axel Kohlmeyer
12:16 Re: [lammps-users] Position of timestep command in input file Diaz,Adrian
12:10 Re: [lammps-users] Position of timestep command in input file Axel Kohlmeyer
11:44 Re: [lammps-users] Position of timestep command in input file Spearot, Douglas
08:38 [lammps-users] Enquries about CdS/NiS doped zeolite X Vishal Vasudevan
08:13 [lammps-users] USER-COLVARS package, i-PI: question about steered md and thermostats Nicolas Künzel
07:21 Re: [lammps-users] Position of timestep command in input file Axel Kohlmeyer
06:35 [lammps-users] Position of timestep command in input file Spearot, Douglas
05:46 Re: [lammps-users] I have some question about whether I can specify the bonds number of an atom? Axel Kohlmeyer
03:33 Re: [lammps-users] Mixing EAM potentilas to create alloy potential in LAMMPS Julien Guénolé
02:41 [lammps-users] I have some question about whether I can specify the bonds number of an atom? 王余
02:11 [lammps-users] Atom type/ Data file Amir Hossein Saeedi

December 20, 2017
17:50 Re: [lammps-users] special_bonds apply to Tersoff pair style Jibao Lu
13:33 Re: [lammps-users] relaxaation Si bulk Axel Kohlmeyer
13:11 [lammps-users] relaxaation Si bulk Djelel Djelloul
12:49 [lammps-users] Help set priorities for the OpenKIM Project Ellad Tadmor
09:32 Re: [lammps-users] Umbrella Sampling/ PMF Axel Kohlmeyer
09:07 Re: [lammps-users] Umbrella Sampling/ PMF Robert McAllen
09:05 Re: [lammps-users] Error when using potential GaAs.bop.table Axel Kohlmeyer
09:03 Re: [lammps-users] Fwd: simulation of magnetic dipoles Axel Kohlmeyer
08:39 Re: [lammps-users] Umbrella Sampling/ PMF Axel Kohlmeyer
08:13 [lammps-users] Umbrella Sampling/ PMF Robert McAllen
07:59 Re: [lammps-users] bond swap within a single chain Wes Barnett
07:10 Re: [lammps-users] special_bonds apply to Tersoff pair style Axel Kohlmeyer
06:55 [lammps-users] special_bonds apply to Tersoff pair style Jibao Lu
00:31 [lammps-users] Fwd: simulation of magnetic dipoles Konark B

December 19, 2017
23:24 [lammps-users] Error when using potential GaAs.bop.table 陈程昊
21:42 Re: [lammps-users] Interfacial tension (IFT) Ahmed E. Ismail
19:59 Re: [lammps-users] Different potential energy calculation results Xiao Jia
19:37 Re: [lammps-users] Different potential energy calculation results Axel Kohlmeyer
19:36 Re: [lammps-users] Different potential energy calculation results Xiao Jia
19:20 Re: [lammps-users] Different potential energy calculation results Axel Kohlmeyer
19:12 Re: [lammps-users] Different potential energy calculation results Xiao Jia
18:56 Re: [lammps-users] relaxation system Axel Kohlmeyer
18:52 Re: [lammps-users] Different potential energy calculation results Axel Kohlmeyer
16:05 Re: [lammps-users] Different potential energy calculation results Xiao Jia
15:56 Re: [lammps-users] Different potential energy calculation results Ray Shan
15:42 Re: [lammps-users] Different potential energy calculation results Xiao Jia
15:32 [lammps-users] rerun error with reaxff: hbondchk failed: zyrjewelz
15:01 Re: [lammps-users] Different potential energy calculation results Xiao Jia
14:55 Re: [lammps-users] Different potential energy calculation results Axel Kohlmeyer
14:43 [lammps-users] relaxation system Djelel Djelloul
14:36 Re: [lammps-users] Different potential energy calculation results Xiao Jia
13:05 Re: [lammps-users] bond swap within a single chain Stefan Shi
12:55 Re: [lammps-users] bond swap within a single chain Wes Barnett
12:40 Re: [lammps-users] bond swap within a single chain Stefan Shi
12:26 Re: [lammps-users] Heat flux application Axel Kohlmeyer
09:58 Re: [lammps-users] Combining Atom Style and Python Style Variables Axel Kohlmeyer
09:49 [lammps-users] Combining Atom Style and Python Style Variables Brenda Rubenstein
09:02 Re: [lammps-users] Rigid body breaking Mohd Ibrahim
08:19 Re: [lammps-users] bond swap within a single chain Guang Shi
07:50 Re: [lammps-users] Rigid body breaking Axel Kohlmeyer
07:48 Re: [lammps-users] Shock propagation , script not running Axel Kohlmeyer
07:45 Re: [lammps-users] Different potential energy calculation results Axel Kohlmeyer
06:17 Re: [lammps-users] Rigid body breaking Stefan Paquay
06:13 Re: [lammps-users] bond swap within a single chain Wes Barnett
03:58 Re: [lammps-users] Rigid body breaking Stefan Paquay
02:48 Re: [lammps-users] Shock propagation , script not running Anders Hafreager
01:33 [lammps-users] Different potential energy calculation results Xiao Jia
00:47 Re: [lammps-users] Input file for cylendical shape of Li-Na-K-F mixture Zahed Ghelichkhah

December 18, 2017
23:39 [lammps-users] Rigid body breaking Mohd Ibrahim
23:10 [lammps-users] Heat flux application ravindra dhumal
22:50 [lammps-users] Shock propagation , script not running anuradha singla
22:31 [lammps-users] Mixing EAM potentilas to create alloy potential in LAMMPS ankur agrawal
21:54 Re: [lammps-users] deform in a non-periodic direction Rajesh
19:54 Re: [lammps-users] Input file for cylendical shape of Li-Na-K-F mixture Axel Kohlmeyer
19:24 Re: [lammps-users] Input file for cylendical shape of Li-Na-K-F mixture Zahed Ghelichkhah
16:00 Re: [lammps-users] Input file for cylendical shape of Li-Na-K-F mixture Axel Kohlmeyer
15:55 Re: [lammps-users] BOX EXPANSION DURING EQUILIBRATION Axel Kohlmeyer
15:32 [lammps-users] bond swap within a single chain Stefan Shi
15:02 Re: [lammps-users] deform in a non-periodic direction Axel Kohlmeyer
14:54 Re: [lammps-users] deform in a non-periodic direction Khourshaei Shar, Ali
14:48 Re: [lammps-users] deform in a non-periodic direction Axel Kohlmeyer
14:31 [lammps-users] Input file for cylendical shape of Li-Na-K-F mixture Zahed Ghelichkhah
14:30 [lammps-users] Σχετ: BOX EXPANSION DURING EQUILIBRATION Γρηγορης Δεδες
14:27 [lammps-users] deform in a non-periodic direction Khourshaei Shar, Ali
14:22 Re: [lammps-users] Simulation of Si3N4 Chowdhury, Sanjib Chandra
13:23 Re: [lammps-users] Simulation of Si3N4 Axel Kohlmeyer
13:20 Re: [lammps-users] Output analysis Giacomo Fiorin
13:20 Re: [lammps-users] Output analysis Axel Kohlmeyer
12:41 [lammps-users] Output analysis Robert McAllen
12:32 Re: [lammps-users] Shifted periodic boundary conditions Axel Kohlmeyer
12:19 [lammps-users] Shifted periodic boundary conditions Emir Kocer
07:52 Re: [lammps-users] plott fix result lammps Giacomo Fiorin
01:27 [lammps-users] plott fix result lammps Djelel Djelloul

December 17, 2017
21:56 Re: [lammps-users] dump to force Axel Kohlmeyer
20:22 Re: [lammps-users] dump to force liyi bai
20:01 Re: [lammps-users] dump to force Axel Kohlmeyer
19:53 Re: [lammps-users] dump to force liyi bai
19:45 Re: [lammps-users] dump to force Axel Kohlmeyer
19:35 [lammps-users] dump to force liyi bai
18:06 [lammps-users] Simulation of Si3N4 Khourshaei Shar, Ali
17:35 Re: [lammps-users] Simulation of Si3N4 Axel Kohlmeyer
14:45 Re: [lammps-users] BOX EXPANSION DURING EQUILIBRATION Axel Kohlmeyer
13:25 [lammps-users] Simulation of Si3N4 Khourshaei Shar, Ali
11:17 [lammps-users] BOX EXPANSION DURING EQUILIBRATION Γρηγορης Δεδες
07:50 Re: [lammps-users] About some questions for simulating sliding friction using ReaxFF Axel Kohlmeyer
06:58 [lammps-users] About some questions for simulating sliding friction using ReaxFF 詹胜鹏
03:25 [lammps-users] The infile section of fix rigid is somewhat wrong Sonu Kumar

December 16, 2017
13:53 Re: [lammps-users] PKA cascade time step Julien Guénolé
12:22 Re: [lammps-users] PKA cascade time step Axel Kohlmeyer
12:18 Re: [lammps-users] How to make a neutral sphere by Lammps Axel Kohlmeyer
12:12 Re: [lammps-users] Increasing atom-ID when implementing "fix gcmc" Axel Kohlmeyer
08:09 [lammps-users] Interfacial tension (IFT) Robert McAllen
07:50 [lammps-users] PKA cascade time step ‪Meral Sharkas‬ ‪
03:07 [lammps-users] Increasing atom-ID when implementing "fix gcmc" Dingbin Huang
01:23 [lammps-users] How to make a neutral sphere by Lammps bahman daneshian

December 15, 2017
18:34 Re: [lammps-users] Interfacial tension (IFT) Ahmed E. Ismail
16:21 [lammps-users] ?????? Can lammps do the correlation function for peratom property 1185201182
15:56 Re: [lammps-users] Reaxff c/h/o energy conservation and temperature drift in NVE Thomas Zhang
15:41 Re: [lammps-users] Force field for chemical reactions Axel Kohlmeyer
11:44 Re: [lammps-users] Interfacial tension (IFT) Giacomo Fiorin
11:41 Re: [lammps-users] Interfacial tension (IFT) Giacomo Fiorin
11:08 [lammps-users] Force field for chemical reactions Amir Hossein Saeedi
11:03 [lammps-users] Interfacial tension (IFT) Robert McAllen
10:59 [lammps-users] Cloud based molecular simulations michael mwangi
09:39 Re: [lammps-users] About fix set force Axel Kohlmeyer
09:38 Re: [lammps-users] About fix set force Stefan Paquay
09:31 Re: [lammps-users] Can lammps do the correlation function for per atom property Steve Plimpton
09:28 Re: [lammps-users] On adding a density and temperature dependent Yukawa force in LAMMPS Steve Plimpton
08:52 [lammps-users] About fix set force Arun Bikram Thapa
04:51 [lammps-users] Can lammps do the correlation function for per atom property 1185201182
04:21 Re: [lammps-users] Simulate an Einstein solid pmoreira

December 14, 2017
12:45 Re: [lammps-users] Simulate an Einstein solid Michał Kański
12:22 Re: [lammps-users] lammps gpu input file Giacomo Fiorin
12:10 Re: [lammps-users] Simulate an Einstein solid Stefan Paquay
10:11 Re: [lammps-users] minimize coordinates only Ray Shan
10:05 [lammps-users] Simulate an Einstein solid pmoreira
09:39 Re: [lammps-users] lammps gpu input file Vijay Choyal
08:28 Re: [lammps-users] lammps gpu input file Giacomo Fiorin
07:24 Re: [lammps-users] minimize coordinates only Stefan Paquay
07:13 [lammps-users] lammps gpu input file Vijay Choyal
07:04 Re: [lammps-users] Build process of module ATC Reuti
06:49 [lammps-users] minimize coordinates only Adriano Santana Sanchez
05:51 Re: [lammps-users] Reaxff c/h/o energy conservation and temperature drift in NVE Benjamin Jensen
05:24 [lammps-users] Position Available Gregory A. Voth
00:50 Re: [lammps-users] Reax Energy function Rajesh
00:20 [lammps-users] Reax Energy function Anubhav Roy

December 13, 2017
16:34 Re: [lammps-users] average per-atom variable over neighbor atoms Axel Kohlmeyer
16:29 Re: [lammps-users] please report this bug Axel Kohlmeyer
16:05 [lammps-users] average per-atom variable over neighbor atoms Yang Sun
16:02 [lammps-users] please report this bug JUAN ANDRES DE LA ROSA ABAD
15:08 Re: [lammps-users] Reaxff c/h/o energy conservation and temperature drift in NVE Ray Shan
14:58 [lammps-users] Reaxff c/h/o energy conservation and temperature drift in NVE Thomas Zhang
11:14 Re: [lammps-users] On adding a density and temperature dependent Yukawa force in LAMMPS Abdourahmane Diaw
11:12 Re: [lammps-users] On adding a density and temperature dependent Yukawa force in LAMMPS Abdourahmane Diaw
09:37 Re: [lammps-users] Questions about loop in lammps Axel Kohlmeyer
07:48 Re: [lammps-users] Questions about loop in lammps Giacomo Fiorin
07:30 Re: [lammps-users] fix heat/ehex for NEMD simulation Steve Plimpton
07:26 Re: [lammps-users] On adding a density and temperature dependent Yukawa force in LAMMPS Steve Plimpton
07:22 Re: [lammps-users] Density and Viscosity calculation for Poiseuille Flow Steve Plimpton
07:20 Re: [lammps-users] ethanol fuel with nanoparticle radiative heat transfer Steve Plimpton
07:16 Re: [lammps-users] Reagarding glu potential Steve Plimpton
05:06 Re: [lammps-users] Build process of module ATC Axel Kohlmeyer
03:56 [lammps-users] Build process of module ATC Reuti
01:43 Re: [lammps-users] Questions about loop in lammps Xuechen Zheng
00:54 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM bahman daneshian

December 12, 2017
21:01 Re: [lammps-users] Questions about loop in lammps Axel Kohlmeyer
18:17 Re: [lammps-users] Questions about loop in lammps Xuechen Zheng
15:23 Re: [lammps-users] Making data file with a hybrid force-field Andrew Jewett
13:02 [lammps-users] fix heat/ehex for NEMD simulation Daipayan Sarkar
12:42 Re: [lammps-users] (no subject) Axel Kohlmeyer
12:39 Re: [lammps-users] (no subject) neda Sanchuli
12:28 Re: [lammps-users] Making data file with a hybrid force-field Axel Kohlmeyer
12:11 [lammps-users] Fwd: Making data file with a hybrid force-field Robert McAllen
11:59 Re: [lammps-users] Making data file with a hybrid force-field Giacomo Fiorin
11:44 Re: [lammps-users] (no subject) Axel Kohlmeyer
11:36 [lammps-users] (no subject) neda Sanchuli
11:27 [lammps-users] Making data file with a hybrid force-field Robert McAllen
09:23 Re: [lammps-users] run metadynamics using Users-COLVARS Giacomo Fiorin
09:19 Re: [lammps-users] run metadynamics using Users-COLVARS liyi bai
09:05 Re: [lammps-users] Questions about loop in lammps Axel Kohlmeyer
09:02 Re: [lammps-users] Questions about loop in lammps Giacomo Fiorin
08:53 [lammps-users] Questions about loop in lammps Xuechen Zheng
08:31 Re: [lammps-users] run metadynamics using Users-COLVARS Giacomo Fiorin
08:20 [lammps-users] Questions about loop in lammps Xuechen Zheng
02:14 [lammps-users] run metadynamics using Users-COLVARS liyi bai
00:48 Re: [lammps-users] Umbrella Sampling Amir Hossein Saeedi

December 11, 2017
23:47 Re: [lammps-users] "Bond atom missing in image check" in parallel run of crystal structure with bond list Jibao Lu
14:53 [lammps-users] On adding a density and temperature dependent Yukawa force in LAMMPS Abdourahmane Diaw
14:43 Re: [lammps-users] Umbrella Sampling Giacomo Fiorin
12:48 [lammps-users] Umbrella Sampling Amir Hossein Saeedi
12:36 Re: [lammps-users] "Bond atom missing in image check" in parallel run of crystal structure with bond list Axel Kohlmeyer
12:28 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM Axel Kohlmeyer
12:16 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM bahman daneshian
10:41 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM Axel Kohlmeyer
10:18 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM bahman daneshian
08:32 [lammps-users] Density and Viscosity calculation for Poiseuille Flow Sisir Das
08:13 [lammps-users] "Bond atom missing in image check" in parallel run of crystal structure with bond list Jibao Lu
07:47 Re: [lammps-users] Radius of gyration components Axel Kohlmeyer
06:53 [lammps-users] Radius of gyration components Sengupta, S.
06:17 Re: [lammps-users] Special_bonds command-amber or dreiding keywords Axel Kohlmeyer
06:03 [lammps-users] PhD & Postdoc Positions in Computational Materials Science Julien Guénolé
06:01 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM Axel Kohlmeyer
00:48 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM bahman daneshian

December 09, 2017
12:51 Re: [lammps-users] Long range ewald force output teddy baker
09:07 [lammps-users] Special_bonds command-amber or dreiding keywords saly jackson

December 08, 2017
22:48 [lammps-users] Regarding potential Prakash Makwana
15:27 Re: [lammps-users] Long range ewald force output Moore, Stan
15:23 [lammps-users] ethanol fuel with nanoparticle radiative heat transfer zyrjewelz
12:48 Re: [lammps-users] [EXTERNAL] Re: Reg. AtC Fix_flux and computational domain problem Templeton, Jeremy Alan
11:29 Re: [lammps-users] Long range ewald force output teddy baker
11:24 [lammps-users] Long range ewald force output teddy baker
11:20 [lammps-users] Reagarding glu potential Prakash Makwana
09:29 Re: [lammps-users] Random packing of granular spheres Axel Kohlmeyer
06:21 [lammps-users] Random packing of granular spheres skamath
05:15 Re: [lammps-users] Poisson's effect during uniaxial strain in NVT Julien Guénolé

December 07, 2017
11:33 Re: [lammps-users] Total energy calculation Gideon Simpson
11:29 Re: [lammps-users] Total energy calculation Axel Kohlmeyer
09:39 Re: [lammps-users] Total energy calculation Stefan Paquay
09:36 Re: [lammps-users] Total energy calculation Stefan Paquay
09:29 [lammps-users] Total energy calculation Gideon Simpson
07:36 Re: [lammps-users] Pressure driven Poiseuille flow Steve Plimpton
07:33 Re: [lammps-users] Reg. AtC Fix_flux and computational domain problem Steve Plimpton
07:32 Re: [lammps-users] Calculate net force on a group of atoms Steve Plimpton
07:19 Re: [lammps-users] Lammps data file Myatnoe Suukyi
04:49 Re: [lammps-users] ReaxFF MD simulation problem higuk

December 06, 2017
22:42 Re: [lammps-users] dump particular type atom in subgroup liyi bai
22:40 Re: [lammps-users] ERROR: New bond exceeded bonds per atom in fix bond/create Vanessa Oklejas
22:35 Re: [lammps-users] ERROR: New bond exceeded bonds per atom in fix bond/create Axel Kohlmeyer
22:31 Re: [lammps-users] dump particular type atom in subgroup Axel Kohlmeyer
21:46 [lammps-users] dump particular type atom in subgroup liyi bai
21:12 [lammps-users] ERROR: New bond exceeded bonds per atom in fix bond/create Vanessa Oklejas
16:14 Re: [lammps-users] Lammps data file Andrew Jewett
15:39 Re: [lammps-users] ERROR on proc 0 Giacomo Fiorin
15:28 [lammps-users] ERROR on proc 0 Khourshaei Shar, Ali
12:03 Re: [lammps-users] fix deform alternate Rajesh
10:23 Re: [lammps-users] The viscosity calculated by two methods is not inconsistent. Eric Murphy
08:59 [lammps-users] The viscosity calculated by two methods is not inconsistent. 1185201182
07:52 Re: [lammps-users] fix deform alternate Michael King
07:18 Re: [lammps-users] fix deform alternate Rajesh
00:01 [lammps-users] Poisson's effect during uniaxial strain in NVT kia krn

December 05, 2017
23:51 [lammps-users] Pressure driven Poiseuille flow Sisir Das
15:05 Re: [lammps-users] partial force in virial Axel Kohlmeyer
12:09 Re: [lammps-users] Lammps version m n
12:04 Re: [lammps-users] Lammps version Axel Kohlmeyer
11:52 [lammps-users] Lammps version m n
10:25 Re: [lammps-users] fix deform alternate Rajesh
09:57 Re: [lammps-users] fix deform alternate Michael King
07:38 Re: [lammps-users] Lammps data file Myatnoe Suukyi
07:19 Re: [lammps-users] fix deform alternate Rajesh
07:14 Re: [lammps-users] fix deform alternate Michael King
05:39 Re: [lammps-users] Needed modules Stefan Paquay
05:37 Re: [lammps-users] 12-bit tables for long-range coulomb Stefan Paquay
05:17 [lammps-users] Needed modules Henrik Hariman
04:40 [lammps-users] 12-bit tables for long-range coulomb Lamm Gro
02:54 Re: [lammps-users] partial force in virial Abolfazl Musavi
02:19 [lammps-users] fix deform alternate Rajesh

December 04, 2017
22:59 Re: [lammps-users] [EXTERNAL] Re: GCMC can not fully fill a box with particles for high MC movement frequency Han Liu
20:35 [lammps-users] problems about neb calculations Alice
19:18 Re: [lammps-users] partial force in virial Axel Kohlmeyer
19:08 [lammps-users] partial force in virial Abolfazl Musavi
13:57 Re: [lammps-users] Reg. AtC Fix_flux and computational domain problem Parmar, Vinod
13:06 [lammps-users] Using lammps's compute heat flux rambod yousefzadeh tabasi
10:50 Re: [lammps-users] Changing boundary conditions in polymer Axel Kohlmeyer
10:10 Re: [lammps-users] Changing boundary conditions in polymer Rajesh
10:05 Re: [lammps-users] Changing boundary conditions in polymer Giacomo Fiorin
09:58 Re: [lammps-users] Lammps data file Axel Kohlmeyer
09:42 Re: [lammps-users] Changing boundary conditions in polymer Rajesh
09:39 Re: [lammps-users] Calculate net force on a group of atoms Rajesh
08:53 [lammps-users] Lammps data file Amir Hossein Saeedi
08:11 Re: [lammps-users] fix avg/time mode vector error Steve Plimpton
08:06 Re: [lammps-users] Calculate net force on a group of atoms Steve Plimpton
08:03 Re: [lammps-users] Reg. AtC Fix_flux and computational domain problem Steve Plimpton
07:26 Re: [lammps-users] Changing boundary conditions in polymer Giacomo Fiorin
07:21 Re: [lammps-users] bond,angle across boundary from VMD topo Yafan Yang
07:13 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Axel Kohlmeyer
07:12 Re: [lammps-users] Free energy calculation using TI method Stefan Paquay
07:08 Re: [lammps-users] On the use of COMB potential for omrfnoy silicon dioxide Axel Kohlmeyer
06:58 Re: [lammps-users] bond,angle across boundary from VMD topo Axel Kohlmeyer
06:07 [lammps-users] bond,angle across boundary from VMD topo Yafan Yang
06:01 [lammps-users] On the use of COMB potential for omrfnoy silicon dioxide Виктор Окулич
05:15 [lammps-users] Free energy calculation using TI method Manish Maurya
02:28 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Johannes P . Dürholt
01:36 Re: [lammps-users] changing potential and number of atom type involved simulation Axel Kohlmeyer
01:31 Re: [lammps-users] Error during applying "npt" command. Axel Kohlmeyer

December 03, 2017
22:51 [lammps-users] Error during applying "npt" command. swarnimaa B.
22:29 [lammps-users] changing potential and number of atom type involved simulation Keshab Bashyal
19:55 Re: [lammps-users] Changing boundary conditions in polymer Rajesh
18:02 Re: [lammps-users] molindex and identifying atoms on the same molecule Axel Kohlmeyer
17:44 Re: [lammps-users] molindex and identifying atoms on the same molecule Jeff Towers
17:04 Re: [lammps-users] molindex and identifying atoms on the same molecule Axel Kohlmeyer
16:50 Re: [lammps-users] molindex and identifying atoms on the same molecule Jeff Towers
15:53 Re: [lammps-users] Changing boundary conditions in polymer Giacomo Fiorin
15:34 Re: [lammps-users] Changing boundary conditions in polymer Axel Kohlmeyer
15:15 Re: [lammps-users] Changing boundary conditions in polymer Giacomo Fiorin
12:44 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Axel Kohlmeyer
11:53 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Johannes P . Dürholt
11:09 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Axel Kohlmeyer
10:12 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Giacomo Fiorin
05:46 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Axel Kohlmeyer

December 02, 2017
23:12 [lammps-users] Changing boundary conditions in polymer Rajesh
19:11 Re: [lammps-users] Clarification on lj cutoff Robert Hoy
18:01 Re: [lammps-users] Clarification on lj cutoff Gideon Simpson
18:00 Re: [lammps-users] Clarification on lj cutoff Robert Hoy
17:54 [lammps-users] Clarification on lj cutoff Gideon Simpson
14:11 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Johannes P . Dürholt
13:56 Re: [lammps-users] Implementation of a numerical Hessian via a new fix Axel Kohlmeyer
11:43 [lammps-users] Implementation of a numerical Hessian via a new fix Johannes P . Dürholt
09:38 Re: [lammps-users] region command with block &union argument Julien Guénolé
06:18 Re: [lammps-users] Cant assign two boundary conditions at lower and upper faces in change box Axel Kohlmeyer

December 01, 2017
22:04 [lammps-users] Cant assign two boundary conditions at lower and upper faces in change box Rajesh
15:11 Re: [lammps-users] Message 'AAA HOW GET HERE' in fix_store.cpp Axel Kohlmeyer
13:39 [lammps-users] Message 'AAA HOW GET HERE' in fix_store.cpp Laura Scalfi
12:55 Re: [lammps-users] fix avg/time mode vector error Axel Kohlmeyer
12:46 [lammps-users] Making sense of in.heat example rambod yousefzadeh tabasi
12:45 Re: [lammps-users] fix avg/time mode vector error Matthew Wander
12:12 Re: [lammps-users] fix avg/time mode vector error Axel Kohlmeyer
12:08 [lammps-users] fix avg/time mode vector error Matthew Wander
09:46 Re: [lammps-users] Problem Calling Certain Python Modules from LAMMPS Input File Axel Kohlmeyer
09:25 [lammps-users] Problem Calling Certain Python Modules from LAMMPS Input File Brenda Rubenstein
03:40 Re: [lammps-users] region command with block &union argument liyi bai
03:15 Re: [lammps-users] region command with block &union argument Julien Guénolé

November 30, 2017
21:20 Re: [lammps-users] COMB3 too slow (compared to Reax/C) Ray Shan
19:39 Re: [lammps-users] COMB3 too slow (compared to Reax/C) Sencer Selcuk
15:33 Re: [lammps-users] COMB3 too slow (compared to Reax/C) Ray Shan
15:24 [lammps-users] Fwd: LAMMPS with OMP Vaidyanathan M.S
14:51 Re: [lammps-users] LAMMPS with OMP Axel Kohlmeyer
14:48 [lammps-users] LAMMPS with OMP Vaidyanathan M.S
12:30 Re: [lammps-users] Autoionization of water Giacomo Fiorin
12:04 Re: [lammps-users] adiabatic wall m n
12:04 [lammps-users] COMB3 too slow (compared to Reax/C) Sencer Selcuk
11:40 Re: [lammps-users] adiabatic wall Axel Kohlmeyer
11:31 Re: [lammps-users] dump changes in potential energy Axel Kohlmeyer
11:30 Re: [lammps-users] region command with block &union argument Julien Guénolé
09:52 [lammps-users] dump changes in potential energy Nasiri, Samaneh
09:38 Re: [lammps-users] adiabatic wall m n
06:51 [lammps-users] region command with block &union argument liyi bai
05:47 [lammps-users] Calculate net force on a group of atoms Rajesh
04:21 [lammps-users] Autoionization of water ‪Meral Sharkas‬ ‪

November 29, 2017
16:38 Re: [lammps-users] adiabatic wall Eric Murphy
16:33 Re: [lammps-users] adiabatic wall Eric Murphy
16:11 [lammps-users] adiabatic wall m n
16:02 [lammps-users] Lammps 2008 version. sungpar
11:13 Re: [lammps-users] Lammps 2008 version. Axel Kohlmeyer
11:08 Re: [lammps-users] Lammps 2008 version. Stefan Paquay
09:21 Re: [lammps-users] command of region and dump_modify Axel Kohlmeyer
09:14 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM Axel Kohlmeyer
07:55 Re: [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM Axel Kohlmeyer
07:40 Re: [lammps-users] Dislocation-Stacking Fault Interaction Julien Guénolé
07:35 [lammps-users] Error on proc 0: Out of range atoms - cannot compute PPPM bahman daneshian
05:47 Re: [lammps-users] molindex and identifying atoms on the same molecule Jeff Towers
05:14 Re: [lammps-users] Data communication Axel Kohlmeyer
03:08 Re: [lammps-users] Invalid thermo keyword in variable formula Nader Ameli
03:01 [lammps-users] Invalid thermo keyword in variable formula Maksim
01:39 [lammps-users] Local fluid stress using fix ATC John Thalakkottor,Joseph
01:34 Re: [lammps-users] Data communication Notan Tah

November 28, 2017
22:57 Re: [lammps-users] Data communication Andrew Jewett
22:07 [lammps-users] Data communication Notan Tah
19:26 [lammps-users] command of region and dump_modify liyi bai
19:17 Re: [lammps-users] Methan molecule simulation Andrew Jewett
19:16 Re: [lammps-users] Methan molecule simulation Andrew Jewett
17:17 [lammps-users] Methan molecule simulation Kim, Changjae
11:21 [lammps-users] Reg. AtC Fix_flux and computational domain problem Parmar, Vinod
06:30 Re: [lammps-users] How to find Si-N potetial? Axel Kohlmeyer
05:23 [lammps-users] How to find Si-N potetial? ??????
03:43 Re: [lammps-users] Some errors with lammps 张亚平

November 27, 2017
16:01 [lammps-users] lammps in stampede2 sungpar
11:32 Re: [lammps-users] Finding LAMMPS Source Code Axel Kohlmeyer
11:30 Re: [lammps-users] lammps in stampede2 Axel Kohlmeyer
10:59 [lammps-users] Finding LAMMPS Source Code MASATO KOIZUMI
10:52 Re: [lammps-users] Axilrod-Teller Potential Stefan Paquay
10:46 Re: [lammps-users] Minor bug-fix in FixNeighHistory Steve Plimpton
07:01 Re: [lammps-users] LAMMPS and sparse dump files Axel Kohlmeyer
06:56 Re: [lammps-users] (no subject) Axel Kohlmeyer
06:46 Re: [lammps-users] molindex and identifying atoms on the same molecule Axel Kohlmeyer
06:32 Re: [lammps-users] molindex and identifying atoms on the same molecule Steve Plimpton
05:01 Re: [lammps-users] LAMMPS and sparse dump files Axel Kohlmeyer
04:58 Re: [lammps-users] force calculation in tersoff potential Axel Kohlmeyer
04:47 Re: [lammps-users] force calculation in tersoff potential Nader Ameli
04:06 [lammps-users] LAMMPS and sparse dump files Michael Bareford

November 26, 2017
22:37 Re: [lammps-users] molindex and identifying atoms on the same molecule Jeff Towers
21:09 Re: [lammps-users] molindex and identifying atoms on the same molecule Axel Kohlmeyer
19:25 [lammps-users] molindex and identifying atoms on the same molecule Jeff Towers
09:14 [lammps-users] (no subject) laltu dass
08:19 Re: [lammps-users] force calculation in tersoff potential Axel Kohlmeyer
08:06 Re: [lammps-users] about compute and fix chunk/atom issue Giacomo Fiorin
07:56 Re: [lammps-users] force calculation in tersoff potential Nader Ameli
04:03 [lammps-users] about compute and fix chunk/atom issue 徐浩
01:33 [lammps-users] Minor bug-fix in FixNeighHistory HANLEY Kevin

November 25, 2017
23:08 Re: [lammps-users] Error: kspace is incompatible bahman daneshian
21:56 Re: [lammps-users] Question on fix balance with time weighting yafan . yang
15:25 Re: [lammps-users] Question on fix balance with time weighting Axel Kohlmeyer
13:57 [lammps-users] Question on fix balance with time weighting Yafan Yang
13:12 Re: [lammps-users] hydrogen bond term of force fields Axel Kohlmeyer
13:03 Re: [lammps-users] force calculation in tersoff potential Axel Kohlmeyer
13:01 Re: [lammps-users] Error: kspace is incompatible Axel Kohlmeyer
12:58 Re: [lammps-users] Force based friction test Axel Kohlmeyer
12:34 Re: [lammps-users] Force based friction test Raghu Ram
10:35 [lammps-users] Dislocation-Stacking Fault Interaction Rosita Masoudi
10:20 Re: [lammps-users] Error: kspace is incompatible Stefan Paquay
08:16 [lammps-users] ?????? about to update the dipole in "fix nve asphere" htc
07:59 [lammps-users] force calculation in tersoff potential Nader Ameli
06:35 Re: [lammps-users] Chemical reactions Axel Kohlmeyer
06:14 [lammps-users] Chemical reactions zhen xue
02:29 [lammps-users] Error: kspace is incompatible bahman daneshian

November 24, 2017
18:07 Re: [lammps-users] How to output resultant using "fix reax/c/bond" command? Ray Shan
17:13 Re: [lammps-users] hydrogen bond term of force fields Ray Shan
16:42 Re: [lammps-users] Some errors with lammps Ray Shan
11:30 Re: [lammps-users] unknown command - pair_style meam Axel Kohlmeyer
10:51 Re: [lammps-users] Fix adapt with eam/fs Axel Kohlmeyer
09:19 [lammps-users] Fix adapt with eam/fs pmoreira
08:46 Re: [lammps-users] Uniaxial Tensile deformation of Graphene sheet at 0 Kelvin Steve Plimpton
08:45 Re: [lammps-users] dump to partial atoms velocity information to calculate VDOS Steve Plimpton
07:22 [lammps-users] Nr and Nrho too high in EAM potential file? Jan Fikar
06:23 Re: [lammps-users] unknown command - pair_style meam Sebastian Hütter
05:42 Re: [lammps-users] (no subject) Michał Kański
04:04 [lammps-users] (no subject) Arun panda
03:01 [lammps-users] Uniaxial Tensile deformation of Graphene sheet at 0 Kelvin Anubhav Roy

November 23, 2017
23:06 [lammps-users] dump to partial atoms velocity information to calculate VDOS liyi bai
21:17 Re: [lammps-users] unknown command - pair_style meam Stefan Paquay
20:44 [lammps-users] unknown command - pair_style meam hansinees
09:22 Re: [lammps-users] RDF compute specification between atoms Steve Plimpton
03:43 Re: [lammps-users] FEP calculation on charged cluster Imanuel Kristanto
03:18 Re: [lammps-users] FEP calculation on charged cluster Agilio Padua
02:25 [lammps-users] MEAM potentail model Bom Salman
02:17 [lammps-users] How to output resultant using "fix reax/c/bond" command? sheng wu
00:12 [lammps-users] RDF compute specification between atoms Nnanna Ukoji

November 22, 2017
19:08 Re: [lammps-users] FEP calculation on charged cluster Stefan Paquay
18:19 Re: [lammps-users] Ensemble choices for MSD calculation 284237308@...1204...
18:16 Re: [lammps-users] Ensemble choices for MSD calculation 284237308@...1204...
18:01 Re: [lammps-users] FEP calculation on charged cluster Imanuel Kristanto
16:31 Re: [lammps-users] Testing radial distribution function (rdf) calculation results Axel Kohlmeyer
16:19 Re: [lammps-users] Testing radial distribution function (rdf) calculation results Axel Kohlmeyer
15:25 Re: [lammps-users] thermal impulse command YOHANNA Jacob Baro
14:57 Re: [lammps-users] Testing radial distribution function (rdf) calculation results Ali Morshedi
14:35 [lammps-users] Testing radial distribution function (rdf) calculation results Ali Morshedi
12:39 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) jamal kazazi
12:28 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) Axel Kohlmeyer
11:57 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) jamal kazazi
09:41 Re: [lammps-users] Fwd: compute group/group in a different model Steve Plimpton
07:08 Re: [lammps-users] FEP calculation on charged cluster Agilio Padua
06:59 [lammps-users] How to output resultant using "fix reax/c/bond" command? 吴胜
06:39 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) Hai Hoang
05:29 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) Axel Kohlmeyer
05:29 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) Ahmed E. Ismail
05:25 Re: [lammps-users] Ensemble choices for MSD calculation Axel Kohlmeyer
05:21 Re: [lammps-users] KIM API Package setup Axel Kohlmeyer
04:15 Re: [lammps-users] Ensemble choices for MSD calculation Hai Hoang
03:59 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) Hai Hoang
03:46 [lammps-users] KIM API Package setup Vijayan, Prabhu
00:45 [lammps-users] Ensemble choices for MSD calculation 284237308@...1204...

November 21, 2017
22:14 [lammps-users] Fwd: compute group/group in a different model yu han
19:06 [lammps-users] Pressure calculated using temperature compute that removes bias results in lower average pressure than measured at equilibrium Daniel Rankin
18:21 Re: [lammps-users] FEP calculation on charged cluster Imanuel Kristanto
18:08 Re: [lammps-users] FEP calculation on charged cluster Imanuel Kristanto
16:38 Re: [lammps-users] Bin & Group & Chunk m n
15:41 Re: [lammps-users] TIP4P interaction with other atoms (buckingham) Axel Kohlmeyer
15:38 Re: [lammps-users] Bin & Group & Chunk Giacomo Fiorin
15:16 [lammps-users] Bin & Group & Chunk m n
14:39 [lammps-users] TIP4P interaction with other atoms (buckingham) jamal kazazi
09:27 Re: [lammps-users] FEP calculation on charged cluster Agilio Padua
09:26 Re: [lammps-users] NPT with a (sub)group Axel Kohlmeyer
09:10 [lammps-users] NPT with a (sub)group Jones, Reese
09:05 Re: [lammps-users] compute group/group in a different model Steve Plimpton
09:03 Re: [lammps-users] about to update the dipole in "fix nve asphere" Steve Plimpton
08:02 Re: [lammps-users] FEP calculation on charged cluster Stefan Paquay
07:42 [lammps-users] FEP calculation on charged cluster Imanuel Kristanto

November 20, 2017
21:21 [lammps-users] compute group/group in a different model yu han
19:23 Re: [lammps-users] Wrong temperature and pressure output because of wrong DOF - ellipsoidal particles Axel Kohlmeyer
18:38 [lammps-users] Wrong temperature and pressure output because of wrong DOF - ellipsoidal particles Thi Lan Huong Nguyen
17:34 Re: [lammps-users] Force based friction test Axel Kohlmeyer
15:04 Re: [lammps-users] TIP4P long range solver Moore, Stan
15:02 [lammps-users] Force based friction test Raghu Ram
14:18 Re: [lammps-users] TIP4P long range solver Axel Kohlmeyer
14:16 Re: [lammps-users] TIP4P long range solver Axel Kohlmeyer
14:14 Re: [lammps-users] TIP4P long range solver Ali Morshedi
14:03 Re: [lammps-users] TIP4P long range solver Axel Kohlmeyer
12:39 [lammps-users] TIP4P long range solver Ali Morshedi
10:52 Re: [lammps-users] Notes on porting pair styles to KOKKOS Steve Plimpton
10:50 Re: [lammps-users] about to update the dipole in "fix nve asphere" Steve Plimpton
10:17 Re: [lammps-users] about to update the dipole in "fix nve asphere" Axel Kohlmeyer
09:15 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands riccardo innocenti
09:02 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands Axel Kohlmeyer
08:19 Re: [lammps-users] thermal impulse command Steve Plimpton
08:07 [lammps-users] about to update the dipole in "fix nve asphere" htc
08:01 Re: [lammps-users] QMMM with lammps Axel Kohlmeyer
07:52 Re: [lammps-users] QMMM with lammps daniele selli
07:44 Re: [lammps-users] QMMM with lammps Axel Kohlmeyer
07:41 Re: [lammps-users] QMMM with lammps daniele selli
07:31 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands Axel Kohlmeyer
07:15 Re: [lammps-users] QMMM with lammps Axel Kohlmeyer
06:54 Re: [lammps-users] QMMM with lammps daniele selli
04:49 Re: [lammps-users] QMMM with lammps Axel Kohlmeyer
02:16 [lammps-users] QMMM with lammps daniele selli
01:51 Re: [lammps-users] Tersoff potential with bonds, angles, etc. Fahim Faraji
00:58 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands riccardo innocenti

November 19, 2017
21:07 Re: [lammps-users] how to tabulate a pair potential with varying separation distance Axel Kohlmeyer
20:13 [lammps-users] how to tabulate a pair potential with varying separation distance Peter Chu
11:07 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands Axel Kohlmeyer
08:34 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands riccardo innocenti
08:19 Re: [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands Axel Kohlmeyer
07:12 [lammps-users] issue running lennard/mdf when using gpu acceleration for other pair_style commands riccardo innocenti
06:58 Re: [lammps-users] Questions about calling python from lammps Axel Kohlmeyer
06:54 Re: [lammps-users] Tersoff potential with bonds, angles, etc. Axel Kohlmeyer
05:30 [lammps-users] Questions about calling python from lammps Xuechen Zheng
04:05 [lammps-users] About lost atoms using fix wall/srd dry6211@...24...
00:58 [lammps-users] Tersoff potential with bonds, angles, etc. Fahim Faraji

November 18, 2017
23:57 [lammps-users] (no subject) arpita das
07:44 Re: [lammps-users] definition of map file format Axel Kohlmeyer
07:37 Re: [lammps-users] thermal impulse command Axel Kohlmeyer

November 17, 2017
19:06 [lammps-users] thermal impulse command YOHANNA Jacob Baro
12:31 [lammps-users] definition of map file format Zbigniew Koziol
12:14 [lammps-users] Notes on porting pair styles to KOKKOS Stefan Paquay
06:55 Re: [lammps-users] WARNING: Fix qeq/reax CG convergence failed after 200 iterations at 1 step and ERROR on proc 0: Non-numeric atom coords - simulation unstable DUNDAR YILMAZ
06:27 Re: [lammps-users] WARNING: Fix qeq/reax CG convergence failed after 200 iterations at 1 step and ERROR on proc 0: Non-numeric atom coords - simulation unstable Michał Kański
05:50 Re: [lammps-users] WARNING: Fix qeq/reax CG convergence failed after 200 iterations at 1 step and ERROR on proc 0: Non-numeric atom coords - simulation unstable Nnanna Ukoji
05:17 Re: [lammps-users] WARNING: Fix qeq/reax CG convergence failed after 200 iterations at 1 step and ERROR on proc 0: Non-numeric atom coords - simulation unstable Michał Kański
04:27 [lammps-users] WARNING: Fix qeq/reax CG convergence failed after 200 iterations at 1 step and ERROR on proc 0: Non-numeric atom coords - simulation unstable Nnanna Ukoji

November 16, 2017
21:46 Re: [lammps-users] Axilrod-Teller Potential Stefan Paquay
18:59 Re: [lammps-users] Rigid--unkown fix JWG
15:23 Re: [lammps-users] Axilrod-Teller Potential Shane Jackson
08:24 Re: [lammps-users] Rigid--unkown fix Axel Kohlmeyer
07:59 Re: [lammps-users] Rigid--unkown fix JWG
07:34 Re: [lammps-users] input cause MPI error liyi bai
07:11 Re: [lammps-users] About lubrication effect in fix srd Eric Murphy
06:14 Re: [lammps-users] input cause MPI error Axel Kohlmeyer
05:44 Re: [lammps-users] Lammps run. Axel Kohlmeyer
04:22 Re: [lammps-users] Rigid--unkown fix Michał Kański
03:29 [lammps-users] Lammps run. swarnimaa B.
01:45 [lammps-users] Rigid--unkown fix JWG
00:09 [lammps-users] hydrogen bond term of force fields Hossein Geraili

November 15, 2017
22:46 [lammps-users] input cause MPI error liyi bai
19:22 [lammps-users] About lubrication effect in fix srd dry6211@...24...
19:14 Re: [lammps-users] lost atoms with fix wall/srd dry6211@...24...
17:09 Re: [lammps-users] License question Steve Plimpton
16:47 Re: [lammps-users] read data file(production) with velocity information Steve Plimpton
15:35 Re: [lammps-users] output velocity of a group of particles m n
15:21 Re: [lammps-users] output velocity of a group of particles Stefan Paquay
15:12 Re: [lammps-users] output velocity of a group of particles m n
15:03 Re: [lammps-users] [EXTERNAL] Re: GCMC can not fully fill a box with particles for high MC movement frequency Thompson, Aidan
14:47 Re: [lammps-users] rerun command Steve Plimpton
14:44 Re: [lammps-users] PyLammps breakdown when using atoms list Steve Plimpton
14:38 Re: [lammps-users] About applying radial velocity in fix move. Steve Plimpton
14:33 Re: [lammps-users] regenerate EAM/fs potential Steve Plimpton
14:28 Re: [lammps-users] Results of time averaging in a variable? Steve Plimpton
14:25 Re: [lammps-users] creating grain boundary using two supercell Steve Plimpton
14:20 Re: [lammps-users] How to oscillate a wall while thermostatting Steve Plimpton
13:55 Re: [lammps-users] GCMC crashes with "Out of range atoms" error but the system is fine when running regular MD Steve Plimpton
13:53 Re: [lammps-users] How to build a cubic simulation box Steve Plimpton
13:37 Re: [lammps-users] GPU Lammps : libcuda.so.1: cannot open shared object file Vaidyanathan M.S
12:55 Re: [lammps-users] GPU Lammps : libcuda.so.1: cannot open shared object file Vaidyanathan M.S
12:50 Re: [lammps-users] Viscosity calculation using Green-Kubo formulation Eric Murphy
12:40 Re: [lammps-users] [EXTERNAL] Re: rolling friction and cohesion models under development for granular models? Eric Murphy
11:55 Re: [lammps-users] output velocity of a group of particles m n
11:43 Re: [lammps-users] GPU Lammps : libcuda.so.1: cannot open shared object file Axel Kohlmeyer
11:43 Re: [lammps-users] GPU Lammps : libcuda.so.1: cannot open shared object file Stefan Paquay
11:32 [lammps-users] GPU Lammps : libcuda.so.1: cannot open shared object file Vaidyanathan M.S
11:11 Re: [lammps-users] output velocity of a group of particles Stefan Paquay
10:58 [lammps-users] output velocity of a group of particles m n
07:55 Re: [lammps-users] Windows Install Question Tsutomu Ohno
07:52 Re: [lammps-users] Windows Install Question Imanuel Kristanto
07:52 [lammps-users] Viscosity calculation using Green-Kubo formulation Omar Khalil
07:21 [lammps-users] Windows Install Question Tsutomu Ohno
06:58 Re: [lammps-users] Stress Strain curve of a brittle material Chowdhury, Sanjib Chandra
06:21 Re: [lammps-users] Stress Strain curve of a brittle material Axel Kohlmeyer
06:21 Re: [lammps-users] Stress Strain curve of a brittle material Stefan Paquay
06:18 Re: [lammps-users] Could lammps calculate the stress tensor based onintermolecular interactions Axel Kohlmeyer
06:07 Re: [lammps-users] ReaxFF MD simulation problem Axel Kohlmeyer
06:00 Re: [lammps-users] ReaxFF MD simulation problem Michał Kański
05:58 Re: [lammps-users] lost atoms with fix wall/srd Michał Kański
04:55 [lammps-users] lost atoms with fix wall/srd dry6211@...24...
04:46 [lammps-users] 回复: Could lammps calculate the stress tensor based onintermolecular interactions 1185201182

November 14, 2017
23:16 Re: [lammps-users] ReaxFF MD simulation problem higuk
22:03 [lammps-users] Stress Strain curve of a brittle material Khourshaei Shar, Ali
19:03 [lammps-users] Some errors with lammps 张亚平
18:24 Re: [lammps-users] ReaxFF MD simulation problem Axel Kohlmeyer
17:55 [lammps-users] ReaxFF MD simulation problem higuk
11:44 Re: [lammps-users] About temperature fluctuations Axel Kohlmeyer
11:35 Re: [lammps-users] About temperature fluctuations A. M.M
10:05 Re: [lammps-users] About temperature fluctuations A. M.M
10:02 Re: [lammps-users] About temperature fluctuations Axel Kohlmeyer
09:49 Re: [lammps-users] About temperature fluctuations A. M.M
09:10 Re: [lammps-users] DPD parameter 'A' Axel Kohlmeyer
07:20 Re: [lammps-users] Error: Cannot open fix print file Axel Kohlmeyer
07:18 Re: [lammps-users] Magnetic field code Axel Kohlmeyer
07:16 Re: [lammps-users] Unable to assign scalar value of compute to a variable Axel Kohlmeyer
07:09 Re: [lammps-users] Unable to assign scalar value of compute to a variable Chilakalapudi, Syamal Praneeth (INT)
05:37 [lammps-users] Magnetic field code Ammar
03:56 [lammps-users] Error: Cannot open fix print file Vijayan, Prabhu
03:32 Re: [lammps-users] Unable to assign scalar value of compute to a variable Julien Guénolé
01:17 [lammps-users] Unable to assign scalar value of compute to a variable Chilakalapudi, Syamal Praneeth (INT)

November 13, 2017
23:00 Re: [lammps-users] Extracting neighbor list in LAMMPS C++ library Axel Kohlmeyer
22:55 Re: [lammps-users] Extracting neighbor list in LAMMPS C++ library Diaz,Adrian
22:42 Re: [lammps-users] Extracting neighbor list in LAMMPS C++ library Diaz,Adrian
22:34 Re: [lammps-users] How to wrap atoms into simulation box with read_data Axel Kohlmeyer
19:44 [lammps-users] How to wrap atoms into simulation box with read_data Andrew Gibbons
19:38 [lammps-users] Extracting neighbor list in LAMMPS C++ library Rohskopf, Andrew D
14:58 Re: [lammps-users] PBC Axel Kohlmeyer
14:47 Re: [lammps-users] PBC Jana Pritam
14:06 Re: [lammps-users] Secondary run failure when calculating clustering David Nicholson
13:47 Re: [lammps-users] About temperature fluctuations A. M.M
13:47 Re: [lammps-users] [EXTERNAL] Re: rolling friction and cohesion models under development for granular models? Bruce Ferdowsi
13:35 Re: [lammps-users] [EXTERNAL] Re: rolling friction and cohesion models under development for granular models? Bolintineanu, Dan Stefan
13:01 Re: [lammps-users] rolling friction and cohesion models under development for granular models? Axel Kohlmeyer
12:58 [lammps-users] rolling friction and cohesion models under development for granular models? Bruce Ferdowsi
12:04 Re: [lammps-users] About temperature fluctuations Axel Kohlmeyer
11:47 Re: [lammps-users] About temperature fluctuations Stefan Paquay
11:35 Re: [lammps-users] About temperature fluctuations A. M.M
08:59 Re: [lammps-users] neigh_modify exclude molecule/intra all and mol_id = 0 Axel Kohlmeyer
08:42 [lammps-users] neigh_modify exclude molecule/intra all and mol_id = 0 Massimo Pica Ciamarra
08:37 Re: [lammps-users] Could lammps calculate the stress tensor based on intermolecular interactions Axel Kohlmeyer
08:23 Re: [lammps-users] About temperature fluctuations Axel Kohlmeyer
08:18 Re: [lammps-users] Equilibrate crystal SiO2 at normal pressure and atmosphere Julien Guénolé
08:04 Re: [lammps-users] About temperature fluctuations A. M.M
06:59 [lammps-users] Could lammps calculate the stress tensor based on intermolecular interactions 1185201182
06:49 [lammps-users] DPD parameter 'A' Emir Kocer
04:14 Re: [lammps-users] Rigid Axel Kohlmeyer
02:28 [lammps-users] Rigid Zohreh Ahadi

November 12, 2017
19:19 Re: [lammps-users] multiple instances of lammps in python Axel Kohlmeyer
19:18 Re: [lammps-users] I want to simulate a system containing C H N Zn , what kind of potential should I use? Axel Kohlmeyer
19:13 Re: [lammps-users] PBC Axel Kohlmeyer
19:10 Re: [lammps-users] Calculation of msd of atoms in spatial bins Axel Kohlmeyer
19:08 Re: [lammps-users] About temperature fluctuations Axel Kohlmeyer
19:06 Re: [lammps-users] Lammps & julia Axel Kohlmeyer
18:02 Re: [lammps-users] About temperature fluctuations Giacomo Fiorin
17:56 [lammps-users] Lammps & julia Gideon Simpson
17:40 [lammps-users] Calculation of msd of atoms in spatial bins Sengupta, S.
08:54 Re: [lammps-users] Equilibrate crystal SiO2 at normal pressure and atmosphere Chowdhury, Sanjib Chandra
05:12 Re: [lammps-users] Equilibrate crystal SiO2 at normal pressure and atmosphere Bingyu Cui
03:55 Re: [lammps-users] PBC Jana Pritam
00:19 [lammps-users] I want to simulate a system containing C H N Zn , what kind of potential should I use? ????????

November 11, 2017
17:46 Re: [lammps-users] Equilibrate crystal SiO2 at normal pressure and atmosphere Chowdhury, Sanjib Chandra
17:17 Re: [lammps-users] multiple instances of lammps in python Axel Kohlmeyer
17:12 [lammps-users] Equilibrate crystal SiO2 at normal pressure and atmosphere Bingyu Cui
13:17 [lammps-users] multiple instances of lammps in python Gideon Simpson
09:09 [lammps-users] About temperature fluctuations A. M.M
02:12 Re: [lammps-users] PyLammps breakdown when using atoms list Xiuyang Xia
01:58 Re: [lammps-users] PyLammps breakdown when using atoms list Xiuyang Xia

November 10, 2017
18:17 Re: [lammps-users] msd/chunk atom id constant Sengupta, S.
16:55 Re: [lammps-users] PBC Andrew Jewett
16:46 Re: [lammps-users] dump now Axel Kohlmeyer
16:04 [lammps-users] dump now Gideon Simpson
14:14 Re: [lammps-users] msd/chunk atom id constant Axel Kohlmeyer
14:10 Re: [lammps-users] CG Energy Minimization returning NaN for specific potentials Axel Kohlmeyer
12:40 Re: [lammps-users] Crystal Structure Giacomo Fiorin
12:15 Re: [lammps-users] compute stress/atom command Axel Kohlmeyer
12:11 Re: [lammps-users] read data file(production) with velocity information Wes Barnett
11:59 [lammps-users] msd/chunk atom id constant Sengupta, S.
11:57 [lammps-users] CG Energy Minimization returning NaN for specific potentials Ian Chesser
11:36 [lammps-users] compute stress/atom command ruiyan
06:34 Re: [lammps-users] PBC Jana Pritam
06:19 Re: [lammps-users] Voronoi/atom issue Julien Guénolé
05:51 Re: [lammps-users] read data file(production) with velocity information ‪Ali Khodadadi‬ ‪
05:35 [lammps-users] read data file(production) with velocity information liyi bai
03:51 Re: [lammps-users] RATTLE in version 2017! Hai Hoang

November 09, 2017
20:57 Re: [lammps-users] the returned integer from extract() method of pair_styles Axel Kohlmeyer
20:35 Re: [lammps-users] PyLammps breakdown when using atoms list Axel Kohlmeyer
20:09 [lammps-users] the returned integer from extract() method of pair_styles JENEL PETRISOR VATAMANU
18:55 [lammps-users] PyLammps breakdown when using atoms list Xiuyang Xia
18:52 Re: [lammps-users] PBC Andrew Jewett
16:14 Re: [lammps-users] RATTLE in version 2017! Peter Wirnsberger
15:16 Re: [lammps-users] PBC Keshab Bashyal
14:26 [lammps-users] PBC Jana Pritam
12:41 [lammps-users] Crystal Structure Mohammad Hasan Badizad
10:50 Re: [lammps-users] temperature fluctuation range in npt Xiao Jia
09:54 Re: [lammps-users] temperature fluctuation range in npt Axel Kohlmeyer
09:24 [lammps-users] temperature fluctuation range in npt ruiyan
07:30 Re: [lammps-users] License question Stefan Paquay
06:54 Re: [lammps-users] lammps crash with AIREBO CH potential Efrem Braun
06:39 [lammps-users] License question Jason Wood
06:31 [lammps-users] rerun command Mirshekariyan Babaki, Mehrnaz
06:05 Re: [lammps-users] Voronoi/atom issue Stefan Paquay
00:38 Re: [lammps-users] About reaxff force field with no chemical reaction 284237308@...1204...

November 08, 2017
21:33 Re: [lammps-users] Voronoi/atom issue Eric Murphy
15:15 [lammps-users] Building a monoclinic single lattice structure Khourshaei Shar, Ali
12:39 [lammps-users] How to make an adiabatic wall? Mohammad Ahmadi
12:29 Re: [lammps-users] Using Irving-Kirkwood formalism for pressure Eric Murphy
11:38 Re: [lammps-users] Using Irving-Kirkwood formalism for pressure ‪Elina‬ ‪
11:22 Re: [lammps-users] Using Irving-Kirkwood formalism for pressure ‪Ali Khodadadi‬ ‪
11:14 Re: [lammps-users] Using Irving-Kirkwood formalism for pressure Eric Murphy
11:01 [lammps-users] Voronoi/atom issue Rajdeep Behera
10:13 Re: [lammps-users] Secondary run failure when calculating clustering Axel Kohlmeyer
09:44 Re: [lammps-users] How to save center coordinates of 3d bins in lammps ‪Ali Khodadadi‬ ‪
09:29 Re: [lammps-users] How to save center coordinates of 3d bins in lammps Michał Kański
09:25 Re: [lammps-users] How to save center coordinates of 3d bins in lammps Axel Kohlmeyer
09:22 Re: [lammps-users] How to save center coordinates of 3d bins in lammps Julien Guénolé
08:54 [lammps-users] How to save center coordinates of 3d bins in lammps ‪Ali Khodadadi‬ ‪
06:41 Re: [lammps-users] Building a prismatic region Michał Kański
04:20 [lammps-users] Secondary run failure when calculating clustering Devonport, Craig
03:39 Re: [lammps-users] About reaxff force field with no chemical reaction Axel Kohlmeyer
01:00 [lammps-users] About reaxff force field with no chemical reaction 284237308@...1204...

November 07, 2017
16:18 Re: [lammps-users] Format of the Data File Andrew Jewett
16:12 Re: [lammps-users] Creating Surface roughness Andrew Jewett
13:27 Re: [lammps-users] About applying radial velocity in fix move. Chowdhury, Sanjib Chandra
13:08 Re: [lammps-users] How to distinguish between liquid and vapor atoms of the same type by means of each atom' s coordination number? saeed alborzi
12:36 Re: [lammps-users] How to distinguish between liquid and vapor atoms of the same type by means of each atom' s coordination number? Axel Kohlmeyer
12:35 [lammps-users] Using Irving-Kirkwood formalism for pressure ‪Elina‬ ‪
12:19 Re: [lammps-users] Building a prismatic region Khourshaei Shar, Ali
11:47 Re: [lammps-users] Creating Surface roughness Chowdhury, Sanjib Chandra
11:39 Re: [lammps-users] How to distinguish between liquid and vapor atoms of the same type by means of each atom' s coordination number? saeed alborzi
11:16 [lammps-users] Creating Surface roughness Gopal
11:09 Re: [lammps-users] print to hi-level logfile Axel Kohlmeyer
11:06 Re: [lammps-users] Building a prismatic region Michał Kański
11:01 Re: [lammps-users] print to hi-level logfile Emile Maras
10:57 [lammps-users] About applying radial velocity in fix move. Arun Bikram Thapa
10:00 [lammps-users] Building a prismatic region Khourshaei Shar, Ali
09:22 Re: [lammps-users] combining tip4p water with other charged species Boris Efremov
08:56 Re: [lammps-users] hybrid pair_style error Axel Kohlmeyer
07:53 Re: [lammps-users] print to hi-level logfile Axel Kohlmeyer
07:34 Re: [lammps-users] print to hi-level logfile Axel Kohlmeyer
07:26 [lammps-users] print to hi-level logfile Emile Maras
07:22 Re: [lammps-users] How to distinguish between liquid and vapor atoms of the same type by means of each atom' s coordination number? Axel Kohlmeyer
07:20 Re: [lammps-users] combining tip4p water with other charged species Axel Kohlmeyer
05:07 [lammps-users] combining tip4p water with other charged species Boris Efremov
03:49 [lammps-users] How to distinguish between liquid and vapor atoms of the same type by means of each atom' s coordination number? saeed alborzi
03:23 Re: [lammps-users] hybrid pair_style error Julien Guénolé
02:01 Re: [lammps-users] hybrid pair_style error YOHANNA Jacob Baro
00:32 [lammps-users] regenerate EAM/fs potential mehrdad zamzamian

November 06, 2017
21:41 [lammps-users] moltemplate: ERROR: Expected floating point parameter in input script Andrew Jewett
21:28 Re: [lammps-users] hybrid pair_style error Axel Kohlmeyer
20:02 [lammps-users] hybrid pair_style error YOHANNA Jacob Baro
13:29 Re: [lammps-users] lammps crash with AIREBO CH potential Efrem Braun
13:14 Re: [lammps-users] [EXTERNAL] how to perform grand canonical Monte Carlo simulation for binary mixture by LAMMPS? Thompson, Aidan
11:54 Re: [lammps-users] compute aggregate/atom stucks with empty neighbor list Axel Kohlmeyer
11:52 Re: [lammps-users] How to build Silicon nitride monoclinic lattice structure in LAMMPS Axel Kohlmeyer
11:43 Re: [lammps-users] Thermostating dipoles with angular velocity bias in shear flow Qi Liu
11:40 Re: [lammps-users] [lammps -users]Computational Material science books Steve Plimpton
11:36 Re: [lammps-users] Extracting per-atom potential energy with LAMMPS-Python interface Steve Plimpton
11:33 Re: [lammps-users] lateral - RDF for quasi 2D system Stefan Paquay
11:13 Re: [lammps-users] Initial box=Source units Steve Plimpton
11:09 Re: [lammps-users] Corresponding fix command & strain formula ?!? Steve Plimpton
11:07 Re: [lammps-users] lateral - RDF for quasi 2D system Steve Plimpton
11:05 Re: [lammps-users] Format of the Data File Steve Plimpton
11:03 Re: [lammps-users] Question in Example/ELASTIC_T Steve Plimpton
11:00 Re: [lammps-users] Accessing Interatomic distances from python via lammps python library Steve Plimpton
10:54 Re: [lammps-users] RATTLE in version 2017! Steve Plimpton
10:52 Re: [lammps-users] problem with non stable results in calculation of thermal conductivity using green-kubo method Steve Plimpton
10:50 Re: [lammps-users] Thermostating dipoles with angular velocity bias in shear flow Steve Plimpton
10:48 Re: [lammps-users] Van der Waals interlayer potential of graphenite structures: Lebedeva model Steve Plimpton
10:37 [lammps-users] How to build Silicon nitride monoclinic lattice structure in LAMMPS Khourshaei Shar, Ali
10:33 Re: [lammps-users] lammps crash with AIREBO CH potential Steve Plimpton
10:28 Re: [lammps-users] potential problem Keshab Bashyal
10:23 Re: [lammps-users] potential problem Axel Kohlmeyer
10:18 Re: [lammps-users] potential problem Keshab Bashyal
10:02 Re: [lammps-users] potential problem Axel Kohlmeyer
08:56 Re: [lammps-users] Substitution for illegal variable error message Noam Bernstein
08:54 Re: [lammps-users] Dipole precessing in Electric Field Axel Kohlmeyer
08:46 Re: [lammps-users] Dipole precessing in Electric Field carles calero
08:39 Re: [lammps-users] Substitution for illegal variable error message Axel Kohlmeyer
08:20 Re: [lammps-users] Using compute/xrd with manual c Axel Kohlmeyer
08:19 [lammps-users] Substitution for illegal variable error message Noam Bernstein
08:05 Re: [lammps-users] Dipole precessing in Electric Field Axel Kohlmeyer
08:01 Re: [lammps-users] Calculation density of water in nanotube Axel Kohlmeyer
07:52 [lammps-users] Using compute/xrd with manual c Sebastian Hütter
07:47 Re: [lammps-users] Calculate Atom Positions - Invalid Thermo Keyword in Variable Formula Axel Kohlmeyer
07:45 Re: [lammps-users] Calculation density of water in nanotube Julien Guénolé
07:38 Re: [lammps-users] Calculate Atom Positions - Invalid Thermo Keyword in Variable Formula Julien Guénolé
07:37 Re: [lammps-users] Results of time averaging in a variable? Noam Bernstein
07:33 Re: [lammps-users] Results of time averaging in a variable? Axel Kohlmeyer
07:31 Re: [lammps-users] Results of time averaging in a variable? Michał Kański
07:03 [lammps-users] Results of time averaging in a variable? Noam Bernstein
06:36 [lammps-users] Calculation density of water in nanotube Zohreh Ahadi
06:33 Re: [lammps-users] REAXFF Potentilal file Michał Kański
06:12 [lammps-users] REAXFF Potentilal file Nasiri, Samaneh
06:06 [lammps-users] compute aggregate/atom stucks with empty neighbor list Michael King
05:57 [lammps-users] about a model htc
05:51 Re: [lammps-users] about a model Axel Kohlmeyer
05:40 Re: [lammps-users] creating grain boundary using two supercell Axel Kohlmeyer
05:38 [lammps-users] about a model htc
05:38 Re: [lammps-users] Pump-probe technique Axel Kohlmeyer
05:31 Re: [lammps-users] about a model Axel Kohlmeyer
05:05 Re: [lammps-users] Dipole precessing in Electric Field carles calero
02:08 [lammps-users] about a model htc
00:57 Re: [lammps-users] Pump-probe technique YOHANNA Jacob Baro

November 05, 2017
19:09 [lammps-users] creating grain boundary using two supercell Keshab Bashyal
16:11 Re: [lammps-users] non equilibrium and non steady molecular dynamics simulations Diaz,Adrian
15:10 Re: [lammps-users] non equilibrium and non steady molecular dynamics simulations Hai Hoang
15:09 Re: [lammps-users] potential problem Axel Kohlmeyer
15:04 [lammps-users] potential problem Keshab Bashyal
07:55 Re: [lammps-users] dump independent files with running multiple simulations Stefan Paquay
05:59 [lammps-users] non equilibrium and non steady molecular dynamics simulations ‪Ali Khodadadi‬ ‪
05:31 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
05:12 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
04:24 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
04:04 Re: [lammps-users] about the commend "fix_langevin.cpp" Axel Kohlmeyer
04:02 Re: [lammps-users] table pair style Axel Kohlmeyer
01:48 [lammps-users] about the commend "fix_langevin.cpp" htc
01:03 [lammps-users] table pair style Fu Xueqiong
01:02 Re: [lammps-users] GAFF Preparation for LAMMPS Andrew Jewett
00:01 Re: [lammps-users] dump independent files with running multiple simulations Andrew Jewett

November 04, 2017
21:11 Re: [lammps-users] dump independent files with running multiple simulations Chowdhury, Sanjib Chandra
20:28 [lammps-users] dump independent files with running multiple simulations liyi bai
12:00 Re: [lammps-users] Calculate Atom Positions - Invalid Thermo Keyword in Variable Formula Hai Hoang
11:22 [lammps-users] Calculate Atom Positions - Invalid Thermo Keyword in Variable Formula Terry Price
05:56 Re: [lammps-users] tabulated potential with large gradient in short range distance Axel Kohlmeyer
05:41 Re: [lammps-users] packages Axel Kohlmeyer
04:50 Re: [lammps-users] packages Monika Choudhary
04:28 Re: [lammps-users] tabulated potential with large gradient in short range distance Bingyu Cui
01:25 Re: [lammps-users] Running ADP potentials on GPU Axel Kohlmeyer
01:19 Re: [lammps-users] lammps Axel Kohlmeyer
01:15 Re: [lammps-users] Pump-probe technique Axel Kohlmeyer
01:13 Re: [lammps-users] GAFF Preparation for LAMMPS Axel Kohlmeyer
01:06 Re: [lammps-users] please help answering questions to the mailing list Axel Kohlmeyer

November 03, 2017
17:40 Re: [lammps-users] Pair_coeff error Axel Kohlmeyer
17:30 [lammps-users] Pair_coeff error Rajdeep Behera
16:30 Re: [lammps-users] packages Michał Kański
15:58 Re: [lammps-users] tabulated potential with large gradient in short range distance Axel Kohlmeyer
12:23 [lammps-users] tabulated potential with large gradient in short range distance Bingyu Cui
07:43 Re: [lammps-users] implementing langevin npt Axel Kohlmeyer
07:33 Re: [lammps-users] Define the liquid and vapour phase in LAMMPS Axel Kohlmeyer
07:31 Re: [lammps-users] ClayFF Axel Kohlmeyer
07:25 Re: [lammps-users] Query regarding pair_style hybrid Axel Kohlmeyer
05:14 Re: [lammps-users] packages Michał Kański
03:03 [lammps-users] ClayFF Mohammad Hasan Badizad
01:53 [lammps-users] Query regarding pair_style hybrid Prerna Khullar
01:50 [lammps-users] packages Monika Choudhary

November 02, 2017
20:51 [lammps-users] implementing langevin npt samuelif
15:34 Re: [lammps-users] GCMC can not fully fill a box with particles for high MC movement frequency Han Liu
14:02 [lammps-users] Define the liquid and vapour phase in LAMMPS Xinyu You
11:25 Re: [lammps-users] please help answering questions to the mailing list Stefan Paquay
11:23 Re: [lammps-users] fix doesn't work with periodic boundary condition Stefan Paquay
11:17 [lammps-users] please help answering questions to the mailing list Axel Kohlmeyer
11:04 Re: [lammps-users] pair/local granular Axel Kohlmeyer
10:39 [lammps-users] pair/local granular Massimo Pica Ciamarra
10:25 Re: [lammps-users] Is there a limit to number of time steps in run command? Sahand Tabriz
09:54 Re: [lammps-users] Is there a limit to number of time steps in run command? Axel Kohlmeyer
09:31 [lammps-users] Is there a limit to number of time steps in run command? Sahand Tabriz
04:41 Re: [lammps-users] Atoms overlapping - Au-Ag alloy Rodrigo Queiroz de Albuqurque

November 01, 2017
17:39 Re: [lammps-users] How to convert a triclinic simulation box into cubic Khourshaei Shar, Ali
16:42 Re: [lammps-users] fix/pair_style works in serial but do not work in parallel? Axel Kohlmeyer
16:32 Re: [lammps-users] fix/pair_style works in serial but do not work in parallel? Quang Ha
16:30 [lammps-users] fix doesn't work with periodic boundary condition Quang Ha
16:01 Re: [lammps-users] How to convert a triclinic simulation box into cubic Axel Kohlmeyer
15:50 Re: [lammps-users] Atoms overlapping - Au-Ag alloy Ray Shan
15:45 Re: [lammps-users] Atoms overlapping - Au-Ag alloy Axel Kohlmeyer
15:22 [lammps-users] msi2lmp.exe from Materisl studio to Lammps input file sungpar
13:40 Re: [lammps-users] msi2lmp.exe from Materisl studio to Lammps input file Axel Kohlmeyer
11:44 Re: [lammps-users] How to convert a triclinic simulation box into cubic Ray Shan
11:43 Re: [lammps-users] How to convert a triclinic simulation box into cubic Khourshaei Shar, Ali
11:42 Re: [lammps-users] Atoms overlapping - Au-Ag alloy Ray Shan
11:38 Re: [lammps-users] How to convert a triclinic simulation box into cubic Ray Shan
11:24 [lammps-users] Atoms overlapping - Au-Ag alloy Rodrigo Queiroz de Albuqurque
10:55 [lammps-users] How to convert a triclinic simulation box into cubic Khourshaei Shar, Ali
10:30 Re: [lammps-users] lammps crash with AIREBO CH potential Efrem Braun
09:21 Re: [lammps-users] Using a Group Command to Specify a Certain Dihedral Calculation Axel Kohlmeyer
08:09 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
07:57 [lammps-users] Using a Group Command to Specify a Certain Dihedral Calculation Charles Belina
07:54 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
05:57 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
05:38 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
05:31 [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
05:27 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
05:24 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
05:19 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
05:15 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
05:09 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
05:08 Re: [lammps-users] Running lammps in parallel on windows Rajesh
05:08 Re: [lammps-users] Running lammps in parallel on windows Imanuel Kristanto
05:03 Re: [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
04:49 Re: [lammps-users] Running lammps in parallel on windows Rajesh
03:52 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
03:22 [lammps-users] How to oscillate a wall while thermostatting saeed alborzi
03:13 Re: [lammps-users] How to oscillate a wall while thermostatting Axel Kohlmeyer
02:35 [lammps-users] How to oscillate a wall while thermostatting saeed alborzi

October 31, 2017
17:52 Re: [lammps-users] boolean create_atoms command: variable for create_atoms command is invalid style Spencer Thomas
16:27 Re: [lammps-users] eam pair_style issue Axel Kohlmeyer
14:37 Re: [lammps-users] eam pair_style issue Fuentes-Cabrera, Miguel A.
14:24 Re: [lammps-users] [EXTERNAL] Fe C O H Lammps Potential Thompson, Aidan
13:45 Re: [lammps-users] How to convert simulation box type Axel Kohlmeyer
13:11 Re: [lammps-users] Basic Question using LAMMPS for SCM Software Axel Kohlmeyer
12:24 [lammps-users] Basic Question using LAMMPS for SCM Software Morrissey, Liam S.
09:36 [lammps-users] information needed to make an LT (moltemplate) file Andrew Jewett
06:52 Re: [lammps-users] boolean create_atoms command: variable for create_atoms command is invalid style Axel Kohlmeyer
06:42 Re: [lammps-users] boolean create_atoms command: variable for create_atoms command is invalid style Spencer Thomas

October 30, 2017
22:56 Re: [lammps-users] How to convert simulation box type Khourshaei Shar, Ali
22:33 Re: [lammps-users] How to convert simulation box type Andrew Jewett
22:18 Re: [lammps-users] GAFF Preparation for LAMMPS Andrew Jewett
21:43 Re: [lammps-users] How to build a cubic box Andrew Jewett
21:20 Re: [lammps-users] Mesoscopic simulation of viscoelastic fluid using LAMMPS Andrew Jewett
21:03 Re: [lammps-users] How to convert simulation box type Sara Adibi
18:50 Re: [lammps-users] boolean create_atoms command: variable for create_atoms command is invalid style Axel Kohlmeyer
15:32 [lammps-users] boolean create_atoms command: variable for create_atoms command is invalid style Spencer Thomas
11:59 Re: [lammps-users] fix/pair_style works in serial but do not work in parallel? Axel Kohlmeyer
09:45 [lammps-users] fix/pair_style works in serial but do not work in parallel? Quang Ha
04:11 [lammps-users] Mesoscopic simulation of viscoelastic fluid using LAMMPS 苏敬宏
03:59 [lammps-users] Mesoscopic simulation of viscoelastic fluid using LAMMPS 苏敬宏
02:36 [lammps-users] Charge adjustment on clustered system Imanuel Kristanto

October 29, 2017
19:52 Re: [lammps-users] Running lammps in parallel on windows Imanuel Kristanto
09:11 Re: [lammps-users] pair_style hybrid Axel Kohlmeyer
09:06 [lammps-users] pair_style hybrid Nader

October 28, 2017
14:26 Re: [lammps-users] Error in lammps file run Wes Barnett
12:10 Re: [lammps-users] bond atom missing in image check Hossein Geraili
10:43 Re: [lammps-users] bond atom missing in image check Hossein Geraili
07:43 Re: [lammps-users] Kinetic energy Steve Plimpton
07:41 Re: [lammps-users] Error while compilation of lammps package - user misc. Steve Plimpton
07:40 Re: [lammps-users] VDW radius of TIP3P Steve Plimpton
07:38 Re: [lammps-users] (no subject) Steve Plimpton
07:36 Re: [lammps-users] energy surface Steve Plimpton

October 27, 2017
19:32 [lammps-users] Pump-probe technique YOHANNA Jacob Baro
18:49 [lammps-users] GAFF Preparation for LAMMPS MD Simulation
15:36 [lammps-users] GCMC crashes with "Out of range atoms" error but the system is fine when running regular MD Luis Ruiz
14:40 [lammps-users] How to convert simulation box type Khourshaei Shar, Ali
14:19 [lammps-users] How to build a cubic box Khourshaei Shar, Ali
12:44 Re: [lammps-users] Error in lammps file run Wes Barnett
12:42 Re: [lammps-users] Lammps install in stampede2 Ray Shan
11:37 [lammps-users] Error in lammps file run Sanjay Jagga
11:28 Re: [lammps-users] Save redundancy in the input file Axel Kohlmeyer
11:09 Re: [lammps-users] Lammps install in stampede2 Ray Shan
11:03 Re: [lammps-users] Save redundancy in the input file Lijie Tu
10:32 Re: [lammps-users] Lammps install in stampede2 Ray Shan
10:18 [lammps-users] Lammps install in stampede2 sungpar
09:42 Re: [lammps-users] fix bond/create problem Axel Kohlmeyer
09:32 Re: [lammps-users] dump image Axel Kohlmeyer
06:52 Re: [lammps-users] Number of process Wes Barnett
06:45 [lammps-users] fix bond/create problem Massimo Pica Ciamarra
01:59 Re: [lammps-users] Number of process Asadollahzadeh
01:52 Re: [lammps-users] [EXTERNAL] Re: slab correction in PPPM/disp and Ewald/disp reza N.Z
01:29 Re: [lammps-users] Number of process Rajesh
01:25 [lammps-users] Number of process Asadollahzadeh
01:22 [lammps-users] lammps Sugan Ya
00:57 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp reza N.Z

October 26, 2017
22:26 [lammps-users] dump image Massimo Pica Ciamarra
16:00 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Christopher Knight
15:55 [lammps-users] How to build a cubic simulation box ali . khourshaei71
15:47 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Moore, Stan
15:12 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Christopher Knight
15:05 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Moore, Stan
15:03 Re: [lammps-users] Read_restart changing box parameters Axel Kohlmeyer
15:00 Re: [lammps-users] IF command documentation Axel Kohlmeyer
13:38 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Christopher Knight
11:56 [lammps-users] IF command documentation Jatin Kashyap
11:54 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Moore, Stan
11:53 [lammps-users] Bi-axial loading in LAMMPS Sushil Kumar
10:26 Re: [lammps-users] [EXTERNAL] Re: slab correction in PPPM/disp and Ewald/disp Moore, Stan
07:55 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp Axel Kohlmeyer
06:41 Re: [lammps-users] Read_restart changing box parameters Axel Kohlmeyer
06:20 Re: [lammps-users] Read_restart changing box parameters Carter Rhea
06:09 Re: [lammps-users] Read_restart changing box parameters Axel Kohlmeyer
06:04 Re: [lammps-users] Read_restart changing box parameters Carter Rhea
04:17 [lammps-users] Problem in Tensile Testing of Nanocomposite Jit Sarkar
02:47 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp reza N.Z

October 25, 2017
16:14 Re: [lammps-users] Save redundancy in the input file Axel Kohlmeyer
15:11 [lammps-users] Save redundancy in the input file Lijie Tu
12:34 Re: [lammps-users] can new atom's property be calculated using an existing pair_style? Axel Kohlmeyer
12:21 Re: [lammps-users] can new atom's property be calculated using an existing pair_style? Quang Ha
11:43 Re: [lammps-users] Read_restart changing box parameters Axel Kohlmeyer
11:26 [lammps-users] Read_restart changing box parameters Carter Rhea
09:50 Re: [lammps-users] Cannot fetch emails from mail list anymore Moore, Stan
08:59 Re: [lammps-users] Questions about the bias added by metadynamics Giacomo Fiorin
08:33 Re: [lammps-users] (no subject) Axel Kohlmeyer
08:31 Re: [lammps-users] can new atom's property be calculated using an existing pair_style? Axel Kohlmeyer
07:51 Re: [lammps-users] can new atom's property be calculated using an existing pair_style? Quang Ha
05:40 [lammps-users] (no subject) sanchari bhatt
05:30 Re: [lammps-users] [lammps -users]Computational Material science books sumit nagar

October 24, 2017
19:05 Re: [lammps-users] [EXTERNAL] how to perform grand canonical Monte Carlo simulation for binary mixture by LAMMPS? chenwei
16:16 Re: [lammps-users] radiation effect Axel Kohlmeyer
16:13 Re: [lammps-users] can new atom's property be calculated using an existing pair_style? Axel Kohlmeyer
15:40 Re: [lammps-users] can new atom's property be calculated using an existing pair_style? Andrew Jewett
13:51 Re: [lammps-users] radiation effect Afshin Arjangmehr
12:56 [lammps-users] radiation effect Mohammad Zahidul Hossain Khan
12:56 Re: [lammps-users] [EXTERNAL] LAMMPS to Determine Fission Gas Outgassing Rate Thompson, Aidan
11:56 [lammps-users] can new atom's property be calculated using an existing pair_style? Quang Ha
11:37 [lammps-users] Why obtained values are different after run=0? Asadollahzadeh
10:00 Re: [lammps-users] Histogram of Dihedral Values Axel Kohlmeyer
09:50 Re: [lammps-users] Adding new attributes to atom_style(?) Quang Ha
09:45 Re: [lammps-users] Adding new attributes to atom_style(?) Axel Kohlmeyer
09:22 [lammps-users] Histogram of Dihedral Values Charles Belina
08:50 Re: [lammps-users] Adding new attributes to atom_style(?) Quang Ha
08:12 Re: [lammps-users] region move with periodic boundary conditions Axel Kohlmeyer
05:32 [lammps-users] region move with periodic boundary conditions Francesco Benfenati
05:19 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp Axel Kohlmeyer
04:51 Re: [lammps-users] Adding new attributes to atom_style(?) Axel Kohlmeyer
02:07 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp reza N.Z
02:06 [lammps-users] [lammps -users]Computational Material science books sumit nagar

October 23, 2017
21:39 [lammps-users] Adding new attributes to atom_style(?) Quang Ha
21:34 Re: [lammps-users] embedded atom method Axel Kohlmeyer
19:57 [lammps-users] embedded atom method Mohammad Zahidul Hossain Khan
19:57 [lammps-users] Initial box=Source units Asadollahzadeh
16:01 Re: [lammps-users] sigma5 boundary as in tutorial Axel Kohlmeyer
15:03 [lammps-users] sigma5 boundary as in tutorial Keshab Bashyal
14:40 Re: [lammps-users] Extracting per-atom potential energy with LAMMPS-Python interface Axel Kohlmeyer
14:26 Re: [lammps-users] Peridynamics using lLAMMPS Axel Kohlmeyer
12:07 Re: [lammps-users] CHARMM force field Axel Kohlmeyer
11:37 Re: [lammps-users] Youngs modulus of Al Muhammed Murat Aksoy
11:03 Re: [lammps-users] NPAT Ensemble David Stelter
10:22 [lammps-users] CHARMM force field neda Sanchuli
09:18 [lammps-users] Questions about the bias added by metadynamics Xinyi Shen
08:52 [lammps-users] Extracting per-atom potential energy with LAMMPS-Python interface Wise, Ethan Allen
07:39 Re: [lammps-users] which force field implemented in lammps should I use for battery electrolyte simulation Axel Kohlmeyer
07:36 Re: [lammps-users] (no subject) Axel Kohlmeyer
06:08 [lammps-users] which force field implemented in lammps should I use for battery electrolyte simulation Nnanna Ukoji
05:14 [lammps-users] Running lammps in parallel on windows Rajesh
02:27 Re: [lammps-users] Bonded atoms far aprt in Coarse-grained simulation Zhuangli cai
01:39 Re: [lammps-users] (no subject) sanchari bhatt
00:33 [lammps-users] (no subject) sanchari bhatt

October 22, 2017
22:58 Re: [lammps-users] Output lag between output window and log.lammps file Andrew Jewett
22:32 [lammps-users] Strain in HCP lattice kia krn
14:34 [lammps-users] Peridynamics using lLAMMPS Rushikesh Sanjay Gite am16m021
13:44 [lammps-users] Corresponding fix command & strain formula ?!? Asadollahzadeh
10:42 [lammps-users] lateral - RDF for quasi 2D system Lamm Gro
05:37 Re: [lammps-users] Format of the Data File Axel Kohlmeyer
02:19 Re: [lammps-users] Format of the Data File MASATO KOIZUMI
02:09 Re: [lammps-users] Format of the Data File Hossein Geraili
02:05 [lammps-users] Format of the Data File MASATO KOIZUMI

October 21, 2017
08:24 Re: [lammps-users] choosing the timestep in modeling membranes Axel Kohlmeyer
04:49 Re: [lammps-users] post processing for calculating the vibrational density of state Ray Shan

October 20, 2017
23:42 [lammps-users] post processing for calculating the vibrational density of state liyi bai
19:10 [lammps-users] choosing the timestep in modeling membranes jamal kazazi
15:01 [lammps-users] Youngs modulus of Al John Smith
12:19 [lammps-users] Question in Example/ELASTIC_T Ninad Bhat
11:44 Re: [lammps-users] General Questions Regarding LAMMPS Axel Kohlmeyer
11:37 [lammps-users] General Questions Regarding LAMMPS Omar Khodary
09:41 Re: [lammps-users] Pairwise force calculation in EAM potential Diaz,Adrian
06:57 Re: [lammps-users] Pairwise force calculation in EAM potential Axel Kohlmeyer
04:58 [lammps-users] Running ADP potentials on GPU ioannis.papadimitriou
03:24 [lammps-users] Pairwise force calculation in EAM potential Xiao Jia

October 19, 2017
19:48 Re: [lammps-users] GCMC can not fully fill a box with particles for high MC movement frequency Han Liu
18:29 Re: [lammps-users] [EXTERNAL] Re: Cannot fetch emails from mail list anymore Wenqiang Liu
18:19 Re: [lammps-users] Cannot fetch emails from mail list anymore Wenqiang Liu
13:59 Re: [lammps-users] Simulation warning A. M.M
13:23 Re: [lammps-users] Simulation warning Axel Kohlmeyer
13:01 Re: [lammps-users] Simulation warning A. M.M
12:59 Re: [lammps-users] 2D graphene simulation Andrew Jewett
12:34 Re: [lammps-users] Simulation warning Axel Kohlmeyer
12:22 Re: [lammps-users] Fix after read_restart Axel Kohlmeyer
12:19 Re: [lammps-users] Accessing Interatomic distances from python via lammps python library Axel Kohlmeyer
12:05 Re: [lammps-users] Fix after read_restart Wes Barnett
12:00 Re: [lammps-users] Accessing Interatomic distances from python via lammps python library Dundar Yilmaz
11:09 [lammps-users] Fix after read_restart Carter Rhea
11:01 [lammps-users] Simulation warning A. M.M
10:57 Re: [lammps-users] Ensemble concept Axel Kohlmeyer
10:54 Re: [lammps-users] Accessing Interatomic distances from python via lammps python library Axel Kohlmeyer
09:52 [lammps-users] Accessing Interatomic distances from python via lammps python library Dundar Yilmaz
09:48 Re: [lammps-users] Is it cauchy stress?! Chowdhury, Sanjib Chandra
09:35 [lammps-users] Is it cauchy stress?! Asadollahzadeh
08:40 Re: [lammps-users] Ensemble concept mehrdad zamzamian
07:52 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp Axel Kohlmeyer
07:52 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Goldman, Nir
07:25 Re: [lammps-users] Questions regarding extending lammps Axel Kohlmeyer
06:44 Re: [lammps-users] Ensemble concept Oleg Sergeev
06:37 [lammps-users] Questions regarding extending lammps Sebastian Gsänger
03:42 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp reza N.Z
02:35 [lammps-users] Ensemble concept mehrdad zamzamian
01:03 [lammps-users] 2D graphene simulation Matthew Anthony Xuereb

October 18, 2017
23:12 Re: [lammps-users] pylammps thermo_style issue Axel Kohlmeyer
19:54 Re: [lammps-users] units metal vs real -Reaxff Oleg Sergeev
19:28 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Oleg Sergeev
19:12 Re: [lammps-users] Water diffusion coefficient from MSD Ray Shan
18:37 [lammps-users] NPAT Ensemble Sina Mirzaeifard
15:14 Re: [lammps-users] Fwd: Problem with fix rigid Andrew Jewett
15:01 Re: [lammps-users] dihedral_style multi/harmonic Andrew Jewett
12:44 Re: [lammps-users] Running LAMMPS from PYTHON via python interface to Lammps Axel Kohlmeyer
12:17 Re: [lammps-users] Running LAMMPS from PYTHON via python interface to Lammps Dundar Yilmaz
12:09 Re: [lammps-users] Running LAMMPS from PYTHON via python interface to Lammps Axel Kohlmeyer
11:43 [lammps-users] Running LAMMPS from PYTHON via python interface to Lammps Dundar Yilmaz
10:14 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Steve Plimpton
09:19 Re: [lammps-users] bond atom missing in image check Stefan Paquay
09:08 Re: [lammps-users] bond atom missing in image check Stefan Paquay
09:07 Re: [lammps-users] bond atom missing in image check Stefan Paquay
08:50 Re: [lammps-users] RATTLE in version 2017! Hai Hoang
08:27 Re: [lammps-users] Angle Harmonic Gradients question Axel Kohlmeyer
08:19 Re: [lammps-users] RATTLE in version 2017! Axel Kohlmeyer
08:15 Re: [lammps-users] units metal vs real -Reaxff Axel Kohlmeyer
07:46 [lammps-users] units metal vs real -Reaxff Alexandra Davila
07:39 Re: [lammps-users] [EXTERNAL] Re: Cannot fetch emails from mail list anymore Moore, Stan
05:24 [lammps-users] dihedral_style multi/harmonic Ali Golbaf
02:25 [lammps-users] RATTLE in version 2017! Hai Hoang
01:12 Re: [lammps-users] Reg: compiling two data files in the script Zeeshan Ahmed

October 17, 2017
22:43 [lammps-users] Reg: compiling two data files in the script ZEESHAN AHMED
22:30 [lammps-users] Output lag between output window and log.lammps file Rajesh
21:02 Re: [lammps-users] Cannot fetch emails from mail list anymore Axel Kohlmeyer
20:31 Re: [lammps-users] bond atom missing in image check Hossein Geraili
20:22 [lammps-users] Cannot fetch emails from mail list anymore Wenqiang Liu
19:23 Re: [lammps-users] Fwd: Problem with fix rigid Ali Mirmohammadi
17:53 Re: [lammps-users] Question on Coulomb potential in LAMMPS Axel Kohlmeyer
17:33 Re: [lammps-users] Read in Angular Momentum in .lj file Axel Kohlmeyer
16:30 Re: [lammps-users] [EXTERNAL] Re: Using KOKKOS package (Cuda, OpenMP ) with intel compiler. Moore, Stan
15:57 [lammps-users] Read in Angular Momentum in .lj file Carter Rhea
14:08 Re: [lammps-users] slab correction in PPPM/disp and Ewald/disp Axel Kohlmeyer
13:51 [lammps-users] Question on Coulomb potential in LAMMPS A. M.M
11:36 [lammps-users] bond atom missing in image check Hossein Geraili
11:16 [lammps-users] slab correction in PPPM/disp and Ewald/disp reza N.Z
09:53 Re: [lammps-users] ReaxFF simulation about Pt catalyst Oleg Sergeev
09:44 Re: [lammps-users] Water diffusion coefficient from MSD Ray Shan
09:37 Re: [lammps-users] ReaxFF simulation about Pt catalyst Ray Shan
07:32 [lammps-users] Angle Harmonic Gradients question Matthew Wander
07:32 Re: [lammps-users] Regarding Peri style Axel Kohlmeyer
06:33 [lammps-users] Regarding Peri style Rushikesh Sanjay Gite am16m021
05:54 Re: [lammps-users] ReaxFF simulation about Pt catalyst Oleg Sergeev
05:50 Re: [lammps-users] ReaxFF simulation about Pt catalyst Oleg Sergeev
03:44 [lammps-users] ReaxFF simulation about Pt catalyst 吴胜
01:04 Re: [lammps-users] interaction energy between a nanoparticle and h2o molecule Axel Kohlmeyer
00:49 Re: [lammps-users] interaction energy between a nanoparticle and h2o molecule ZEESHAN AHMED
00:40 Re: [lammps-users] LB mixing rule Axel Kohlmeyer
00:40 Re: [lammps-users] interaction energy between a nanoparticle and h2o molecule Axel Kohlmeyer
00:20 [lammps-users] LB mixing rule ZEESHAN AHMED
00:07 [lammps-users] interaction energy between a nanoparticle and h2o molecule ZEESHAN AHMED

October 16, 2017
23:54 [lammps-users] Kinetic energy Hossein Geraili
22:56 [lammps-users] pylammps thermo_style issue Gideon Simpson
13:29 Re: [lammps-users] Does user-omp work with mpich? Axel Kohlmeyer
13:26 Re: [lammps-users] Inquiry on special_bonds and first weighting coefficient Axel Kohlmeyer
13:12 Re: [lammps-users] Using GROMOS Force Field in lammps Axel Kohlmeyer
11:44 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Oleg Sergeev
10:37 [lammps-users] Inquiry on special_bonds and first weighting coefficient MASATO KOIZUMI
09:52 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Song, Zhigong
08:58 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Cawkwell, Marc Jon
08:06 Re: [lammps-users] [EXTERNAL] hi about the potential parameters of latte Steve Plimpton

October 15, 2017
23:05 Re: [lammps-users] Using OpenMP Rajesh
22:25 [lammps-users] Using GROMOS Force Field in lammps Faust SHI
19:28 Re: [lammps-users] maxval error Axel Kohlmeyer
19:01 [lammps-users] maxval error Gideon Simpson
18:32 Re: [lammps-users] Bonded atoms far aprt in Coarse-grained simulation Andrew Jewett
16:41 Re: [lammps-users] Does user-omp work with mpich? Mockele Nkrumah
14:32 [lammps-users] Water diffusion coefficient from MSD sungpar
13:12 Re: [lammps-users] Using OpenMP Giacomo Fiorin
12:57 Re: [lammps-users] Does user-omp work with mpich? Axel Kohlmeyer
10:33 [lammps-users] Does user-omp work with mpich? Mockele Nkrumah
10:07 Re: [lammps-users] Error while compilation of lammps package - user misc. R. Varsha
10:00 Re: [lammps-users] Error while compilation of lammps package - user misc. R. Varsha
08:46 Re: [lammps-users] Error while compilation of lammps package - user misc. R. Varsha
08:32 Re: [lammps-users] Error while compilation of lammps package - user misc. Rajesh
08:27 [lammps-users] Error while compilation of lammps package - user misc. R. Varsha
06:20 Re: [lammps-users] Total energy Axel Kohlmeyer
06:04 Re: [lammps-users] RDF calculation for a chunk of atoms Axel Kohlmeyer
00:08 [lammps-users] Using OpenMP Rajesh

October 14, 2017
20:49 [lammps-users] Total energy Hossein Geraili
15:37 [lammps-users] RDF calculation for a chunk of atoms melika_ bm85
09:37 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. A. M.M
09:25 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. Axel Kohlmeyer
08:22 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. A. M.M

October 13, 2017
16:03 Re: [lammps-users] [EXTERNAL] how to perform grand canonical Monte Carlo simulation for binary mixture by LAMMPS? Thompson, Aidan
14:00 [lammps-users] VDW radius of TIP3P Neda Rafiee
10:02 Re: [lammps-users] Python and animations Gideon Simpson
08:33 Re: [lammps-users] trouble using rigid bodies in simulation (lost atoms) surendra jain
08:27 Re: [lammps-users] trouble using rigid bodies in simulation (lost atoms) Axel Kohlmeyer
08:12 [lammps-users] trouble using rigid bodies in simulation (lost atoms) surendra jain
07:46 Re: [lammps-users] Python and animations Richard Berger
06:46 Re: [lammps-users] Virial part in Pressure calculation Axel Kohlmeyer
02:33 [lammps-users] Virial part in Pressure calculation Xiao Jia
01:57 [lammps-users] (no subject) Егор Никитин

October 12, 2017
22:48 Re: [lammps-users] (no subject) sanchari bhatt
22:09 Re: [lammps-users] Problem in Pt cluster Axel Kohlmeyer
21:47 Re: [lammps-users] Python and animations Gideon Simpson
21:46 Re: [lammps-users] PyLammps crashing Gideon Simpson
19:43 [lammps-users] Problem in Pt cluster 吴胜
16:52 Re: [lammps-users] GCMC can not fully fill a box with particles for high MC movement frequency Han Liu
14:00 Re: [lammps-users] User Created Potentials Stefan Paquay
13:32 Re: [lammps-users] User Created Potentials Axel Kohlmeyer
13:02 Re: [lammps-users] User Created Potentials Stefan Paquay
12:57 Re: [lammps-users] PyLammps crashing Richard Berger
12:45 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. Axel Kohlmeyer
12:35 Re: [lammps-users] User Created Potentials Axel Kohlmeyer
12:20 Re: [lammps-users] PyLammps crashing Richard Berger
12:09 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. A. M.M
12:06 [lammps-users] User Created Potentials Carter Rhea
12:01 Re: [lammps-users] Python and animations Richard Berger
09:31 Re: [lammps-users] energy surface Asadollahzadeh
09:29 Re: [lammps-users] PyLammps crashing Gideon Simpson
09:24 Re: [lammps-users] Python and animations Gideon Simpson
08:06 Re: [lammps-users] Bonded atoms far aprt in Coarse-grained simulation Zhuangli cai
07:58 Re: [lammps-users] Dipole precessing in Electric Field Steve Plimpton
07:55 Re: [lammps-users] GCMC can not fully fill a box with particles for high MC movement frequency Steve Plimpton
07:46 Re: [lammps-users] (no subject) Steve Plimpton
07:44 Re: [lammps-users] PyLammps crashing Richard Berger
07:38 Re: [lammps-users] Python and animations Richard Berger
07:37 Re: [lammps-users] Hybrid pair style Steve Plimpton
07:32 Re: [lammps-users] Finding out if the molecule or in file is bad. Steve Plimpton
07:31 Re: [lammps-users] Particles outside surface of region Steve Plimpton
07:24 Re: [lammps-users] Python and animations Steve Plimpton
07:22 Re: [lammps-users] EAM Mixing Problem Steve Plimpton
07:16 Re: [lammps-users] optimization of structure Steve Plimpton
07:14 Re: [lammps-users] tally fix langevin Steve Plimpton
07:08 Re: [lammps-users] Inquiry on Epsilon/Sigma Units in Quartic Bonds Steve Plimpton
07:03 Re: [lammps-users] energy surface Steve Plimpton
07:01 Re: [lammps-users] PyLammps crashing Steve Plimpton
07:00 Re: [lammps-users] Bonded atoms far aprt in Coarse-grained simulation Steve Plimpton
06:58 Re: [lammps-users] distribution of the pressure in gas Steve Plimpton
06:54 Re: [lammps-users] abnormal value of elastic constant Steve Plimpton
04:34 [lammps-users] Dipole precessing in Electric Field carles calero
01:21 Re: [lammps-users] Using LAMMPS on Cloud Supercomputers Titusi Forum
00:05 Re: [lammps-users] Run command Rajesh
00:02 Re: [lammps-users] Run command Axel Kohlmeyer

October 11, 2017
23:34 Re: [lammps-users] Run command Asadollahzadeh
23:22 Re: [lammps-users] Run command Axel Kohlmeyer
23:19 Re: [lammps-users] group/group force Axel Kohlmeyer
23:07 Re: [lammps-users] Fwd: Problem with fix rigid Axel Kohlmeyer
21:11 [lammps-users] Run command Asadollahzadeh
19:57 Re: [lammps-users] Does LAMMPS use Bounding volume for rigid body collision detection in the broad phase? KeepFIT
18:38 [lammps-users] Fwd: Problem with fix rigid Ali Mirmohammadi
18:28 Re: [lammps-users] Does LAMMPS use Bounding volume for rigid body collision detection in the broad phase? Axel Kohlmeyer
18:01 Re: [lammps-users] regarding fix neb Deepesh Giri
17:48 Re: [lammps-users] Does LAMMPS use Bounding volume for rigid body collision detection in the broad phase? KeepFIT
16:38 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. A. M.M
15:57 Re: [lammps-users] Force Field Axel Kohlmeyer
15:51 Re: [lammps-users] Does LAMMPS use Bounding volume for rigid body collision detection in the broad phase? Axel Kohlmeyer
15:46 Re: [lammps-users] regarding fix neb Axel Kohlmeyer
15:31 [lammps-users] Force Field Quentin Faure
15:15 [lammps-users] regarding fix neb Deepesh Giri
14:36 [lammps-users] Does LAMMPS use Bounding volume for rigid body collision detection in the broad phase? KeepFIT
11:53 Re: [lammps-users] group/group force Giacomo Fiorin
11:06 [lammps-users] group/group force ‪Mostafa Safdari moghaddam‬ ‪
09:49 Re: [lammps-users] Out of range atoms - cannot compute PPPM Axel Kohlmeyer
09:48 Re: [lammps-users] Out of range atoms - cannot compute PPPM Axel Kohlmeyer
09:41 Re: [lammps-users] Out of range atoms - cannot compute PPPM R. Varsha
09:40 Re: [lammps-users] Out of range atoms - cannot compute PPPM R. Varsha
09:39 Re: [lammps-users] Out of range atoms - cannot compute PPPM Axel Kohlmeyer
09:38 Re: [lammps-users] Out of range atoms - cannot compute PPPM R. Varsha
09:36 Re: [lammps-users] Out of range atoms - cannot compute PPPM R. Varsha
09:36 Re: [lammps-users] Out of range atoms - cannot compute PPPM Axel Kohlmeyer
09:33 [lammps-users] Out of range atoms - cannot compute PPPM R. Varsha
09:09 Re: [lammps-users] CG Axel Kohlmeyer
08:56 [lammps-users] CG ‪Mostafa Safdari moghaddam‬ ‪
07:34 Re: [lammps-users] Drag value fix npt Axel Kohlmeyer
06:55 [lammps-users] Drag value fix npt Sengupta, S.
06:18 Re: [lammps-users] [lammps users] Graphene with epoxy problem sumit nagar
05:14 Re: [lammps-users] [lammps users] Graphene with epoxy problem Axel Kohlmeyer
05:03 Re: [lammps-users] bug in lammps ? Karthik Sasihithlu
05:01 Re: [lammps-users] [lammps users] Graphene with epoxy problem sumit nagar
04:53 Re: [lammps-users] [lammps users] Graphene with epoxy problem Axel Kohlmeyer
04:52 Re: [lammps-users] bug in lammps ? Axel Kohlmeyer
04:48 Re: [lammps-users] fracture after crack propagation (problem) Axel Kohlmeyer
04:45 Re: [lammps-users] bug in lammps ? Karthik Sasihithlu
04:43 Re: [lammps-users] fracture after crack propagation(problem) Axel Kohlmeyer
04:40 [lammps-users] [lammps users] Graphene with epoxy problem sumit nagar
04:35 [lammps-users] fracture after crack propagation (problem) sumit nagar
04:32 Re: [lammps-users] Issues with PPPM errors Axel Kohlmeyer
04:30 Re: [lammps-users] bug in lammps ? Axel Kohlmeyer
01:19 Re: [lammps-users] fracture after crack propagation(problem) sumit nagar
01:11 Re: [lammps-users] bug in lammps ? Karthik Sasihithlu
01:04 [lammps-users] Issues with PPPM errors Jonathan Torstensen

October 10, 2017
23:13 [lammps-users] GCMC can not fully fill a box with particles for high MC movement frequency Han Liu
16:04 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. Axel Kohlmeyer
15:44 Re: [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. A. M.M
14:21 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Afshin Arjangmehr
13:47 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Michael Gauci
12:36 Re: [lammps-users] bug in lammps ? Axel Kohlmeyer
10:25 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Axel Kohlmeyer
09:50 [lammps-users] bug in lammps ? Karthik Sasihithlu
09:37 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Michael Gauci
08:41 [lammps-users] Using KOKKOS package (Cuda, OpenMP ) with intel compiler. A. M.M
06:59 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Axel Kohlmeyer
04:03 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Michael Gauci

October 09, 2017
20:44 Re: [lammps-users] (no subject) sanchari bhatt
19:56 Re: [lammps-users] [lammps-Users]Script to check Single layer graphene deformation in x direction sumit nagar
19:52 [lammps-users] [lammps -Users] adding epoxy to a single layer graphene sheet sumit nagar
18:22 Re: [lammps-users] datafile format Axel Kohlmeyer
18:17 Re: [lammps-users] datafile format Diaz,Adrian
16:46 Re: [lammps-users] g++ error (although not the stated compiler in makefile) Axel Kohlmeyer
16:34 [lammps-users] g++ error (although not the stated compiler in makefile) Michael Gauci
16:04 Re: [lammps-users] Fix MSCG library Axel Kohlmeyer
16:02 Re: [lammps-users] datafile format Axel Kohlmeyer
14:50 Re: [lammps-users] about OMP and TAD Fernanda S Teixeira
14:16 Re: [lammps-users] about OMP and TAD Axel Kohlmeyer
13:59 Re: [lammps-users] about OMP and TAD Axel Kohlmeyer
13:54 Re: [lammps-users] Converting packmol output to lammps data file Axel Kohlmeyer
13:51 Re: [lammps-users] about OMP and TAD Fernanda S Teixeira
13:51 Re: [lammps-users] Cut-On function (!) Axel Kohlmeyer
13:50 Re: [lammps-users] Benzene fix rigid Axel Kohlmeyer
13:49 Re: [lammps-users] about OMP and TAD Axel Kohlmeyer
13:21 [lammps-users] about OMP and TAD Fernanda S Teixeira
12:30 Re: [lammps-users] Converting packmol output to lammps data file renefbg
11:47 Re: [lammps-users] Benzene fix rigid Stefan Paquay
11:39 [lammps-users] Benzene fix rigid sungpar
11:11 Re: [lammps-users] why etail is zero Axel Kohlmeyer
09:12 [lammps-users] why etail is zero Hossein Geraili
09:11 [lammps-users] Cut-On function (!) Nasiri, Samaneh
04:14 Re: [lammps-users] (no subject) Axel Kohlmeyer

October 08, 2017
23:56 [lammps-users] datafile format Diaz,Adrian
22:57 [lammps-users] (no subject) sanchari bhatt
16:37 Re: [lammps-users] Epsilon/Sigma Parameter for Quartic Bonds Axel Kohlmeyer
15:40 [lammps-users] Epsilon/Sigma Parameter for Quartic Bonds MASATO KOIZUMI
06:59 [lammps-users] Fix MSCG library Asadollahzadeh
06:12 [lammps-users] problem with non stable results in calculation of thermal conductivity using green-kubo method Masoud Jedari
05:18 [lammps-users] ion pair simulation Hossein Geraili
03:42 Re: [lammps-users] FW: Restart not exact Sengupta, S.

October 07, 2017
22:30 [lammps-users] Problem with fix rigid Ali Mirmohammadi
13:01 Re: [lammps-users] Surprising difference between temperature calculated by "temp" themo-keyword and T= 2*ke/(3*kb*N) Axel Kohlmeyer
10:12 [lammps-users] problem with non stable results in calculation of thermal conductivity using green-kubo method Masoud Jedari
08:57 [lammps-users] Surprising difference between temperature calculated by "temp" themo-keyword and T= 2*ke/(3*kb*N) Bhanuday Sharma
02:40 [lammps-users] Hybrid pair style Rajesh

October 06, 2017
15:39 Re: [lammps-users] Fwd: Moltemplate Execution Andrew Jewett
15:35 Re: [lammps-users] Fwd: Moltemplate Execution Axel Kohlmeyer
15:03 Re: [lammps-users] Question about Ewald summation in 1, 4 pair interactions Axel Kohlmeyer
15:02 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
14:52 Re: [lammps-users] Fwd: Moltemplate Execution Axel Kohlmeyer
14:48 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
14:40 Re: [lammps-users] Initial relax box after applying displacement Axel Kohlmeyer
14:38 Re: [lammps-users] Fwd: Moltemplate Execution Axel Kohlmeyer
14:25 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
14:20 Re: [lammps-users] msd calculation for WATER(SPC) Model Andrew Jewett
13:26 Re: [lammps-users] Poisuille flow Axel Kohlmeyer
13:07 Re: [lammps-users] msd calculation for WATER(SPC) Model Chowdhury, Sanjib Chandra
12:58 Re: [lammps-users] Poisuille flow m n
12:25 Re: [lammps-users] FW: Restart not exact Axel Kohlmeyer
12:24 Re: [lammps-users] FW: Restart not exact Stefan Paquay
12:22 [lammps-users] msd calculation for WATER(SPC) Model sungpar
12:03 [lammps-users] FW: Restart not exact Sengupta, S.
09:43 Re: [lammps-users] Couette flow with heat transfer m n
07:02 Re: [lammps-users] Initial relax box after applying displacement Giacomo Fiorin
06:52 Re: [lammps-users] MS-CG Axel Kohlmeyer
06:11 [lammps-users] MS-CG ‪Mostafa Safdari moghaddam‬ ‪
04:34 [lammps-users] Question about Ewald summation in 1, 4 pair interactions J. Rene-Espinosa
02:15 [lammps-users] Initial relax box after applying displacement Asadollahzadeh

October 05, 2017
19:57 Re: [lammps-users] Amber FF Andrew Jewett
16:28 Re: [lammps-users] Converting packmol output to lammps data file Andrew Jewett
14:18 [lammps-users] Finding out if the molecule or in file is bad. Jonathan Torstensen
13:42 Re: [lammps-users] Pair style lj Steve Plimpton
13:39 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Steve Plimpton
13:18 [lammps-users] Particles outside surface of region Jagroop Kaur
12:23 Re: [lammps-users] barostat in systems with rigid and non-rigid bodies Steve Plimpton
11:55 Re: [lammps-users] Couette flow with heat transfer Steve Plimpton
11:53 Re: [lammps-users] real number of dihedral types in DPPC Steve Plimpton
11:40 Re: [lammps-users] Variable in loop Giacomo Fiorin
11:19 Re: [lammps-users] Variable in loop Giacomo Fiorin
11:14 [lammps-users] Variable in loop Asadollahzadeh
10:52 Re: [lammps-users] Does Timestep (time units) matter in a uniaxial tensile simulation using ReaxFF? Anubhav Roy
10:49 Re: [lammps-users] Does Timestep (time units) matter in a uniaxial tensile simulation using ReaxFF? Axel Kohlmeyer
10:27 Re: [lammps-users] Does Timestep (time units) matter in a uniaxial tensile simulation using ReaxFF? Anubhav Roy
09:31 Re: [lammps-users] Thermostating dipoles with angular velocity bias in shear flow Qi Liu
08:54 [lammps-users] Converting packmol output to lammps data file renefbg
07:55 Re: [lammps-users] ERROR DUMP COMMAND Axel Kohlmeyer
07:52 [lammps-users] ERROR DUMP COMMAND Carmen Rotolo
06:18 Re: [lammps-users] Does Timestep (time units) matter in a uniaxial tensile simulation using ReaxFF? Axel Kohlmeyer

October 04, 2017
21:37 [lammps-users] Does Timestep (time units) matter in a uniaxial tensile simulation using ReaxFF? Anubhav Roy
18:14 [lammps-users] Python and animations Gideon Simpson
17:42 Re: [lammps-users] Poisuille flow m n
17:27 Re: [lammps-users] Poisuille flow Axel Kohlmeyer
16:34 Re: [lammps-users] Poisuille flow m n
16:27 Re: [lammps-users] Poisuille flow Kasra F. Hesary
16:18 Re: [lammps-users] Poisuille flow m n
16:01 Re: [lammps-users] Amber FF Andrew Jewett
15:54 Re: [lammps-users] Poisuille flow Axel Kohlmeyer
15:47 [lammps-users] Poisuille flow m n
12:38 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
11:00 Re: [lammps-users] Fwd: pcff force field Rajesh
10:50 Re: [lammps-users] Fwd: pcff force field Vanessa Oklejas
10:37 Re: [lammps-users] Fwd: pcff force field Rajesh
10:31 Re: [lammps-users] Fwd: pcff force field Vanessa Oklejas
09:34 Re: [lammps-users] deviation Hossein Geraili
08:37 Re: [lammps-users] Fwd: pcff force field Rajesh
07:29 [lammps-users] EAM Mixing Problem Rosita Masoudi
07:23 [lammps-users] optimization of structure Hossein Geraili
05:59 Re: [lammps-users] [EXTERNAL] Re: How hybrid/overlay works, especifically in case of AIREBO and TERSOFF Nasiri, Samaneh
05:30 [lammps-users] tally fix langevin Karthik Sasihithlu
00:46 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh

October 03, 2017
21:22 Re: [lammps-users] Amber FF Andrew Jewett
20:19 Re: [lammps-users] Amber FF James Kress
20:17 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
19:57 Re: [lammps-users] Amber FF Andrew Jewett
19:42 Re: [lammps-users] Fwd: pcff force field Rajesh
19:13 Re: [lammps-users] Amber FF James Kress
18:04 Re: [lammps-users] Amber FF Andrew Jewett
14:25 [lammps-users] Thermostating dipoles with angular velocity bias in shear flow Qi Liu
12:40 Re: [lammps-users] Fwd: pcff force field Andrew Jewett
11:59 [lammps-users] deviation Hossein Geraili
11:25 [lammps-users] Inquiry on Epsilon/Sigma Units in Quartic Bonds MASATO KOIZUMI
08:35 [lammps-users] energy surface Asadollahzadeh
08:19 Re: [lammps-users] Amber FF Hossein Geraili
08:03 Re: [lammps-users] Amber FF Axel Kohlmeyer
07:37 [lammps-users] Amber FF Hossein Geraili
03:46 Re: [lammps-users] Debye frequency in solid Jan Fikar

October 02, 2017
18:08 Re: [lammps-users] Fwd: Moltemplate Execution Andrew Jewett
16:45 Re: [lammps-users] Fixing the position of graphene sheet Andrew Jewett
12:54 Re: [lammps-users] how to calculate stress tensor of a bin Eric Murphy
12:09 [lammps-users] PyLammps crashing Gideon Simpson
11:32 Re: [lammps-users] ERROR: Molecule topology/atom exceeds system topology/atom (../molecule.cpp:1398) Axel Kohlmeyer
10:58 Re: [lammps-users] no output from fix ave/chunk command Axel Kohlmeyer
10:37 [lammps-users] About use of TAD command Fernanda S Teixeira
08:33 [lammps-users] no output from fix ave/chunk command ruiyan
08:14 Re: [lammps-users] Pair Coul Wolf Axel Kohlmeyer
08:00 [lammps-users] Pair Coul Wolf Matthew Wander
05:00 Re: [lammps-users] nonpriodic boundry condition Axel Kohlmeyer
04:53 Re: [lammps-users] nonpriodic boundry condition Hossein Geraili
04:28 Re: [lammps-users] nonpriodic boundry condition Axel Kohlmeyer
04:21 Re: [lammps-users] deposition Axel Kohlmeyer
02:59 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
02:14 [lammps-users] deposition Digvijay Yadav

October 01, 2017
22:46 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh
20:24 Re: [lammps-users] nonpriodic boundry condition Hossein Geraili
13:18 Re: [lammps-users] nonpriodic boundry condition Axel Kohlmeyer
12:48 Re: [lammps-users] nonpriodic boundry condition Hossein Geraili
12:22 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh
12:20 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Ray Shan
11:44 Re: [lammps-users] nonpriodic boundry condition Hossein Geraili
11:16 Re: [lammps-users] nonpriodic boundry condition Axel Kohlmeyer
11:08 Re: [lammps-users] nonpriodic boundry condition Axel Kohlmeyer
11:01 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh
10:35 Re: [lammps-users] nonpriodic boundry condition Hossein Geraili
10:05 Re: [lammps-users] Pair style lj Rajesh
10:03 [lammps-users] nonpriodic boundry condition Hossein Geraili
09:40 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Ray Shan
09:38 Re: [lammps-users] Pair style lj Ray Shan
02:03 [lammps-users] Pair style lj Rajesh
01:12 [lammps-users] Bonded atoms far aprt in Coarse-grained simulation Zhuangli cai

September 30, 2017
11:17 [lammps-users] distribution of the pressure in gas Reza Rabbani
10:26 Re: [lammps-users] Fwd: deposition region extends Ray Shan
10:21 Re: [lammps-users] Debye frequency in solid Axel Kohlmeyer
09:10 Re: [lammps-users] fix deposit Axel Kohlmeyer
09:07 Re: [lammps-users] Fwd: deposition region extends Axel Kohlmeyer
09:05 Re: [lammps-users] pair style hybrid overlay Axel Kohlmeyer
03:03 [lammps-users] Fwd: deposition region extends Digvijay Yadav
02:08 [lammps-users] fix deposit Digvijay Yadav

September 29, 2017
18:29 Re: [lammps-users] Coarse-grained polymer in solvent Andrew Jewett
10:18 [lammps-users] how to calculate stress tensor of a bin Yan, Rui
10:17 [lammps-users] abnormal value of elastic constant maryam akbari
10:12 Re: [lammps-users] Debye frequency in solid Jan Fikar
09:52 [lammps-users] pair style hybrid overlay Matthew Wander
09:51 [lammps-users] why fix ave/chunk doesn't output any information when use rerun command Yan, Rui
00:40 [lammps-users] ERROR: Molecule topology/atom exceeds system topology/atom (../molecule.cpp:1398) sunny

September 28, 2017
19:36 Re: [lammps-users] Coarse-grained polymer in solvent Stefan Paquay
18:59 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh
18:01 Re: [lammps-users] Coarse-grained polymer in solvent Axel Kohlmeyer
17:20 [lammps-users] Coarse-grained polymer in solvent Kushal Panchal
16:24 [lammps-users] Fixing the position of graphene sheet Jatin Kashyap
16:08 Re: [lammps-users] Quartic Bonds and Lennard-Jones Potential Axel Kohlmeyer
16:01 Re: [lammps-users] Quartic Bonds and Lennard-Jones Potential MASATO KOIZUMI
15:59 Re: [lammps-users] Fix shake command issue Michał Kański
15:30 Re: [lammps-users] Adjusting pressure Axel Kohlmeyer
15:23 Re: [lammps-users] Quartic Bonds and Lennard-Jones Potential Axel Kohlmeyer
15:02 [lammps-users] Quartic Bonds and Lennard-Jones Potential MASATO KOIZUMI
14:26 Re: [lammps-users] ERROR: No pair reax/c for fix qeq/reax Ray Shan
14:07 [lammps-users] question about TAD Fernanda S Teixeira
05:37 [lammps-users] Fix shake command issue Christos Bardas - 3ME
03:51 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
03:48 Re: [lammps-users] Fwd: Moltemplate Execution R. Varsha
01:09 [lammps-users] Adjusting pressure Omar Khalil

September 27, 2017
23:21 [lammps-users] deposition region extends Digvijay Yadav
18:15 Re: [lammps-users] Fwd: Moltemplate Execution Andrew Jewett
07:27 Re: [lammps-users] The results from GPU and MPI LAMMPS were very different. Axel Kohlmeyer
07:25 Re: [lammps-users] segmentation fault (core dumped) Axel Kohlmeyer
07:14 [lammps-users] Debye frequency in solid Jan Fikar
05:47 Re: [lammps-users] dump image/movie on macos Axel Kohlmeyer
03:39 [lammps-users] Fwd: [lammps-user] learning resources required sumit nagar
03:30 [lammps-users] [lammps-user] learning resources required sumit nagar
00:43 [lammps-users] dump image/movie on macos Gideon Simpson

September 26, 2017
20:48 [lammps-users] The results from GPU and MPI LAMMPS were very different. shijy@...516...
16:28 [lammps-users] Fwd: Moltemplate Execution R. Varsha
09:07 [lammps-users] segmentation fault (core dumped) Myatnoe Suukyi
08:22 [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh
08:01 Re: [lammps-users] the region temperature calculated by <compute temp/region> command shows invalid result Yuka Uemura
06:37 Re: [lammps-users] Compilation warning A. M.M
06:34 [lammps-users] [lammps-Users]Script to check Single layer graphene deformation in x direction sumit nagar
05:30 Re: [lammps-users] the region temperature calculated by <compute temp/region> command shows invalid result Axel Kohlmeyer
03:55 [lammps-users] how to perform grand canonical Monte Carlo simulation for binary mixture by LAMMPS? chenwei

September 25, 2017
23:56 Re: [lammps-users] the region temperature calculated by <compute temp/region> command shows invalid result Yuka Uemura
22:11 [lammps-users] Keeping structures at fixed position Rajesh
16:38 Re: [lammps-users] Compilation warning Stefan Paquay
16:24 Re: [lammps-users] Compilation warning Axel Kohlmeyer
16:20 Re: [lammps-users] Compilation warning Stefan Paquay
16:17 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
16:01 Re: [lammps-users] Compilation warning A. M.M
16:00 Re: [lammps-users] Compilation warning Axel Kohlmeyer
15:38 Re: [lammps-users] Compilation warning A. M.M
15:18 Re: [lammps-users] Wall lj/93 pbc query Axel Kohlmeyer
15:07 Re: [lammps-users] Wall lj/93 pbc query Sengupta, S.
14:36 Re: [lammps-users] Compilation warning A. M.M
14:34 Re: [lammps-users] Compilation warning Axel Kohlmeyer
14:31 Re: [lammps-users] Compilation warning A. M.M
14:29 Re: [lammps-users] Compilation warning Axel Kohlmeyer
14:12 Re: [lammps-users] Compilation warning A. M.M
14:07 Re: [lammps-users] Compilation warning Axel Kohlmeyer
14:04 [lammps-users] Compilation warning A. M.M
13:38 Re: [lammps-users] Computer Difference Axel Kohlmeyer
13:06 Re: [lammps-users] LAMMPS Python Error Richard Berger
12:16 [lammps-users] deviation in result Hossein Geraili
12:15 Re: [lammps-users] Wall lj/93 pbc query Axel Kohlmeyer
12:00 Re: [lammps-users] the region temperature calculated by <compute temp/region> command shows invalid result Axel Kohlmeyer
11:49 [lammps-users] Wall lj/93 pbc query Sengupta, S.
09:31 Re: [lammps-users] barostat in systems with rigid and non-rigid bodies Stefan Paquay
09:29 Re: [lammps-users] [EXTERNAL] unrealistic values Thompson, Aidan
07:24 Re: [lammps-users] Fwd: Fwd: [lammps-user]Conversion of VMD files to lammps file -Continued Axel Kohlmeyer
07:19 Re: [lammps-users] How to use molecular's quaternions for orientation-dependent forces calculation with "hybrid sphere molecular" style? Axel Kohlmeyer
07:15 Re: [lammps-users] Fwd: Command for adding tensile force to atoms in a simulation box Axel Kohlmeyer
03:49 [lammps-users] Fwd: Command for adding tensile force to atoms in a simulation box sumit nagar
03:32 Re: [lammps-users] zero barrier from NEB calculations Emile Maras
02:31 [lammps-users] Fwd: Fwd: Command for adding tensile force to atoms in a simulation box sumit nagar
02:03 [lammps-users] Fwd: Command for adding tensile force to atoms in a simulation box sumit nagar
01:48 Re: [lammps-users] Command for adding tensile force to atoms in a simulation box sumit nagar
01:15 [lammps-users] Command for adding tensile force to atoms in a simulation box sumit nagar

September 24, 2017
16:22 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
03:47 [lammps-users] ERROR: No pair reax/c for fix qeq/reax Rajesh
02:19 [lammps-users] Fwd: Fwd: [lammps-user]Conversion of VMD files to lammps file -Continued sumit nagar

September 23, 2017
11:26 [lammps-users] How to use molecular's quaternions for orientation-dependent forces calculation with "hybrid sphere molecular" style? RainMan
09:46 Re: [lammps-users] Fwd: [lammps-user]Conversion of VMD files to lammps file -Continued Axel Kohlmeyer
01:27 [lammps-users] Fwd: [lammps -user] Learning resources sumit nagar
01:14 [lammps-users] the region temperature calculated by <compute temp/region> command shows invalid result Yuka Uemura
00:58 Re: [lammps-users] [lammps-user]Conversion of VMD files to lammps file -Continued sumit nagar
00:43 [lammps-users] Fwd: [lammps -user] Learning resources sumit nagar

September 22, 2017
23:15 [lammps-users] Fwd: [lammps-user]Conversion of VMD files to lammps file -Continued sumit nagar
17:25 [lammps-users] Couette flow with heat transfer m n
17:21 Re: [lammps-users] Illegal pair_style command Error Axel Kohlmeyer
16:39 Re: [lammps-users] Illegal pair_style command Error Jatin Kashyap
15:05 Re: [lammps-users] Illegal pair_style command Error Axel Kohlmeyer
13:37 Re: [lammps-users] Couette flow Stefan Paquay
12:30 [lammps-users] Couette flow m n
12:25 [lammps-users] Illegal pair_style command Error Jatin Kashyap
11:25 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
09:12 [lammps-users] real number of dihedral types in DPPC Neda Rafiee
08:56 Re: [lammps-users] fix npt command Rajesh
08:51 Re: [lammps-users] [lammps-user]Conversion of VMD files to lammps file -Continued Axel Kohlmeyer
08:51 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Steve Plimpton
08:49 Re: [lammps-users] fix npt command Steve Plimpton
07:32 Re: [lammps-users] [lammps -user] Learning resources Nader Ameli
07:24 Re: [lammps-users] [lammps -user] Learning resources Wes Barnett
07:04 [lammps-users] Van der Waals interlayer potential of graphenite structures: Lebedeva model Zbigniew Kozioł
07:03 [lammps-users] [lammps -user] Learning resources sumit nagar
07:01 Re: [lammps-users] accepted force field deviation Hossein Geraili
04:36 [lammps-users] [lammps-user]Conversion of VMD files to lammps file -Continued sumit nagar
02:25 [lammps-users] Moltemplate Execution R. Varsha
01:26 Re: [lammps-users] How do I generate a system.lt file? Rajesh
00:27 [lammps-users] [lammps-Users] Conversion from VMD to Lammps sumit nagar

September 21, 2017
20:17 [lammps-users] How do I generate a system.lt file? Andrew Jewett
14:15 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
14:09 [lammps-users] barostat in systems with rigid and non-rigid bodies Scott M Smith
10:26 [lammps-users] fix npt command Rajesh
10:03 Re: [lammps-users] The divergence in functional forms of ZBL screened potential Jan Fikar
08:17 Re: [lammps-users] ERROR: Illegal fix deposit command Steve Plimpton
08:16 Re: [lammps-users] The divergence in functional forms of ZBL screened potential Steve Plimpton
04:07 Re: [lammps-users] ERROR: Illegal fix deposit command Rajesh
04:04 [lammps-users] ERROR: Illegal fix deposit command Digvijay Yadav
03:33 [lammps-users] The divergence in functional forms of ZBL screened potential Peter Chu
03:06 [lammps-users] ERROR: Illegal fix deposit command Digvijay Yadav
01:43 [lammps-users] accepted force field deviation Hossein Geraili
01:27 [lammps-users] accepted force field deviation Hossein Geraili

September 20, 2017
23:53 Re: [lammps-users] ERROR: Invalid fix style R. Varsha
19:22 Re: [lammps-users] Some questions Axel Kohlmeyer
14:33 Re: [lammps-users] Using pair style hybrid with GPU Axel Kohlmeyer
14:31 [lammps-users] Some questions A. M.M
14:13 Re: [lammps-users] Using pair style hybrid with GPU Xiaoyu Wang
13:15 Re: [lammps-users] Using pair style hybrid with GPU Axel Kohlmeyer
13:06 Re: [lammps-users] Using pair style hybrid with GPU Xiaoyu Wang
12:53 Re: [lammps-users] Using pair style hybrid with GPU Axel Kohlmeyer
12:44 [lammps-users] Using pair style hybrid with GPU Xiaoyu Wang
09:57 Re: [lammps-users] ERROR: Invalid fix style Axel Kohlmeyer
09:43 Re: [lammps-users] ERROR: Invalid fix style Stefan Paquay
09:42 Re: [lammps-users] ERROR: Invalid fix style Stefan Paquay
09:36 [lammps-users] ERROR: Invalid fix style R. Varsha
08:02 Re: [lammps-users] periodic molecule COM moving with fix momentum Axel Kohlmeyer
07:48 Re: [lammps-users] Compilation error Axel Kohlmeyer
03:27 [lammps-users] periodic molecule COM moving with fix momentum Ali Shomali

September 19, 2017
20:15 [lammps-users] Compilation error Kim, Changjae
15:45 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
14:32 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Axel Kohlmeyer
13:40 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Jo
13:01 Re: [lammps-users] MD simulations in hexagon prism unit cell Andrew Jewett
12:47 Re: [lammps-users] coul/long Jo
12:40 Re: [lammps-users] SPC/e water model Andrew Jewett
12:20 [lammps-users] coul/long Jo
12:08 Re: [lammps-users] Fwd: Creating a bond list within a pair style Axel Kohlmeyer
11:26 [lammps-users] Fwd: Creating a bond list within a pair style Matthew Wander
11:22 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
11:19 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
11:08 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
08:52 Re: [lammps-users] Bug of Voronoi package for large number of atoms? Steve Plimpton
08:48 Re: [lammps-users] Creating a bond list within a pair style Steve Plimpton
08:47 Re: [lammps-users] Keeping a particular region empty during run Rajesh
08:47 Re: [lammps-users] fix deposition Steve Plimpton
08:46 Re: [lammps-users] Keeping a particular region empty during run Rajesh
08:46 Re: [lammps-users] Keeping a particular region empty during run Axel Kohlmeyer
08:45 Re: [lammps-users] error when running python script to call lammps Steve Plimpton
08:44 Re: [lammps-users] Keeping a particular region empty during run Steve Plimpton
08:42 Re: [lammps-users] Axilrod-Teller Potential Steve Plimpton
08:11 Re: [lammps-users] converting pdb to lammps data file Neda Rafiee
08:07 [lammps-users] Bug of Voronoi package for large number of atoms? Christophe Ortiz
07:20 Re: [lammps-users] MD simulations in hexagon prism unit cell Axel Kohlmeyer
07:06 [lammps-users] Creating a bond list within a pair style Matthew Wander
05:45 Re: [lammps-users] Change pair style Rajesh
05:41 Re: [lammps-users] Change pair style Ray Shan
03:52 [lammps-users] fix deposition Digvijay Yadav
03:38 Re: [lammps-users] Computer Difference Emir Kocer
03:37 Re: [lammps-users] SPC/e water model R. Varsha
02:34 Re: [lammps-users] SPC/e water model R. Varsha

September 18, 2017
23:38 [lammps-users] error when running python script to call lammps Shenli Zhang
22:42 [lammps-users] Keeping a particular region empty during run Rajesh
22:08 Re: [lammps-users] MD simulations in hexagon prism unit cell surendra jain
18:53 Re: [lammps-users] converting pdb to lammps data file Andrew Jewett
17:28 Re: [lammps-users] SPC/e water model Andrew Jewett
16:44 Re: [lammps-users] MD simulations in hexagon prism unit cell Andrew Jewett
16:11 Re: [lammps-users] Fix viscous and dynamic groups Axel Kohlmeyer
11:55 [lammps-users] Fix viscous and dynamic groups Michal Kanski
11:42 Re: [lammps-users] eam and eam/alloys with GPU Axel Kohlmeyer
11:32 [lammps-users] Axilrod-Teller Potential Shane Jackson
10:36 Re: [lammps-users] Change pair style Rajesh
10:35 Re: [lammps-users] Change pair style James Kress
09:45 Re: [lammps-users] Change pair style Rajesh
09:44 Re: [lammps-users] [EXTERNAL] Re: Shear Deformation: Monomers and Simulation Box Deforming Out of Sync Wood, Mitchell
09:39 Re: [lammps-users] Change pair style James Kress
09:28 Re: [lammps-users] Change pair style Rajesh
09:04 Re: [lammps-users] about TAD and deposition Steve Plimpton
09:01 Re: [lammps-users] negative vapor pressure Steve Plimpton
08:56 Re: [lammps-users] Change pair style Steve Plimpton
08:54 Re: [lammps-users] Shear Deformation: Monomers and Simulation Box Deforming Out of Sync Steve Plimpton
08:40 [lammps-users] eam and eam/alloys with GPU Roman M. Gerasimov
08:34 Re: [lammps-users] Conversion of charmm format to xplor format. Axel Kohlmeyer
07:27 Re: [lammps-users] Conversion of charmm format to xplor format. R. Varsha
07:17 Re: [lammps-users] Makefile.stampede Jan Fikar
06:44 Re: [lammps-users] Conversion of charmm format to xplor format. Axel Kohlmeyer
05:55 Re: [lammps-users] converting pdb to lammps data file Axel Kohlmeyer
05:47 Re: [lammps-users] converting pdb to lammps data file Axel Kohlmeyer
05:34 Re: [lammps-users] converting pdb to lammps data file Neda Rafiee
05:23 Re: [lammps-users] converting pdb to lammps data file R. Varsha
05:19 Re: [lammps-users] converting pdb to lammps data file Axel Kohlmeyer
04:50 Re: [lammps-users] converting pdb to lammps data file R. Varsha
01:12 Re: [lammps-users] SPC/e water model R. Varsha
00:52 [lammps-users] converting pdb to lammps data file Neda Rafiee
00:34 Re: [lammps-users] Conversion of charmm format to xplor format. R. Varsha

September 17, 2017
22:48 Re: [lammps-users] Error in ReaxFF simulations Ray Shan
22:34 Re: [lammps-users] Error in ReaxFF simulations Ray Shan
22:01 [lammps-users] Error in ReaxFF simulations Rajesh
04:18 Re: [lammps-users] MD simulations in hexagon prism unit cell surendra jain
01:01 [lammps-users] Converting pdb to lammps data file Neda Rafiee
00:47 [lammps-users] Change pair style Rajesh

September 16, 2017
09:51 Re: [lammps-users] MD simulations in hexagon prism unit cell surendra jain
08:39 Re: [lammps-users] How does Lammps calculate Property/atom fx fy fz of an atom using ReaxFF Anubhav Roy
08:09 Re: [lammps-users] Request to add question to the forum (can not get high enough sp3 atoms while preparing amorphous carbon) Axel Kohlmeyer
08:03 Re: [lammps-users] Minimisation criteria Axel Kohlmeyer
08:02 Re: [lammps-users] fix deposition Axel Kohlmeyer
07:55 Re: [lammps-users] Regarding two Tersoff potentials Axel Kohlmeyer
07:34 Re: [lammps-users] How does Lammps calculate Property/atom fx fy fz of an atom using ReaxFF Axel Kohlmeyer
07:23 Re: [lammps-users] change_box delta command Axel Kohlmeyer
06:23 [lammps-users] Minimisation criteria Digvijay Yadav
05:30 [lammps-users] fix deposition Digvijay Yadav
02:20 [lammps-users] Regarding two Tersoff potentials Sharma MD

September 15, 2017
23:44 [lammps-users] How does Lammps calculate Property/atom fx fy fz of an atom using ReaxFF Anubhav Roy
21:23 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
20:25 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
19:10 [lammps-users] Shear Deformation: Monomers and Simulation Box Deforming Out of Sync MASATO KOIZUMI
16:24 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
15:21 [lammps-users] change_box delta command JAGROOP KAUR
13:34 Re: [lammps-users] Conversion of charmm format to xplor format. Giacomo Fiorin
13:07 Re: [lammps-users] Alternative for vacuum boundary conditions Axel Kohlmeyer
12:56 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
12:29 [lammps-users] Alternative for vacuum boundary conditions José Cobeña
11:48 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
07:33 Re: [lammps-users] Deposition Script Steve Plimpton
03:25 [lammps-users] Deposition Script Digvijay Yadav
01:08 [lammps-users] generating random polymers in Moltemplate with obstacles Andrew Jewett

September 14, 2017
23:46 Re: [lammps-users] Conversion of charmm format to xplor format. R. Varsha
21:24 Re: [lammps-users] SPC/e water model Andrew Jewett
16:34 [lammps-users] Request to add question to the forum (can not get high enough sp3 atoms while preparing amorphous carbon) Shahriar Mufid
08:38 Re: [lammps-users] Computer Difference Axel Kohlmeyer
08:36 Re: [lammps-users] Conversion of charmm format to xplor format. Giacomo Fiorin
08:33 Re: [lammps-users] Computer Difference Steve Plimpton
08:32 [lammps-users] Fwd: Please forward to lammps mailing list Steve Plimpton
08:06 Re: [lammps-users] Conversion of charmm format to xplor format. Stefan Paquay
07:36 Re: [lammps-users] Accessing periodic image of atoms in my own fix Axel Kohlmeyer
07:27 Re: [lammps-users] Accessing periodic image of atoms in my own fix Frank Zack
07:23 Re: [lammps-users] Computer Difference Axel Kohlmeyer
06:52 Re: [lammps-users] Accessing periodic image of atoms in my own fix Frank Zack
06:40 Re: [lammps-users] Accessing periodic image of atoms in my own fix Axel Kohlmeyer
06:40 Re: [lammps-users] Computer Difference Emir Koçer
06:33 Re: [lammps-users] Computer Difference Wes Barnett
06:25 [lammps-users] Accessing periodic image of atoms in my own fix Frank Zack
05:49 Re: [lammps-users] Computer Difference Emir Koçer
05:35 Re: [lammps-users] Computer Difference Giacomo Fiorin
05:18 [lammps-users] Conversion of charmm format to xplor format. R. Varsha
00:58 Re: [lammps-users] Error running ReaxFF Simulation Michał Kański
00:24 Re: [lammps-users] SPC/e water model R. Varsha

September 13, 2017
23:22 [lammps-users] Error running ReaxFF Simulation Rajesh
21:14 Re: [lammps-users] Makefile.stampede Brown, Michael W
21:07 Re: [lammps-users] [Non-DoD Source] Re: Trying to compile on Cray XC40 Brown, Michael W
19:41 Re: [lammps-users] Syntax error by extra/bond/per/atom in read_data command Axel Kohlmeyer
17:49 Re: [lammps-users] Syntax error by extra/bond/per/atom in read_data command Hyungmook Kang
16:37 Re: [lammps-users] Syntax error by extra/bond/per/atom in read_data command Axel Kohlmeyer
16:09 [lammps-users] Syntax error by extra/bond/per/atom in read_data command Hyungmook Kang
13:50 Re: [lammps-users] How to decide the number of atoms in each bins forthe 1d bin style Steve Plimpton
13:48 Re: [lammps-users] SPC/e water model Steve Plimpton
13:41 Re: [lammps-users] ATC Cu_ttm.mat file problem Steve Plimpton
12:30 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Axel Kohlmeyer
12:19 Re: [lammps-users] Airebo potential Ray Shan
11:49 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Jo
10:41 Re: [lammps-users] Temperature suddendly drop down to zero Axel Kohlmeyer
10:12 Re: [lammps-users] LAMMPS review Axel Kohlmeyer
09:26 Re: [lammps-users] lj parameters Stefan Paquay
08:02 Re: [lammps-users] lj parameters Hossein Geraili
07:26 Re: [lammps-users] Reaxff simulation James Kress
06:48 [lammps-users] LAMMPS review Jonathan Severin
05:30 Re: [lammps-users] Reaxff simulation Smith, Micholas D.
05:07 [lammps-users] ?????? How to decide the number of atoms in each bins forthe 1d bin style 1185201182
02:27 Re: [lammps-users] SPC/e water model Andrew Jewett
00:57 [lammps-users] SPC/e water model R. Varsha
00:45 [lammps-users] Reaxff simulation Praveen Kumar
00:20 [lammps-users] Airebo potential elene shopova
00:18 [lammps-users] Temperature suddendly drop down to zero kia krn

September 12, 2017
23:18 [lammps-users] Green kubo thermal conductivity ZEESHAN AHMED
14:27 Re: [lammps-users] Computer Difference Giacomo Fiorin
12:06 [lammps-users] lj parameters Hossein Geraili
11:43 Re: [lammps-users] [Non-DoD Source] Re: Trying to compile on Cray XC40 Axel Kohlmeyer
11:24 Re: [lammps-users] [Non-DoD Source] Re: Trying to compile on Cray XC40 Downs, Andrew S CTR USARMY ARL (US)
10:41 [lammps-users] Computer Difference Emir Koçer
10:09 Re: [lammps-users] Trying to compile on Cray XC40 Axel Kohlmeyer
09:17 Re: [lammps-users] [EXTERNAL] Re: How hybrid/overlay works, especifically in case of AIREBO and TERSOFF Nasiri, Samaneh
09:17 Re: [lammps-users] [EXTERNAL] Re: how to output an average of compute gyration/chunk Frischknecht, Amalie L
09:09 [lammps-users] Trying to compile on Cray XC40 Downs, Andrew S CTR USARMY ARL (US)
09:02 Re: [lammps-users] [EXTERNAL] Re: how to output an average of compute gyration/chunk Axel Kohlmeyer
09:02 Re: [lammps-users] ATC Cu_ttm.mat file problem Sikang Luan
08:53 Re: [lammps-users] [EXTERNAL] Re: how to output an average of compute gyration/chunk Frischknecht, Amalie L
08:50 Re: [lammps-users] [EXTERNAL] Re: How hybrid/overlay works, especifically in case of AIREBO and TERSOFF Thompson, Aidan
08:32 Re: [lammps-users] Confused by pressure calculation Steve Plimpton
08:30 Re: [lammps-users] How to decide the number of atoms in each bins for the 1d bin style Steve Plimpton
08:27 Re: [lammps-users] How hybrid/overlay works, especifically in case of AIREBO and TERSOFF Steve Plimpton
08:26 Re: [lammps-users] ATC Cu_ttm.mat file problem Steve Plimpton
08:22 Re: [lammps-users] Moving all atoms out of defined region Steve Plimpton
08:21 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Steve Plimpton
08:15 Re: [lammps-users] Carbon-Carbon Long range inteaction using Lj potential Steve Plimpton
06:42 [lammps-users] Confused by pressure calculation Matthew Wander
05:05 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Axel Kohlmeyer

September 11, 2017
23:12 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Andrew Jewett
21:26 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Axel Kohlmeyer
21:00 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Andrew Jewett
13:55 [lammps-users] How to decide the number of atoms in each bins for the 1d bin style 1185201182
12:47 Re: [lammps-users] How to deal with the migration of the alumina atoms ? Axel Kohlmeyer
12:32 Re: [lammps-users] Problem with a simulation Axel Kohlmeyer
10:00 Re: [lammps-users] How hybrid/overlay works, especifically in case of AIREBO and TERSOFF Nasiri, Samaneh
09:07 [lammps-users] How hybrid/overlay works, especifically in case of AIREBO and TERSOFF Nasiri, Samaneh
08:10 [lammps-users] How to deal with the migration of the alumina atoms ? Shuting Wang
00:13 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Imanuel Kristanto

September 10, 2017
19:45 Re: [lammps-users] Irrelevant Discussion when clicking on a Google Search result Stephan Grein
15:25 Re: [lammps-users] Problem with a simulation A. M.M
14:50 Re: [lammps-users] Problem with a simulation Axel Kohlmeyer
10:16 [lammps-users] Irrelevant Discussion when clicking on a Google Search result Emir Koçer
10:06 Re: [lammps-users] Problem with a simulation Axel Kohlmeyer
05:44 [lammps-users] Problem with a simulation A. M.M

September 09, 2017
15:01 [lammps-users] ATC Cu_ttm.mat file problem Sikang Luan
06:29 Re: [lammps-users] General questions Axel Kohlmeyer
06:02 [lammps-users] General questions A. M.M
01:31 Re: [lammps-users] Makefile.stampede Jan Fikar
00:30 [lammps-users] Makefile.stampede Qiang Zhu

September 08, 2017
21:58 Re: [lammps-users] directly set atom coordinates within python script Axel Kohlmeyer
17:04 [lammps-users] directly set atom coordinates within python script Shenli Zhang
10:04 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Axel Kohlmeyer
09:59 Re: [lammps-users] Indirect Umbrella Sampling INDUS and pressure control fix npt Axel Kohlmeyer
09:47 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Jo
08:46 [lammps-users] Indirect Umbrella Sampling INDUS and pressure control fix npt Romain bey
04:27 Re: [lammps-users] strain effect on primary radiation damage Julien Guénolé
04:01 [lammps-users] strain effect on primary radiation damage kia krn

September 07, 2017
21:34 [lammps-users] Moving all atoms out of defined region Rajesh
13:28 Re: [lammps-users] neb command application Giacomo Fiorin
11:55 Re: [lammps-users] Problem with log command : Binary log file instead of ASCII Axel Kohlmeyer
11:17 Re: [lammps-users] Problem with log command : Binary log file instead of ASCII Stefan Paquay
10:59 [lammps-users] Jumping into an irrelevant discussion in LAMMPS Mailing List when clicking a search result Emir Koçer
10:53 [lammps-users] Problem with log command : Binary log file instead of ASCII Emir Koçer
10:35 Re: [lammps-users] (no subject) Vanessa Oklejas
10:21 Re: [lammps-users] (no subject) Stefan Paquay
10:08 [lammps-users] (no subject) neda Sanchuli
08:55 Re: [lammps-users] Carbon-Carbon Long range inteaction using Lj potential Nasiri, Samaneh
08:43 [lammps-users] neb command application ????????
06:56 Re: [lammps-users] Merging Two structure (pdb or lammps data files) files Rajesh
06:48 Re: [lammps-users] Merging Two structure (pdb or lammps data files) files Stefan Paquay
06:30 Re: [lammps-users] Merging Two structure (pdb or lammps data files) files Rajesh
06:18 Re: [lammps-users] Merging Two structure (pdb or lammps data files) files Stefan Paquay
05:34 [lammps-users] Merging Two structure (pdb or lammps data files) files Rajesh

September 06, 2017
23:41 Re: [lammps-users] error: segmentation fault_reax/c_KOKKOS Mohammad Izadi
23:37 Re: [lammps-users] reaxff error Ray Shan
23:30 [lammps-users] reaxff error Praveen Kumar
19:23 Re: [lammps-users] Moltemplate OPLS-AA improper parameters Andrew Jewett
15:21 Re: [lammps-users] error: segmentation fault_reax/c_KOKKOS Axel Kohlmeyer
14:55 Re: [lammps-users] error: segmentation fault_reax/c_KOKKOS Axel Kohlmeyer
14:41 Re: [lammps-users] Issues with CNT Thermal Conductivity Calculations Santosh Mogurampelly
09:09 Re: [lammps-users] Error running on multiple pprocessors Neda Rafiee
08:57 Re: [lammps-users] using command Stefan Paquay
08:46 Re: [lammps-users] applying shear and tension Steve Plimpton
08:45 Re: [lammps-users] using command Steve Plimpton
08:42 Re: [lammps-users] how to output an average of compute gyration/chunk Steve Plimpton
08:09 Re: [lammps-users] (no subject) sanchari bhatt
07:01 Re: [lammps-users] Is it possible to realize the “soft” body particle in LAMMPS? Wusheng Zhang
06:53 Re: [lammps-users] 'master list distance cutoff' changes strangely after restarting the simulation Axel Kohlmeyer
04:53 [lammps-users] applying shear and tension melika_ bm85
04:22 [lammps-users] 'master list distance cutoff' changes strangely after restarting the simulation Zhuangli cai
02:34 [lammps-users] using command Digvijay Yadav
02:30 Re: [lammps-users] error: segmentation fault_reax/c_KOKKOS Mohammad Izadi
02:27 Re: [lammps-users] [EXTERNAL] Re: error: segmentation fault_reax/c_KOKKOS Mohammad Izadi

September 05, 2017
23:52 Re: [lammps-users] velocity plot from lammps output file Sisir Das
22:13 Re: [lammps-users] velocity plot from lammps output file Sisir Das
19:45 Re: [lammps-users] Is it possible to realize the “soft” body particle in LAMMPS? Axel Kohlmeyer
19:15 [lammps-users] Is it possible to realize the “soft” body particle in LAMMPS? Wusheng Zhang
17:47 [lammps-users] looking for feedback on windows installer packages Axel Kohlmeyer
17:26 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Axel Kohlmeyer
17:09 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Jo
17:06 Re: [lammps-users] [EXTERNAL] Re: Compiling LAMMPS with KOKKOS/CUDA Axel Kohlmeyer
16:17 Re: [lammps-users] [EXTERNAL] Re: Compiling LAMMPS with KOKKOS/CUDA qizhang jia
14:19 Re: [lammps-users] [EXTERNAL] Re: error: segmentation fault_reax/c_KOKKOS Moore, Stan
14:18 Re: [lammps-users] [EXTERNAL] Re: Compiling with Kokkos for KNL processors with Intel Compilers Moore, Stan
14:15 Re: [lammps-users] error: segmentation fault_reax/c_KOKKOS Axel Kohlmeyer
14:14 Re: [lammps-users] Lammps potential Axel Kohlmeyer
14:07 Re: [lammps-users] [EXTERNAL] Re: Compiling LAMMPS with KOKKOS/CUDA Axel Kohlmeyer
14:01 Re: [lammps-users] [EXTERNAL] Re: Compiling LAMMPS with KOKKOS/CUDA Moore, Stan
13:59 Re: [lammps-users] [EXTERNAL] Re: Fast Multipole Method (FMM) - does it exist and if not, why not Moore, Stan
13:35 Re: [lammps-users] Fast Multipole Method (FMM) - does it exist and if not, why not Axel Kohlmeyer
13:24 Re: [lammps-users] dpd-SSA example Axel Kohlmeyer
13:21 Re: [lammps-users] Compiling LAMMPS with KOKKOS/CUDA Axel Kohlmeyer
11:59 [lammps-users] Compiling LAMMPS with KOKKOS/CUDA qizhang jia
11:48 Re: [lammps-users] Doubt wrt pair style lj/cut/coul/dsf Axel Kohlmeyer
11:31 Re: [lammps-users] velocity plot from lammps output file Vanessa Oklejas
11:30 Re: [lammps-users] fix heat for thermal conductivity Steve Plimpton
11:23 Re: [lammps-users] Compiling with Kokkos for KNL processors with Intel Compilers Steve Plimpton
11:00 [lammps-users] velocity plot from lammps output file Sisir Das
10:58 [lammps-users] Doubt wrt pair style lj/cut/coul/dsf Ana Silveira
10:43 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
08:56 [lammps-users] Compiling with Kokkos for KNL processors with Intel Compilers Dundar Yilmaz
08:47 Re: [lammps-users] How to reach to a desired( or properly equilibrated) pressure in NVT ensemble in LAMMPS? Axel Kohlmeyer
07:50 Re: [lammps-users] How to reach to a desired( or properly equilibrated) pressure in NVT ensemble in LAMMPS? Stefan Paquay
07:39 Re: [lammps-users] (no subject) Stefan Paquay
06:18 [lammps-users] dpd-SSA example Nitish Singh
04:26 Re: [lammps-users] Error running on multiple pprocessors Axel Kohlmeyer
04:17 Re: [lammps-users] Error running on multiple pprocessors Axel Kohlmeyer
03:23 Re: [lammps-users] pair style table for Coulombic and dispersion pair interactions Michał Kański
02:29 [lammps-users] Error running on multiple pprocessors Neda Rafiee
00:31 Re: [lammps-users] Error running on multiple pprocessors Neda Rafiee

September 04, 2017
21:21 [lammps-users] Fast Multipole Method (FMM) - does it exist and if not, why not Peter Spalthoff
21:07 [lammps-users] pair style table for Coulombic and dispersion pair interactions Jo
16:12 Re: [lammps-users] improper_coeff Vanessa Oklejas
15:53 Re: [lammps-users] MD simulations in hexagon prism unit cell Andrew Jewett
10:08 [lammps-users] Lammps potential fateme momeni
10:01 [lammps-users] MD simulations in hexagon prism unit cell surendra jain
09:58 [lammps-users] MD simu surendra jain
09:49 [lammps-users] error: segmentation fault_reax/c_KOKKOS Mohammad Izadi
09:48 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
09:43 Re: [lammps-users] Peridynamic bonds Axel Kohlmeyer
09:37 Re: [lammps-users] reading initial configuration and simulation box boundaries Axel Kohlmeyer
08:27 Re: [lammps-users] limit the atoms in one direction Michał Kański
08:26 [lammps-users] Peridynamic bonds Sebastian Echeverri
07:36 [lammps-users] limit the atoms in one direction Zheng, Xuechen
05:13 [lammps-users] reading initial configuration and simulation box boundaries Carol Baruffi
04:58 Re: [lammps-users] About SIA (or defect) insertion, how to fix the symmetry Jan Fikar
04:36 [lammps-users] About SIA (or defect) insertion, how to fix the symmetry Bom Salman
03:07 [lammps-users] How to reach to a desired( or properly equilibrated) pressure in NVT ensemble in LAMMPS? geraili_hosein

September 03, 2017
23:27 [lammps-users] improper_coeff Hossein Geraili
21:39 [lammps-users] pressure equilibrium Hossein Geraili
20:46 [lammps-users] fix heat for thermal conductivity ??????
13:42 Re: [lammps-users] pressure fluctuation Hossein Geraili
12:11 Re: [lammps-users] ERROR: Fix ave/time compute does not calculate a vector (../fix_ave_time.cpp:168) Navdeep Singh
11:22 Re: [lammps-users] Simulation of monoclinic crystal Navdeep Singh
10:48 Re: [lammps-users] pressure fluctuation Hossein Geraili
10:41 [lammps-users] pressure fluctuation Hossein Geraili
03:38 [lammps-users] ERROR: Fix ave/time compute does not calculate a vector (../fix_ave_time.cpp:168) Mostafa Valadkhani

September 02, 2017
23:16 [lammps-users] Moltemplate OPLS-AA improper parameters Andrew Jewett
23:04 [lammps-users] (no subject) sanchari bhatt
08:35 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
08:17 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
07:56 Re: [lammps-users] Error running on multiple pprocessors Axel Kohlmeyer
03:03 Re: [lammps-users] custom fix and pairstyle give error when called from python Victor Koppejan - TNW
02:26 [lammps-users] Error running on multiple pprocessors Neda Rafiee

September 01, 2017
17:44 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
17:36 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
17:14 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
16:44 Re: [lammps-users] how to output an average of compute gyration/chunk Axel Kohlmeyer
16:26 [lammps-users] how to output an average of compute gyration/chunk Frischknecht, Amalie L
16:20 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
15:38 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
12:32 Re: [lammps-users] custom fix and pairstyle give error when called from python Stefan Paquay
08:42 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Axel Kohlmeyer
08:40 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Tingyu Lu
08:40 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Axel Kohlmeyer
08:36 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Tingyu Lu
07:46 Re: [lammps-users] Shear Deformation using Fix Deform Command Axel Kohlmeyer
07:43 Re: [lammps-users] quenching procedure Axel Kohlmeyer
07:40 Re: [lammps-users] Nanoindentation Axel Kohlmeyer
07:37 Re: [lammps-users] Shell command Axel Kohlmeyer
05:47 [lammps-users] Nanoindentation Jit Sarkar
05:02 [lammps-users] Shell command Neda Rafiee
04:31 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Axel Kohlmeyer
02:11 Re: [lammps-users] custom fix and pairstyle give error when called from python Victor Koppejan - TNW
01:18 [lammps-users] quenching procedure Notan Tah

August 31, 2017
23:43 [lammps-users] Shear Deformation using Fix Deform Command MASATO KOIZUMI
22:08 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Tingyu Lu
19:46 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Axel Kohlmeyer
18:38 Re: [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Axel Kohlmeyer
18:36 Re: [lammps-users] Evaluating bond force using atom_style charge and pair_style reax/c Axel Kohlmeyer
17:58 [lammps-users] Evaluating bond force using atom_style charge and pair_style reax/c Anubhav Roy
17:34 [lammps-users] Fwd: Got "segmentation fault" error when using pari_style quip with gap potential file Tingyu Lu
16:14 [lammps-users] Simulation of monoclinic crystal Baig abdullah Al muhit
14:44 Re: [lammps-users] more undefined references to 'fftw_*" and ld returned 1 exit status when doing "make mpi" in /src Axel Kohlmeyer
14:43 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
14:37 [lammps-users] more undefined references to 'fftw_*" and ld returned 1 exit status when doing "make mpi" in /src Tingyu Lu
14:34 Re: [lammps-users] Non-numeric pressure - simulation unstable Axel Kohlmeyer
14:08 [lammps-users] more undefined references to 'fftw_*" and ld returned 1 exit status when doing "make mpi" in /src Tingyu Lu
11:29 Re: [lammps-users] Fwd: Temperature and Energy increases with langevin thermostat Axel Kohlmeyer
11:10 Re: [lammps-users] custom fix and pairstyle give error when called from python Axel Kohlmeyer
10:30 [lammps-users] Fwd: Temperature and Energy increases with langevin thermostat surendra jain
10:00 [lammps-users] custom fix and pairstyle give error when called from python Victor Koppejan - TNW
08:59 [lammps-users] Non-numeric pressure - simulation unstable Jian-Hui Zhai
08:46 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
08:42 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
08:28 Re: [lammps-users] LAMMPS library: Gather specific atoms and insert small molecules Stephan Grein
05:22 [lammps-users] fix heat for thermal conductivity ??????
01:49 [lammps-users] fix heat for thermal conductivity ??????
00:05 Re: [lammps-users] Issues with CNT Thermal Conductivity Calculations Santosh Mogurampelly

August 30, 2017
16:59 Re: [lammps-users] restart file Axel Kohlmeyer
16:57 Re: [lammps-users] restart file Axel Kohlmeyer
16:45 Re: [lammps-users] restart file Vanessa Oklejas
16:38 Re: [lammps-users] Tabulated potential and long range interaction Axel Kohlmeyer
14:59 Re: [lammps-users] Tabulated potential and long range interaction Meral Sharkas
14:54 Re: [lammps-users] Tabulated potential and long range interaction Axel Kohlmeyer
14:47 [lammps-users] Tabulated potential and long range interaction Meral Sharkas
14:34 Re: [lammps-users] Got "segmentation fault" error when using pari_style quip with gap potential file Axel Kohlmeyer
14:26 Re: [lammps-users] Issues with CNT Thermal Conductivity Calculations Daksha, Chaitanya Mrityunjay
14:21 [lammps-users] Got "segmentation fault" error when using pari_style quip with gap potential file Tingyu Lu
12:47 Re: [lammps-users] Expected floating point parameter in input script or data file Quang Ha
12:39 [lammps-users] Compiling with Kokkos for KNL processors with Intel Compilers Dundar Yilmaz
12:29 [lammps-users] restart file Ana Cristina Ramírez
12:28 Re: [lammps-users] Expected floating point parameter in input script or data file Stefan Paquay
12:23 Re: [lammps-users] Expected floating point parameter in input script or data file Quang Ha
12:14 Re: [lammps-users] crystal vibrates widely in NVT and NPT Stefan Paquay
12:04 [lammps-users] crystal vibrates widely in NVT and NPT ruiyan
11:54 Re: [lammps-users] NaN when using Qeq package Xiaoyu Wang
11:39 Re: [lammps-users] Conducting creep test in LAMMPS Axel Kohlmeyer
11:38 Re: [lammps-users] Temperature and Energy increases with langevin thermostat Axel Kohlmeyer
11:31 Re: [lammps-users] Expected floating point parameter in input script or data file Axel Kohlmeyer
11:30 Re: [lammps-users] NaN when using Qeq package Axel Kohlmeyer
11:29 Re: [lammps-users] Expected floating point parameter in input script or data file Michał Kański
11:10 [lammps-users] Conducting creep test in LAMMPS ehsan shahini
11:05 Re: [lammps-users] NaN when using Qeq package Xiaoyu Wang
10:55 [lammps-users] Expected floating point parameter in input script or data file Quang Ha
08:56 Re: [lammps-users] Segmentation fault when using Kolmogorov/Crespi/z with REBO Srilok Srinivasan
08:43 Re: [lammps-users] sputtering process tara.majdi
08:33 Re: [lammps-users] sputtering process Julien Guénolé
08:13 Re: [lammps-users] crystal vibrates widely in NVT and NPT Stefan Paquay
07:24 Re: [lammps-users] High pressure fluctuations with ReaxFF Chowdhury, Sanjib Chandra
07:12 [lammps-users] sputtering process Digvijay Yadav
06:49 [lammps-users] High pressure fluctuations with ReaxFF Rajesh
04:14 Re: [lammps-users] 回复: The difference between compute pressure andcompute stress/atom Julien Guénolé
03:34 [lammps-users] crystal vibrates widely in NVT and NPT ruiyan

August 29, 2017
23:27 Re: [lammps-users] Is there any built-in method to apply "tensile test" in LAMMPS? Michał Kański
23:12 Re: [lammps-users] Temperature and Energy increases with langevin thermostat surendra jain
22:36 Re: [lammps-users] Calculating free energy difference on clustered atoms Imanuel Kristanto
22:02 [lammps-users] Is there any built-in method to apply "tensile test" in LAMMPS? Wusheng Zhang
20:33 Re: [lammps-users] Segmentation fault when using Kolmogorov/Crespi/z with REBO Axel Kohlmeyer
19:32 Re: [lammps-users] Pressure / Virial calculation Xiao Jia
18:56 Re: [lammps-users] Pressure / Virial calculation Axel Kohlmeyer
17:11 Re: [lammps-users] Pressure / Virial calculation Xiao Jia
16:59 Re: [lammps-users] Segmentation fault when using Kolmogorov/Crespi/z with REBO Axel Kohlmeyer
16:45 Re: [lammps-users] NaN when using Qeq package Axel Kohlmeyer
16:43 Re: [lammps-users] NaN when using Qeq package Xiaoyu Wang
16:33 Re: [lammps-users] NaN when using Qeq package Axel Kohlmeyer
16:31 Re: [lammps-users] Pressure / Virial calculation Axel Kohlmeyer
16:27 Re: [lammps-users] NaN when using Qeq package Ray Shan
16:14 [lammps-users] NaN when using Qeq package Xiaoyu Wang
15:53 [lammps-users] Pressure / Virial calculation Xiao Jia
14:46 [lammps-users] Segmentation fault when using Kolmogorov/Crespi/z with REBO Srilok Srinivasan
14:39 Re: [lammps-users] Issues with CNT Thermal Conductivity Calculations Santosh Mogurampelly
13:06 [lammps-users] Issues with CNT Thermal Conductivity Calculations Daksha, Chaitanya Mrityunjay
11:40 Re: [lammps-users] LAMMPS run in Stampede 2 HUILIN YE
11:33 Re: [lammps-users] LAMMPS run in Stampede 2 Axel Kohlmeyer
11:32 Re: [lammps-users] [lammps users] modeling polymer compression with a film of Titania Axel Kohlmeyer
10:05 [lammps-users] LAMMPS run in Stampede 2 HUILIN YE
09:58 [lammps-users] [lammps users] modeling polymer compression with a film of Titania Carmen Rotolo
08:44 Re: [lammps-users] Calculating free energy difference on clustered atoms Axel Kohlmeyer
08:27 [lammps-users] Calculating free energy difference on clustered atoms Imanuel Kristanto
08:14 Re: [lammps-users] About in.langevin in KAPPA folder Axel Kohlmeyer
07:32 [lammps-users] About in.langevin in KAPPA folder Tir McDohl
07:14 Re: [lammps-users] How to make a supercooled liquid by LAMMPS Axel Kohlmeyer
07:10 Re: [lammps-users] Bondary conditions Axel Kohlmeyer
06:03 [lammps-users] Bondary conditions Digvijay Yadav
04:52 [lammps-users] How to make a supercooled liquid by LAMMPS bahman daneshian
03:48 [lammps-users] Pairstyle Thole with buck/coul/long Agilio Padua
02:07 Re: [lammps-users] how to group atoms introduce randomly with create_atoms? Christophe Ortiz

August 28, 2017
23:53 [lammps-users] How to rapid cooling by lammps bahman daneshian
18:38 [lammps-users] 回复: The difference between compute pressure andcompute stress/atom 709832702
17:45 Re: [lammps-users] The difference between compute pressure andcompute stress/atom Axel Kohlmeyer
17:21 [lammps-users] 回复: The difference between compute pressure andcompute stress/atom 709832702
15:31 [lammps-users] Pairstyle Thole with buck/coul/long Jo
14:02 Re: [lammps-users] fix rigid/npt with triclinic Axel Kohlmeyer
13:50 [lammps-users] CO2 + H2O mixture with thole dampening Jo
13:32 Re: [lammps-users] fix rigid/npt with triclinic Wes Barnett
12:38 Re: [lammps-users] fix rigid/npt with triclinic Axel Kohlmeyer
12:28 Re: [lammps-users] fix rigid/npt with triclinic Wes Barnett
09:42 Re: [lammps-users] use of stdin input for "interactive" lammps runs Ryan S. Elliott
09:38 Re: [lammps-users] use of stdin input for "interactive" lammps runs Axel Kohlmeyer
09:24 [lammps-users] use of stdin input for "interactive" lammps runs Ryan S. Elliott
08:46 [lammps-users] about TAD and deposition Fernanda S Teixeira
08:17 Re: [lammps-users] Finding the heat flux across a vacuum gap between two solids Sen Gupta, Ashim
07:11 Re: [lammps-users] Modelling solids and thermostatting them Axel Kohlmeyer
06:56 [lammps-users] Modelling solids and thermostatting them Tir McDohl
05:47 Re: [lammps-users] Issues with fix rigid in PRD simulation Axel Kohlmeyer
05:46 Re: [lammps-users] how to group atoms introduce randomly with create_atoms? Michał Kański
05:31 Re: [lammps-users] 回复: The difference between compute pressure andcompute stress/atom Axel Kohlmeyer
05:28 Re: [lammps-users] The difference between compute pressure andcompute stress/atom Axel Kohlmeyer
05:25 Re: [lammps-users] Stretch just from one side! Axel Kohlmeyer
04:26 [lammps-users] how to group atoms introduce randomly with create_atoms? Christophe Ortiz
03:46 Re: [lammps-users] Accelerating ReaxFF simulations Michał Kański
02:17 Re: [lammps-users] 回复: The difference between compute pressure andcompute stress/atom Julien Guénolé
01:38 [lammps-users] Stretch just from one side! Asadollahzadeh

August 27, 2017
23:49 Re: [lammps-users] Accelerating ReaxFF simulations Rajesh
22:49 [lammps-users] 回复: The difference between compute pressure andcompute stress/atom 709832702
22:14 Re: [lammps-users] fix rigid/npt with triclinic Trung Nguyen
16:33 Re: [lammps-users] Issues with fix rigid in PRD simulation Mohammad Rasool Vazirisereshk
14:34 Re: [lammps-users] fix rigid/npt with triclinic Axel Kohlmeyer
14:18 Re: [lammps-users] The difference between compute pressure and compute stress/atom Axel Kohlmeyer
14:09 Re: [lammps-users] Pressure equilibration Axel Kohlmeyer
14:00 Re: [lammps-users] Temperature and Energy increases with langevin thermostat Axel Kohlmeyer
13:50 Re: [lammps-users] lost atom error Axel Kohlmeyer
07:40 Re: [lammps-users] lost atom error Nader Ameli
06:28 [lammps-users] lost atom error SHABNAM GHAHREMANIAN
05:21 [lammps-users] Pressure equilibration Meral Sharkas
04:53 Re: [lammps-users] Quenching in a confined volume Fabian Duarte
04:36 [lammps-users] Temperature and Energy increases with langevin thermostat surendra jain
03:23 Re: [lammps-users] Accelerating ReaxFF simulations Giacomo Fiorin
00:21 [lammps-users] Accelerating ReaxFF simulations Rajesh

August 26, 2017
23:10 Re: [lammps-users] pcff force field Rajesh
23:02 Re: [lammps-users] experiment on fix efield along with reax/c Mohammad Izadi
22:43 Re: [lammps-users] experiment on fix efield along with reax/c Mohammad Izadi
21:41 [lammps-users] The difference between compute pressure and compute stress/atom 709832702
14:06 Re: [lammps-users] experiment on fix efield along with reax/c Axel Kohlmeyer
13:38 Re: [lammps-users] About Truncated Octahedral Simulation Box Axel Kohlmeyer
13:02 Re: [lammps-users] experiment on fix efield along with reax/c Ray Shan
12:09 [lammps-users] experiment on fix efield along with reax/c Mohammad Izadi
11:56 [lammps-users] About Truncated Octahedral Simulation Box Au3
11:38 Re: [lammps-users] Quenching in a confined volume Axel Kohlmeyer
10:19 [lammps-users] Quenching in a confined volume Fabian Duarte
09:36 Re: [lammps-users] Issues with fix rigid in PRD simulation Axel Kohlmeyer
09:19 Re: [lammps-users] Vashishta potentials Axel Kohlmeyer
09:05 Re: [lammps-users] (no subject) Axel Kohlmeyer
08:54 Re: [lammps-users] (no subject) Axel Kohlmeyer

August 25, 2017
23:38 [lammps-users] (no subject) sanchari bhatt
17:09 [lammps-users] Vashishta potentials Jaeyun Moon
16:43 [lammps-users] Issues with fix rigid in PRD simulation Mohammad Rasool Vazirisereshk
15:25 Re: [lammps-users] lj to real unit conversion of distance ! Axel Kohlmeyer
14:52 [lammps-users] lj to real unit conversion of distance ! Mohammad Tuhin
13:29 Re: [lammps-users] About problem using fix ave/chunk with fix srd Steve Plimpton
12:54 Re: [lammps-users] Restraining a water molecule on interface during simulation Giacomo Fiorin
12:49 Re: [lammps-users] Stress & strain value Mohammad Rafat Sadat
11:56 Re: [lammps-users] Angular velocity for calculation of rotational density of state function Axel Kohlmeyer
11:53 [lammps-users] Issues with fix rigid in PRD simulation Mohammad Rasool Vazirisereshk
10:35 [lammps-users] Restraining a water molecule on interface during simulation Deepak Ojha
10:22 [lammps-users] Angular velocity for calculation of rotational density of state function Arif Abdullah Rokoni
09:09 Re: [lammps-users] Rigid bodies will slightly deform if a barostat is used ZhaoChuan Fan
07:25 Re: [lammps-users] Rigid bodies will slightly deform if a barostat is used Axel Kohlmeyer
01:42 Re: [lammps-users] (no subject) sanchari bhatt
00:53 [lammps-users] Stress & strain value Asadollahzadeh

August 24, 2017
23:23 [lammps-users] Rigid bodies will slightly deform if a barostat is used ZhaoChuan Fan
16:09 [lammps-users] Postdoc Opening at Idaho National Laboratory Yidong Xia
15:58 [lammps-users] Postdoc Opening at Idaho National Laboratory Yidong Xia
15:23 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Andrew Jewett
15:08 Re: [lammps-users] (no subject) Andrew Jewett
13:34 Re: [lammps-users] Nanocutting Fabian Duarte
13:15 [lammps-users] fix rigid/npt with triclinic Wes Barnett
13:04 Re: [lammps-users] Displacement Perturbations in lammps Eric Murphy
12:51 Re: [lammps-users] Displacement Perturbations in lammps Axel Kohlmeyer
12:50 Re: [lammps-users] Displacement Perturbations in lammps Axel Kohlmeyer
12:21 Re: [lammps-users] Displacement Perturbations in lammps Sonu Kumar
11:44 Re: [lammps-users] Displacement Perturbations in lammps Eric Murphy
11:19 Re: [lammps-users] Displacement Perturbations in lammps Sonu Kumar
11:10 Re: [lammps-users] temp doesnt increase during equilibration Wes Barnett
11:08 Re: [lammps-users] One question for SiC.vashishta ! Thank you ! Ray Shan
10:59 Re: [lammps-users] Computing Shear Strain and stress Baig abdullah Al muhit
10:58 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Rajesh
10:55 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Stefan Paquay
10:40 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Rajesh
09:58 Re: [lammps-users] Displacement Perturbations in lammps Eric Murphy
09:36 Re: [lammps-users] temp doesnt increase during equilibration Stefan Paquay
09:12 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Stefan Paquay
07:55 Re: [lammps-users] how to create 10, 125 atoms in a cube of length 15 without using lattice command. Axel Kohlmeyer
07:31 Re: [lammps-users] how to create 10, 125 atoms in a cube of length 15 without using lattice command. Nitish Singh
07:19 Re: [lammps-users] how to create 10, 125 atoms in a cube of length 15 without using lattice command. Michał Kański
07:17 Re: [lammps-users] Pair_style hybrid Michał Kański
06:25 [lammps-users] how to create 10, 125 atoms in a cube of length 15 without using lattice command. Nitish Singh
05:43 Re: [lammps-users] Nanocutting Axel Kohlmeyer
05:11 Re: [lammps-users] Moltemplate installation R. Varsha
03:53 [lammps-users] temp doesnt increase during equilibration Meral Sharkas
03:43 Re: [lammps-users] Pair_style hybrid Kousika A
01:22 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Rajesh
01:03 [lammps-users] Computing Shear Strain and stress melika_ bm85
00:58 Re: [lammps-users] Nanocutting Fabian Duarte
00:43 Re: [lammps-users] Moltemplate installation Andrew Jewett
00:10 Re: [lammps-users] Moltemplate installation R. Varsha
00:10 Re: [lammps-users] Moltemplate installation Rajesh
00:03 Re: [lammps-users] Moltemplate installation Andrew Jewett

August 23, 2017
22:16 Re: [lammps-users] Displacement Perturbations in lammps Sonu Kumar
21:51 [lammps-users] (no subject) sanchari bhatt
21:23 Re: [lammps-users] pcff force field Vanessa Oklejas
21:19 Re: [lammps-users] Fwd: pcff force field Andrew Jewett
21:08 Re: [lammps-users] pcff force field Rajesh
21:01 [lammps-users] One question for SiC.vashishta ! Thank you ! ??????
20:58 [lammps-users] Fwd: pcff force field Vanessa Oklejas
20:51 Re: [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Andrew Jewett
19:43 [lammps-users] About problem using fix ave/chunk with fix srd dry6211@...24...
19:35 [lammps-users] About problem using fix ave/chunk with fix srd dry6211@...24...
19:29 [lammps-users] Virial was not tallied on needed timestep ..(compute pressure.cpp:223) Rajesh
16:04 Re: [lammps-users] [EXTERNAL] How to realize my purpose in the Reaxff of LAMMPS? Thompson, Aidan
15:54 [lammps-users] negative vapor pressure Brian Morrow
13:38 Re: [lammps-users] Is it possible to realize particles with two, four or six "interaction sites" or "patches"? Steve Plimpton
13:34 Re: [lammps-users] Calculate tail correction for EAM potential Steve Plimpton
13:32 Re: [lammps-users] Displacement Perturbations in lammps Steve Plimpton
13:28 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Steve Plimpton
11:25 Re: [lammps-users] pcff force field Rajesh
10:58 Re: [lammps-users] pcff force field Vanessa Oklejas
10:50 Re: [lammps-users] how to use fene potential for bonds? Wes Barnett
10:48 Re: [lammps-users] pcff force field Rajesh
10:42 Re: [lammps-users] pcff force field Ray Shan
10:37 Re: [lammps-users] pcff force field Rajesh
09:35 Re: [lammps-users] Find bond vector Axel Kohlmeyer
09:33 Re: [lammps-users] pair style hybrid/overlay Axel Kohlmeyer
09:27 [lammps-users] pair style hybrid/overlay surendra jain
09:03 [lammps-users] Find bond vector Kushal Panchal
08:52 Re: [lammps-users] Pair_style hybrid Michał Kański
08:04 Re: [lammps-users] how to use fene potential for bonds? Nicola Molinari
07:35 Re: [lammps-users] Pair_style hybrid Kousika A
07:07 Re: [lammps-users] Pair_style hybrid Michał Kański
07:00 [lammps-users] how to use fene potential for bonds? seyyed mohammad javad mousavi
06:37 [lammps-users] Pair_style hybrid Kousika A
06:17 Re: [lammps-users] pair_style table WARNING Axel Kohlmeyer
05:37 Re: [lammps-users] (no subject) Imanuel Kristanto
05:13 Re: [lammps-users] (no subject) Axel Kohlmeyer
04:28 [lammps-users] Displacement and Velocity Perturbations in lammps Sonu Kumar
03:38 Re: [lammps-users] pair_style table WARNING Michał Kański
01:31 Re: [lammps-users] (no subject) Imanuel Kristanto
01:01 [lammps-users] pair_style table WARNING michelle
00:56 [lammps-users] pair_style table WARNING Fu Xueqiong

August 22, 2017
22:47 [lammps-users] (no subject) sanchari bhatt
21:24 Re: [lammps-users] Help with Miyake potential Axel Kohlmeyer
19:45 Re: [lammps-users] LAMMPS questions about using COMB potential combined with EAM potential Ray Shan
19:41 Re: [lammps-users] Export Material Studio Coarse Grain Andrew Jewett
19:37 [lammps-users] Help with Miyake potential sankha mukherjee
19:11 Re: [lammps-users] Export Material Studio Coarse Grain Vanessa Oklejas
19:00 Re: [lammps-users] Export Material Studio Coarse Grain Andrew Jewett
18:06 Re: [lammps-users] Export Material Studio Coarse Grain Vanessa Oklejas
17:58 Re: [lammps-users] Moltemplate installation Andrew Jewett
16:49 Re: [lammps-users] Issue with fix qeq/point for SPC/E water simulation Ray Shan
16:33 Re: [lammps-users] Issue with fix qeq/point for SPC/E water simulation Baig abdullah Al muhit
16:29 Re: [lammps-users] How to raise the temperature after box relaxation at 0K? Meral Sharkas
16:09 Re: [lammps-users] How to raise the temperature after box relaxation at 0K? Stefan Paquay
16:06 Re: [lammps-users] Stretching test for mechanical property Ray Shan
15:57 [lammps-users] Fwd: Stretching test for mechanical property Arun Bikram Thapa
15:49 Re: [lammps-users] How to raise the temperature after box relaxation at 0K? Meral Sharkas
15:36 Re: [lammps-users] Stretching test for mechanical property Arun Bikram Thapa
15:32 Re: [lammps-users] Is it possible to realize particles with two, four or six "interaction sites" or "patches"? Stefan Paquay
15:20 [lammps-users] Is it possible to realize particles with two, four or six "interaction sites" or "patches"? Wusheng Zhang
15:20 [lammps-users] Export Material Studio Coarse Grain arizvi
15:13 Re: [lammps-users] How to raise the temperature after box relaxation at 0K? Stefan Paquay
15:10 Re: [lammps-users] How to raise the temperature after box relaxation at 0K? Meral Sharkas
15:04 Re: [lammps-users] How to raise the temperature after box relaxation at 0K? Michał Kański
15:02 Re: [lammps-users] Identifying B19 crystal structure Aria Mansouri
14:59 [lammps-users] How to raise the temperature after box relaxation at 0K? Meral Sharkas
14:58 Re: [lammps-users] Run one atom under "addforce" Axel Kohlmeyer
14:57 Re: [lammps-users] Run one atom under "addforce" Zheng, Xuechen
14:54 Re: [lammps-users] Lammps Help Ray Shan
14:52 Re: [lammps-users] Run one atom under "addforce" Michał Kański
14:51 Re: [lammps-users] Run one atom under "addforce" Ray Shan
14:48 [lammps-users] Run one atom under "addforce" Zheng, Xuechen
14:47 Re: [lammps-users] Stretching test for mechanical property Vanessa Oklejas
14:45 Re: [lammps-users] Stretching test for mechanical property Ray Shan
14:37 Re: [lammps-users] Stretching test for mechanical property Arun Bikram Thapa
14:33 [lammps-users] Stretching test for mechanical property Arun Bikram Thapa
14:26 Re: [lammps-users] Fragments and Melecules analysis/quantification Ray Shan
14:25 Re: [lammps-users] Finding the heat flux across a vacuum gap between two solids Ray Shan
14:07 Re: [lammps-users] Issue with fix qeq/point for SPC/E water simulation Ray Shan
14:04 Re: [lammps-users] Reg: Interaction energy calculation between two molecules in a system Ray Shan
13:36 Re: [lammps-users] Identifying B19 crystal structure Stefan Paquay
13:19 [lammps-users] Reg: Interaction energy calculation between two molecules in a system ZEESHAN AHMED
12:38 [lammps-users] Identifying B19 crystal structure Fabian Duarte
09:12 Re: [lammps-users] Calculate tail correction for EAM potential Axel Kohlmeyer
08:37 Re: [lammps-users] Calculate tail correction for EAM potential rbasir
08:28 [lammps-users] Displacement Perturbations in lammps Sonu Kumar
08:04 Re: [lammps-users] Calculate tail correction for EAM potential Axel Kohlmeyer
07:46 Re: [lammps-users] Calculate tail correction for EAM potential rbasir
07:40 Re: [lammps-users] Compiling LAMMPS with intel parallel studio Ubuntu 16.04 Axel Kohlmeyer
07:34 Re: [lammps-users] Calculate tail correction for EAM potential Axel Kohlmeyer
07:31 Re: [lammps-users] Question regarding DPD simulation for charge polymers Axel Kohlmeyer
07:27 Re: [lammps-users] Alloys Axel Kohlmeyer
04:20 Re: [lammps-users] Lammps read data and the data file Trung Phung
02:55 Re: [lammps-users] Controlling strain Nicola Molinari

August 21, 2017
23:58 Re: [lammps-users] Lammps read data and the data file melika_ bm85
22:19 Re: [lammps-users] Lammps read data and the data file Trung Phung
21:58 Re: [lammps-users] Moltemplate installation R. Varsha
21:39 Re: [lammps-users] Alloys Trung Phung
19:34 Re: [lammps-users] Moltemplate installation Rajesh
18:39 [lammps-users] please help answering questions Axel Kohlmeyer
15:40 [lammps-users] Issue with fix qeq/point for SPC/E water simulation Baig abdullah Al muhit
15:23 [lammps-users] Postdoc researcher opening at Idaho National Laboratory Yidong Xia
14:46 Re: [lammps-users] Segmentation fault (Core dumped) with fix qeq Baig abdullah Al muhit
14:19 Re: [lammps-users] Moltemplate installation Andrew Jewett
13:28 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Christopher Knight
13:18 Re: [lammps-users] Improved performance for setup on large numbers of MPI ranks Axel Kohlmeyer
13:09 [lammps-users] Improved performance for setup on large numbers of MPI ranks Christopher Knight
12:52 [lammps-users] Question regarding DPD simulation for charge polymers Dipak Aryal
12:22 [lammps-users] Controlling strain Asadollahzadeh
11:35 Re: [lammps-users] Moltemplate installation Rajesh
11:22 Re: [lammps-users] Calculate tail correction for EAM potential rbasir
11:21 Re: [lammps-users] Moltemplate installation Rajesh
11:17 Re: [lammps-users] Calculate tail correction for EAM potential Steve Plimpton
10:51 Re: [lammps-users] Reaxff of water Ray Shan
09:34 [lammps-users] Lammps read data and the data file melika_ bm85
08:20 [lammps-users] Finding the heat flux across a vacuum gap between two solids Sen Gupta, Ashim
07:32 [lammps-users] Reaxff of water Praveen Kumar
07:31 Re: [lammps-users] About constructing a potential file for Fe-He system. Axel Kohlmeyer
07:27 Re: [lammps-users] table potential issues. Axel Kohlmeyer
07:26 Re: [lammps-users] Moltemplate installation Axel Kohlmeyer
07:22 Re: [lammps-users] fprintf() to DEBUG Axel Kohlmeyer
07:18 Re: [lammps-users] Fwd: Regarding Tersoff and Eam pot. Axel Kohlmeyer
07:16 Re: [lammps-users] fprintf() to DEBUG Srinivasan Mahendran
07:08 Re: [lammps-users] fprintf() to DEBUG Axel Kohlmeyer
06:54 [lammps-users] fprintf() to DEBUG Srinivasan Mahendran
04:56 Re: [lammps-users] Fragments and Melecules analysis/quantification renefbg
02:37 [lammps-users] Fwd: Regarding Tersoff and Eam pot. Sharma MD

August 20, 2017
23:06 [lammps-users] Moltemplate installation R. Varsha
22:20 Re: [lammps-users] Atoms lost even in ppp conditions Rajesh
21:28 [lammps-users] About constructing a potential file for Fe-He system. Peter Chu
14:23 Re: [lammps-users] Atoms lost even in ppp conditions Stefan Paquay
12:44 [lammps-users] How to calculate cohesive energy of an alloy Vijay Reddy
10:37 [lammps-users] Atoms lost even in ppp conditions Rajesh
10:06 Re: [lammps-users] Adjusting system desnity Rajesh
08:14 [lammps-users] Calculate tail correction for EAM potential rbasir
07:53 Re: [lammps-users] Fragments and Melecules analysis/quantification Axel Kohlmeyer

August 19, 2017
14:19 [lammps-users] Compiling LAMMPS with intel parallel studio Ubuntu 16.04 Afshin Arjangmehr
10:51 [lammps-users] total Energy Hossein Geraili
08:35 [lammps-users] Alloys Asadollahzadeh
07:28 Re: [lammps-users] Regarding Tersoff and Eam pot. Axel Kohlmeyer
07:18 Re: [lammps-users] Can lammps run single atom at NVE? Axel Kohlmeyer
07:15 Re: [lammps-users] Can lammps run single atom at NVE? Steve Plimpton
07:12 Re: [lammps-users] Fragments and Melecules analysis/quantification Steve Plimpton
07:12 Re: [lammps-users] Regarding Tersoff and Eam pot. Sharma MD
06:05 Re: [lammps-users] Regarding Tersoff and Eam pot. Axel Kohlmeyer
05:44 Re: [lammps-users] Regarding Tersoff and Eam pot. Sharma MD
04:19 Re: [lammps-users] Regarding Tersoff and Eam pot. Axel Kohlmeyer
03:55 [lammps-users] Regarding Tersoff and Eam pot. Sharma MD

August 18, 2017
21:47 Re: [lammps-users] Adjusting system desnity Andrew Jewett
21:04 [lammps-users] Adjusting system desnity Rajesh
20:43 [lammps-users] table potential issues. Anna Vernon
20:33 [lammps-users] Adjusting system desnity Rajesh
17:58 Re: [lammps-users] Segmentation fault (Core dumped) with fix qeq Axel Kohlmeyer
17:11 Re: [lammps-users] Segmentation fault (Core dumped) with fix qeq Baig abdullah Al muhit
16:18 Re: [lammps-users] Segmentation fault (Core dumped) with fix qeq Axel Kohlmeyer
15:15 [lammps-users] Segmentation fault (Core dumped) with fix qeq Baig abdullah Al muhit
14:48 Re: [lammps-users] Can lammps run single atom at NVE? Axel Kohlmeyer
14:15 Re: [lammps-users] Can lammps run single atom at NVE? Zheng, Xuechen
14:01 Re: [lammps-users] Can lammps run single atom at NVE? Axel Kohlmeyer
13:48 Re: [lammps-users] Can lammps run single atom at NVE? Zheng, Xuechen
13:22 Re: [lammps-users] Can lammps run single atom at NVE? Axel Kohlmeyer
13:17 Re: [lammps-users] Can lammps run single atom at NVE? Zheng, Xuechen
12:32 Re: [lammps-users] How to mix to get cross pairwise energy. Axel Kohlmeyer
12:21 Re: [lammps-users] Can lammps run single atom at NVE? Axel Kohlmeyer
11:48 [lammps-users] Can lammps run single atom at NVE? Zheng, Xuechen
11:03 [lammps-users] Fragments and Melecules analysis/quantification renefbg
10:22 [lammps-users] How to mix to get cross pairwise energy. Xiaoyu Wang
10:00 [lammps-users] Reg: total energy of co2 dimer Zeeshan Ahmed
09:53 Re: [lammps-users] corner atoms fly away for core-shell model Axel Kohlmeyer
08:21 [lammps-users] Fwd: Thermal/conductivity Neda Rafiee
07:56 Re: [lammps-users] Getting the DPD thermostat right Axel Kohlmeyer
07:31 [lammps-users] corner atoms fly away for core-shell model bo He
04:16 Re: [lammps-users] Getting the DPD thermostat right Peter Vanya
01:59 Re: [lammps-users] Distance between particles does not match for deformed box habib rahbari

August 17, 2017
22:54 Re: [lammps-users] Question about extraction of atom id Woo Cheol Jeon
21:13 Re: [lammps-users] neigh_modify Prakash Makwana
20:58 [lammps-users] Distance between particles does not match for deformed box habib rahbari
15:01 Re: [lammps-users] Structure of AIREBO potential Huang
14:54 Re: [lammps-users] error Unknown fix style (../modify.cpp:815) Axel Kohlmeyer
14:49 Re: [lammps-users] Problem in pair_style hybride Paul Swain
14:49 Re: [lammps-users] neigh_modify Axel Kohlmeyer
14:48 [lammps-users] error Unknown fix style (../modify.cpp:815) Paul Swain
14:43 Re: [lammps-users] Structure of AIREBO potential Axel Kohlmeyer
14:38 Re: [lammps-users] neigh_modify Prakash Makwana
14:36 Re: [lammps-users] single function for specific pair style Axel Kohlmeyer
14:35 Re: [lammps-users] single function for specific pair style Huang
14:34 Re: [lammps-users] Structure of AIREBO potential Huang
14:06 Re: [lammps-users] single function for specific pair style Axel Kohlmeyer
14:03 [lammps-users] single function for specific pair style Huang
13:58 Re: [lammps-users] Structure of AIREBO potential Axel Kohlmeyer
13:50 Re: [lammps-users] Structure of AIREBO potential Huang
13:48 Re: [lammps-users] Nanocutting Axel Kohlmeyer
13:41 Re: [lammps-users] Nanocutting Axel Kohlmeyer
12:59 [lammps-users] Nanocutting Fabian Duarte
12:35 Re: [lammps-users] neigh_modify Axel Kohlmeyer
12:26 Re: [lammps-users] Structure of AIREBO potential Ray Shan
11:13 Re: [lammps-users] neigh_modify Prakash Makwana
11:07 Re: [lammps-users] Getting the DPD thermostat right Axel Kohlmeyer
11:03 Re: [lammps-users] Question about extraction of atom id Axel Kohlmeyer
10:16 [lammps-users] Getting the DPD thermostat right Peter Vanya
10:11 [lammps-users] Question about extraction of atom id Woo Cheol Jeon
09:18 Re: [lammps-users] TIP4P-FQ Axel Kohlmeyer
08:45 Re: [lammps-users] Density of methanol Axel Kohlmeyer
08:40 Re: [lammps-users] Using compute cluster/atom to create group Imanuel Kristanto
08:36 Re: [lammps-users] Using compute cluster/atom to create group Axel Kohlmeyer
08:31 Re: [lammps-users] Problem in pair_style hybride Axel Kohlmeyer
08:27 [lammps-users] Using compute cluster/atom to create group Imanuel Kristanto
08:15 [lammps-users] Density of methanol 노승효
08:14 [lammps-users] Problem in pair_style hybride Paul Swain
07:58 Re: [lammps-users] Thole damping function Steve Plimpton
07:57 Re: [lammps-users] pair interaction energies and forces Steve Plimpton
07:54 Re: [lammps-users] system of an electrolyte. Steve Plimpton
07:52 Re: [lammps-users] DSF-Potential curve Steve Plimpton
07:50 Re: [lammps-users] Comparison between fix heat and ehex Steve Plimpton
07:45 Re: [lammps-users] pair_style nb3b/harmonic implementation vs documentation Steve Plimpton
07:42 Re: [lammps-users] Energy fluctuations while sliding motion Steve Plimpton
07:39 Re: [lammps-users] Change from 2D to 3D Steve Plimpton
07:38 Re: [lammps-users] How to see codes beneath Lammps commands Steve Plimpton
07:35 Re: [lammps-users] Fix NVE for Poiseuille flow in example Steve Plimpton
06:58 Re: [lammps-users] Change from 2D to 3D Stefan Paquay
06:38 Re: [lammps-users] How to see codes beneath Lammps commands Axel Kohlmeyer
06:36 Re: [lammps-users] Thermal/conductivity Axel Kohlmeyer
06:24 [lammps-users] How to see codes beneath Lammps commands Neda Rafiee
06:16 [lammps-users] Thermal/conductivity Neda Rafiee
05:37 Re: [lammps-users] Problem in neighbour list Axel Kohlmeyer
04:43 Re: [lammps-users] Structure of AIREBO potential Huang
04:34 Re: [lammps-users] Structure of AIREBO potential Axel Kohlmeyer
04:16 [lammps-users] Structure of AIREBO potential Huang
01:01 [lammps-users] TIP4P-FQ ??

August 16, 2017
23:03 [lammps-users] Problem in neighbour list Selesta Oxem
22:37 Re: [lammps-users] Change from 2D to 3D Sisir Das
15:18 Re: [lammps-users] Lammps installation Axel Kohlmeyer
14:00 Re: [lammps-users] memory Axel Kohlmeyer
13:57 [lammps-users] Lammps installation LoatParadise Milton
13:50 Re: [lammps-users] memory Hossein Geraili
13:41 Re: [lammps-users] memory Axel Kohlmeyer
13:34 [lammps-users] memory Hossein Geraili
13:11 Re: [lammps-users] molecular dynamics simulation Axel Kohlmeyer
13:09 Re: [lammps-users] MD simulation for 3d polydisperse system Axel Kohlmeyer
10:01 [lammps-users] MD simulation for 3d polydisperse system Notan Tah
09:54 [lammps-users] molecular dynamics simulation abhishek kumar
08:56 Re: [lammps-users] system of an electrolyte. Axel Kohlmeyer
08:23 Re: [lammps-users] Change from 2D to 3D Axel Kohlmeyer
08:18 Re: [lammps-users] Fix NVE for Poiseuille flow in example Axel Kohlmeyer
08:14 Re: [lammps-users] modify option Axel Kohlmeyer
07:17 [lammps-users] modify option Sisir Das
07:10 [lammps-users] system of an electrolyte. R. Varsha
07:08 [lammps-users] Fix NVE for Poiseuille flow in example Sisir Das
06:50 [lammps-users] Change from 2D to 3D Sisir Das
06:48 Re: [lammps-users] shear wave in equilibrium simulations Stefan Paquay
05:21 [lammps-users] shear wave in equilibrium simulations Reza Has

August 15, 2017
23:43 Re: [lammps-users] force field Asadollahzadeh
18:33 [lammps-users] Thole damping function Jo
12:19 [lammps-users] pair interaction energies and forces Jo
12:09 Re: [lammps-users] force field Axel Kohlmeyer
11:43 [lammps-users] force field Asadollahzadeh
08:03 Re: [lammps-users] A question about the number of neighbors for each atom in pair_airebo.cpp Steve Plimpton
06:43 Re: [lammps-users] TIP4P-2005 water model Axel Kohlmeyer
05:10 Re: [lammps-users] Per atom temperature Axel Kohlmeyer
04:29 Re: [lammps-users] Per atom temperature Nader Ameli
02:16 Re: [lammps-users] NEB EXAMPLE Alexandra Davila

August 14, 2017
10:40 Re: [lammps-users] NEB EXAMPLE Axel Kohlmeyer
10:35 Re: [lammps-users] NEB EXAMPLE Alexandra Davila
10:10 Re: [lammps-users] NEB EXAMPLE Axel Kohlmeyer
10:06 Re: [lammps-users] NEB EXAMPLE Steve Plimpton
10:03 Re: [lammps-users] Neb with reax Steve Plimpton
10:01 [lammps-users] NEB EXAMPLE Alexandra Davila
09:58 Re: [lammps-users] Lammps simulation for Poiseuille flow in pipe Steve Plimpton
09:57 Re: [lammps-users] TIP4P-2005 water model Steve Plimpton
09:54 Re: [lammps-users] Fwd: Problem when building LAMMPS with USER-3SPN (external package) Steve Plimpton
09:50 Re: [lammps-users] Receiving the following error when I ran my simulation- Overlapping large/large in pair colloid (..pair_colloid.cpp.187) Steve Plimpton
09:19 Re: [lammps-users] Melting Metallic Particles on Graphene Stefan Paquay
09:06 Re: [lammps-users] Per atom temperature S. Ramaswami
09:00 Re: [lammps-users] Hollow cylinder region Stefan Paquay
08:59 Re: [lammps-users] Per atom temperature Stefan Paquay
08:00 [lammps-users] Hollow cylinder region Eivind Bering
07:58 [lammps-users] Neb with reax Alexandra Davila
06:55 [lammps-users] system of an electrolyte. R. Varsha
06:15 Re: [lammps-users] Create files in LAMMPS. Nader Ameli
06:13 Re: [lammps-users] Create files in LAMMPS. Imanuel Kristanto
03:21 [lammps-users] Create files in LAMMPS. R. Varsha
03:03 [lammps-users] Per atom temperature Nader Ameli
02:57 Re: [lammps-users] LAMMPS: Inquiry on Random Seed and Data Reproduction" Axel Kohlmeyer
02:14 [lammps-users] Lammps simulation for Poiseuille flow in pipe Sisir Das
01:02 Re: [lammps-users] Pair_style coul/wolf Kousika A
00:58 [lammps-users] LAMMPS: Inquiry on Random Seed and Data Reproduction" MASATO KOIZUMI

August 13, 2017
22:25 [lammps-users] New LAMMPS Windows Installer Binaries for 11 Aug 2017 release candidate Axel Kohlmeyer
14:52 Re: [lammps-users] Some questions ? Axel Kohlmeyer
14:33 [lammps-users] Some questions ? A. M.M
12:07 [lammps-users] Fwd: Problem when building LAMMPS with USER-3SPN (external package) A. M.M

August 12, 2017
19:47 Re: [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" Axel Kohlmeyer
18:53 Re: [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" MASATO KOIZUMI
15:59 Re: [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" Axel Kohlmeyer
14:02 Re: [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" Axel Kohlmeyer
13:40 Re: [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" MASATO KOIZUMI
12:49 Re: [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" Axel Kohlmeyer
12:47 Re: [lammps-users] Problem about pair-style buck/coul/msm and kspace-style msm Axel Kohlmeyer
12:10 Re: [lammps-users] meam problem in python Giacomo Fiorin
12:07 Re: [lammps-users] Fwd: Giacomo Fiorin
11:26 [lammps-users] meam problem in python Masoud Rahbar
09:16 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
08:58 Re: [lammps-users] Pair_style coul/wolf Axel Kohlmeyer
08:48 Re: [lammps-users] Pair_style coul/wolf Kousika A
07:27 [lammps-users] Problem about pair-style buck/coul/msm and kspace-style msm 袁丹丹
06:47 [lammps-users] Fwd: laltu dass
04:56 Re: [lammps-users] (no subject) Axel Kohlmeyer
01:00 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential Huang
00:31 [lammps-users] (no subject) laltu dass

August 11, 2017
17:43 [lammps-users] LAMMPS: Inconsistent Results When Using Same Random Seed" MASATO KOIZUMI
15:51 Re: [lammps-users] ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Luca Gelisio
15:08 [lammps-users] imminent new stable release Steve Plimpton
14:51 Re: [lammps-users] ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Ray Shan
13:50 Re: [lammps-users] Receiving the following error when I ran my simulation- Overlapping large/large in pair colloid (..pair_colloid.cpp.187) Dennis Plessen
12:33 Re: [lammps-users] simulation of liquid Argon Axel Kohlmeyer
12:11 [lammps-users] simulation of liquid Argon m n
10:10 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential Axel Kohlmeyer
09:58 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
09:50 Re: [lammps-users] ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Luca Gelisio
08:58 Re: [lammps-users] TIP4P-2005 water model Steve Plimpton
08:56 Re: [lammps-users] Receiving the following error when I ran my simulation- Overlapping large/large in pair colloid (..pair_colloid.cpp.187) Steve Plimpton
08:08 Re: [lammps-users] ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Giacomo Fiorin
07:57 [lammps-users] ODP: ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Michał Kański
07:06 Re: [lammps-users] ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Giacomo Fiorin
06:14 [lammps-users] ReaxFF form in Ashraf and van Duin (JPCA 2016, 10.1021/acs.jpca.6b12429) Luca Gelisio
06:12 Re: [lammps-users] Pair_style coul/wolf Axel Kohlmeyer
06:02 Re: [lammps-users] Tabulated potential + coulombic long range potential Axel Kohlmeyer
06:00 Re: [lammps-users] msi2lmp tool - handling symmetry operations Axel Kohlmeyer
05:12 [lammps-users] msi2lmp tool - handling symmetry operations Diez Fernandez, Amanda
04:10 Re: [lammps-users] Tabulated potential + coulombic long range potential Meral Sharkas
03:34 [lammps-users] Pair_style coul/wolf Kousika A
01:49 [lammps-users] TIP4P-2005 water model 284237308@...1204...
00:05 Re: [lammps-users] Lost atoms while atoms are still in the box Trung Phung
00:02 Re: [lammps-users] Lennard-Jones 2D pressure changes with potential cut off sindhana

August 10, 2017
23:33 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Kousika A
16:54 [lammps-users] Receiving the following error when I ran my simulation- Overlapping large/large in pair colloid (..pair_colloid.cpp.187) Dennis Plessen
16:51 [lammps-users] Energy fluctuations while sliding motion George Ray
09:56 Re: [lammps-users] I need to add lammps_create_atoms() to Fortran interface Axel Kohlmeyer
09:51 Re: [lammps-users] Tabulated potential + coulombic long range potential Axel Kohlmeyer
09:17 Re: [lammps-users] Lennard-Jones 2D pressure changes with potential cut off Axel Kohlmeyer
09:13 Re: [lammps-users] Lost atoms while atoms are still in the box Axel Kohlmeyer
08:01 Re: [lammps-users] Lennard-Jones 2D pressure changes with potential cut off Giacomo Fiorin
08:00 Re: [lammps-users] modifying the LJ potential with a tabulated potential Giacomo Fiorin
07:59 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Axel Kohlmeyer
07:46 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Kousika A
06:40 Re: [lammps-users] A question about AIREBO potential Huang
05:11 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Axel Kohlmeyer
05:04 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Kousika A
04:57 [lammps-users] Lennard-Jones 2D pressure changes with potential cut off sindhana
04:32 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Axel Kohlmeyer
04:16 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Kousika A
03:49 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Axel Kohlmeyer
01:53 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Kousika A

August 09, 2017
23:40 [lammps-users] modifying the LJ potential with a tabulated potential Anna Lappala
22:57 [lammps-users] Fw: Tabulated potential + coulombic long range potential Meral Sharkas
22:13 [lammps-users] Lost atoms while atoms are still in the box Trung Phung
15:56 Re: [lammps-users] How can I get the plot of thermal conductivity from J0Jt.dat file? Arthur France-Lanord
12:54 [lammps-users] I need to add lammps_create_atoms() to Fortran interface rbasir
11:49 Re: [lammps-users] A question about AIREBO potential Ray Shan
11:19 [lammps-users] DSF-Potential curve Sebastian Gsänger
09:53 Re: [lammps-users] How can I get the plot of thermal conductivity from J0Jt.dat file? 소순성
08:35 Re: [lammps-users] How can I get the plot of thermal conductivity from J0Jt.dat file? Arthur France-Lanord
08:24 Re: [lammps-users] How can I plot the heat current autocorrelation function (HCACF) from J0Jt.dat file? Steve Plimpton
08:20 Re: [lammps-users] how to create orthorhombic lattice Steve Plimpton
08:20 Re: [lammps-users] How can I get the plot of thermal conductivity from J0Jt.dat file? Steve Plimpton
08:18 Re: [lammps-users] Signal to noise ratio and sampling time. Steve Plimpton
08:16 Re: [lammps-users] Strain while deformation Steve Plimpton
08:04 [lammps-users] Tabulated potential + coulombic long range potential Meral Sharkas
04:36 Re: [lammps-users] how to create orthorhombic lattice Axel Kohlmeyer
03:07 [lammps-users] how to create orthorhombic lattice Nitish Singh
01:57 [lammps-users] How can I get the plot of thermal conductivity from J0Jt.dat file? 소순성

August 08, 2017
22:58 Re: [lammps-users] Rebuilding LAMMPS in windows-Regarding Ray Shan
22:52 [lammps-users] Rebuilding LAMMPS in windows-Regarding Kousika A
15:35 Re: [lammps-users] A basic question on using lamps dump files Axel Kohlmeyer
14:43 [lammps-users] A basic question on using lamps dump files Richard Gustafson
13:15 Re: [lammps-users] Problem when building LAMMPS with USER-3SPN (external package) Axel Kohlmeyer
12:53 [lammps-users] Problem when building LAMMPS with USER-3SPN (external package) A. M.M
11:00 [lammps-users] Signal to noise ratio and sampling time. Eduardo Ramos
09:17 [lammps-users] A question about AIREBO potential Huang
08:48 [lammps-users] Strain while deformation George Ray

August 07, 2017
23:38 Re: [lammps-users] Temperature and Energy increases with "nve/limit" command Axel Kohlmeyer
22:49 Re: [lammps-users] Temperature and Energy increases with "nve/limit" command surendra jain
18:12 Re: [lammps-users] Unable to run LAMMPS due to too many lines in input file Neil Mehta
17:42 Re: [lammps-users] Unable to run LAMMPS due to too many lines in input file Axel Kohlmeyer
16:58 [lammps-users] Unable to run LAMMPS due to too many lines in input file Neil Mehta
13:30 Re: [lammps-users] Temperature and Energy increases with "nve/limit" command Axel Kohlmeyer
12:40 Re: [lammps-users] lammps-users - Query on indentation using lammps Axel Kohlmeyer
10:58 Re: [lammps-users] Reg: Huge increment in density for two phase simulation while using NPT Ray Shan
10:45 Re: [lammps-users] melting point for the Silicon bulk Ray Shan
09:09 Re: [lammps-users] Ni-Fe ADP potential , ERROR: Lost atoms: original 4000 current 3998 (../thermo.cpp:442) Axel Kohlmeyer
08:54 [lammps-users] lammps-users - Query on indentation using lammps Aju Zachariah Mani
08:48 Re: [lammps-users] Ni-Fe ADP potential , ERROR: Lost atoms: original 4000 current 3998 (../thermo.cpp:442) Anil Mangla
07:54 Re: [lammps-users] Replication in compute command Steve Plimpton
07:42 Re: [lammps-users] Ni-Fe ADP potential , ERROR: Lost atoms: original 4000 current 3998 (../thermo.cpp:442) Axel Kohlmeyer
07:39 [lammps-users] Ni-Fe ADP potential , ERROR: Lost atoms: original 4000 current 3998 (../thermo.cpp:442) Anil Mangla
07:22 [lammps-users] How can I plot the heat current autocorrelation function (HCACF) from J0Jt.dat file? 소순성
04:56 Re: [lammps-users] Reg: Intercation energy of co2 dimer and its atomic interactions Axel Kohlmeyer
04:36 Re: [lammps-users] Question on: How to simulate a system that contains two different scales of force field by using lammps Axel Kohlmeyer
02:32 [lammps-users] Reg: Intercation energy of co2 dimer and its atomic interactions Zeeshan Ahmed
00:25 [lammps-users] Question on: How to simulate a system that contains two different scales of force field by using lammps sunny

August 06, 2017
08:31 Re: [lammps-users] Questions on voronoi package installation Woo Cheol Jeon
08:22 Re: [lammps-users] Questions on voronoi package installation Axel Kohlmeyer
08:08 [lammps-users] Questions on voronoi package installation Woo Cheol Jeon

August 05, 2017
21:27 Re: [lammps-users] Reg: Huge increment in density for two phase simulation while using NPT Zeeshan Ahmed
20:32 Re: [lammps-users] Reg: Huge increment in density for two phase simulation while using NPT Ray Shan
14:11 [lammps-users] Replication in compute command Nader Ameli
13:52 [lammps-users] Reg: Huge increment in density for two phase simulation while using NPT Zeeshan Ahmed
08:25 Re: [lammps-users] Melting Metallic Particles on Graphene Stefan Paquay
05:33 Re: [lammps-users] Inserting a particle at a Voronoi vertex at maximum distance from existing particles Steve Plimpton
05:22 Re: [lammps-users] Problem in tensile test Steve Plimpton
04:12 [lammps-users] Comparison between fix heat and ehex Daipayan Sarkar
01:29 [lammps-users] Melting Metallic Particles on Graphene Rosita Masoudi

August 04, 2017
23:40 [lammps-users] Temperature and Energy increases with "nve/limit" command surendra jain
20:51 [lammps-users] Inserting a particle at a Voronoi vertex at maximum distance from existing particles Garrett Tow
10:31 Re: [lammps-users] melting point for the Silicon bulk Ray Shan
10:10 Re: [lammps-users] Problem with using external electric field in reactive MD simulations Mohammad Izadi
09:04 [lammps-users] A question about the number of neighbors for each atom in pair_airebo.cpp Huang
08:36 Re: [lammps-users] Problem in tensile test Axel Kohlmeyer
08:26 Re: [lammps-users] Visual Studio for Mac Axel Kohlmeyer
08:25 Re: [lammps-users] Thermo-style pe & compute pe Steve Plimpton
08:13 Re: [lammps-users] Calculation of number of slip events in granular simulation Steve Plimpton
08:10 Re: [lammps-users] How to make MSD output for every 0.5 ns Steve Plimpton
07:33 [lammps-users] Problem in tensile test Selesta Oxem
07:16 [lammps-users] XRD Anil Mangla
06:47 [lammps-users] Visual Studio for Mac Matthew Wander
05:50 Re: [lammps-users] Problem with using external electric field in reactive MD simulations Axel Kohlmeyer

August 03, 2017
23:31 Re: [lammps-users] Problem with using external electric field in reactive MD simulations Mohammad Izadi
19:09 Re: [lammps-users] How to output compute cluster/atom srdjan pusara
18:46 Re: [lammps-users] How to output compute cluster/atom Giacomo Fiorin
17:41 Re: [lammps-users] How to output compute cluster/atom srdjan pusara
17:19 Re: [lammps-users] How to output compute cluster/atom Axel Kohlmeyer
15:26 Re: [lammps-users] How to output compute cluster/atom Patrick Goetz
14:49 [lammps-users] Problem regarding uniaxial tension test Selesta Oxem
12:46 Re: [lammps-users] Simulation of a LJ liquid with solid walls on top and bottom Axel Kohlmeyer
12:20 [lammps-users] Simulation of a LJ liquid with solid walls on top and bottom m n
11:42 Re: [lammps-users] GPU compiled but binary sleeps... Meij, Henk
11:20 Re: [lammps-users] How to output compute cluster/atom srdjan pusara
10:30 Re: [lammps-users] How to output compute cluster/atom Axel Kohlmeyer
10:15 Re: [lammps-users] Bond/break causing segfaults(?) Axel Kohlmeyer
10:14 Re: [lammps-users] How to output compute cluster/atom srdjan pusara
10:14 [lammps-users] Problem regarding uniaxial tension test Selesta Oxem
09:50 Re: [lammps-users] How to define different groups in the same molecule as different chunks Giacomo Fiorin
09:26 [lammps-users] How to define different groups in the same molecule as different chunks Shu Wang
09:23 Re: [lammps-users] problem with "fix thermal/conductivity" Patrick Goetz
09:20 [lammps-users] Bond/break causing segfaults(?) Guido Ritsema van Eck
09:19 Re: [lammps-users] How to output compute cluster/atom Axel Kohlmeyer
09:06 Re: [lammps-users] How to output compute cluster/atom srdjan pusara
09:00 Re: [lammps-users] How to output compute cluster/atom Axel Kohlmeyer
08:47 Re: [lammps-users] problem with "fix thermal/conductivity" Axel Kohlmeyer
08:39 [lammps-users] How to output compute cluster/atom srdjan pusara
08:25 Re: [lammps-users] problem with "fix thermal/conductivity" Neda Rafiee
07:48 Re: [lammps-users] problem with "fix thermal/conductivity" Axel Kohlmeyer
07:32 Re: [lammps-users] problem with "fix thermal/conductivity" Neda Rafiee
07:21 Re: [lammps-users] LAMMPS GPU Compatibility/Recommendations ke shen
07:11 Re: [lammps-users] LAMMPS GPU Compatibility/Recommendations Meij, Henk
06:38 Re: [lammps-users] LJ parames Axel Kohlmeyer
06:29 Re: [lammps-users] Regarding the calculation of slip events in granular simulation Axel Kohlmeyer
06:15 Re: [lammps-users] Electric_field Axel Kohlmeyer
05:39 Re: [lammps-users] problem with "fix thermal/conductivity" Axel Kohlmeyer
03:17 Re: [lammps-users] Regarding the calculation of slip events in granular simulation saikat roy
02:58 [lammps-users] problem with "fix thermal/conductivity" Neda Rafiee

August 02, 2017
23:32 Re: [lammps-users] Electric_field Mohammad Izadi
23:25 [lammps-users] Thermo-style pe & compute pe Lamm Gro
21:41 Re: [lammps-users] How to make thermostat temperature change with time? Stefan Paquay
21:39 [lammps-users] LJ parames 284237308@...1204...
20:08 Re: [lammps-users] How to make thermostat temperature change with time? Axel Kohlmeyer
17:40 Re: [lammps-users] GPU compiled but binary sleeps... Axel Kohlmeyer
17:32 Re: [lammps-users] Electric_field Axel Kohlmeyer
17:31 Re: [lammps-users] LAMMPS GPU Compatibility/Recommendations ke shen
17:25 Re: [lammps-users] LAMMPS GPU Compatibility/Recommendations Axel Kohlmeyer
17:01 Re: [lammps-users] Regarding the calculation of slip events in granular simulation Axel Kohlmeyer
15:30 [lammps-users] Regarding the calculation of slip events in granular simulation saikat roy
15:26 [lammps-users] Calculation of number of slip events in granular simulation saikat roy
12:53 [lammps-users] LAMMPS GPU Compatibility/Recommendations ke shen
11:14 [lammps-users] Electric_field Mohammad Izadi
07:24 Re: [lammps-users] GPU compiled but binary sleeps... Meij, Henk
04:31 Re: [lammps-users] Masato Koizumi "Reporting LAMMPS bug in fix deform command" Julien Guénolé
01:09 [lammps-users] Masato Koizumi "Reporting LAMMPS bug in fix deform command" MASATO KOIZUMI

August 01, 2017
21:18 [lammps-users] How to make thermostat temperature change with time? Au3
11:59 Re: [lammps-users] LAMMPS Python Error Axel Kohlmeyer
11:02 Re: [lammps-users] Bond style hydrid using harmonic and table Axel Kohlmeyer
10:29 Re: [lammps-users] Problems with compass parameters Axel Kohlmeyer
10:19 [lammps-users] LAMMPS Python Error Dr. Xiaofeng Duan
10:10 [lammps-users] Bond style hydrid using harmonic and table George Ray
09:11 Re: [lammps-users] Problems with compass parameters Sridhar,S Arun Srikant
09:10 Re: [lammps-users] Problems with compass parameters Sridhar,S Arun Srikant
08:59 Re: [lammps-users] Problems with compass parameters Rosa Osorio
07:49 Re: [lammps-users] problem with running lammps in parallel Axel Kohlmeyer
07:42 [lammps-users] problem with running lammps in parallel Ana Cristina Ramírez
00:01 Re: [lammps-users] problem with running lammps in parallel Axel Kohlmeyer

July 31, 2017
23:44 [lammps-users] problem with running lammps in parallel Neda Rafiee
22:06 Re: [lammps-users] How to make MSD output for every 0.5 ns Nishad Khan
16:52 Re: [lammps-users] proper forcefield for C60 fullerene Axel Kohlmeyer
16:31 Re: [lammps-users] How to get bond length distribution between CG superatoms from atomistic simulation Axel Kohlmeyer
15:19 Re: [lammps-users] undefined reference to scalable_aligned_malloc, > scalable_aligned_realloc, and scalable_aligned_free? Patrick Goetz
14:56 [lammps-users] How to get bond length distribution between CG superatoms from atomistic simulation Shu Wang
14:52 Re: [lammps-users] OPLSAA for lammps input using moltemplate John Smith
14:42 [lammps-users] proper forcefield for C60 fullerene Ali Shomali
09:53 Re: [lammps-users] Bead -Spring model temperature not going up Stefan Paquay
09:52 Re: [lammps-users] Bead -Spring model temperature not going up Stefan Paquay
09:31 [lammps-users] Bead -Spring model temperature not going up George Ray
09:09 [lammps-users] GPU compiled but binary sleeps... Meij, Henk
08:30 Re: [lammps-users] How to make MSD output for every 0.5 ns Steve Plimpton
04:34 Re: [lammps-users] what happens when cutoff greater than half box length? Axel Kohlmeyer
04:28 Re: [lammps-users] Error: atoms lost Axel Kohlmeyer
03:59 [lammps-users] what happens when cutoff greater than half box length? RaviKumarReddy ADDULA
00:19 [lammps-users] Error: atoms lost Neda Rafiee

July 30, 2017
21:05 Re: [lammps-users] Atom type for same atoms Joshua Moore
20:15 [lammps-users] Atom type for same atoms zhaoxiao@...4953...
18:46 Re: [lammps-users] Variation in x y z coordinates in dump files due to restart Axel Kohlmeyer
11:34 Re: [lammps-users] Variation in x y z coordinates in dump files due to restart Vivek Ananth
09:40 Re: [lammps-users] Variation in x y z coordinates in dump files due to restart Axel Kohlmeyer
07:22 [lammps-users] How to make MSD output for every 0.5 ns Nishad Khan
05:37 [lammps-users] Variation in x y z coordinates in dump files due to restart Vivek Ananth

July 29, 2017
20:25 Re: [lammps-users] undefined reference to scalable_aligned_malloc, > scalable_aligned_realloc, and scalable_aligned_free? Stan Moore
07:27 Re: [lammps-users] Regarding RDF output Axel Kohlmeyer
07:13 [lammps-users] Regarding RDF output Jeams Anderson
06:36 Re: [lammps-users] Melting two standard molecules together Axel Kohlmeyer
06:31 Re: [lammps-users] fix atoms in simulation box Axel Kohlmeyer
03:58 [lammps-users] Melting two standard molecules together NEETHISH M M

July 28, 2017
23:13 [lammps-users] fix atoms in simulation box Mathur Nil
22:55 Re: [lammps-users] trouble using rigid bodies in simulation (lost atoms) Axel Kohlmeyer
21:53 Re: [lammps-users] trouble using rigid bodies in simulation (lost atoms) surendra jain
15:42 Re: [lammps-users] undefined reference to scalable_aligned_malloc, scalable_aligned_realloc, and scalable_aligned_free? Axel Kohlmeyer
14:22 [lammps-users] undefined reference to scalable_aligned_malloc, scalable_aligned_realloc, and scalable_aligned_free? Patrick Goetz
13:32 Re: [lammps-users] An interesting observation Rajdeep Behera
07:30 Re: [lammps-users] trouble using rigid bodies in simulation (lost atoms) Axel Kohlmeyer
06:02 [lammps-users] trouble using rigid bodies in simulation (lost atoms) surendra jain
03:40 Re: [lammps-users] pair_style nb3b/harmonic implementation vs documentation Julien Guénolé

July 27, 2017
21:24 Re: [lammps-users] Accounting for Local Velocity in Langevin Thermostat Axel Kohlmeyer
17:31 [lammps-users] Accounting for Local Velocity in Langevin Thermostat Joshua Cordon
16:32 Re: [lammps-users] Problems with compass parameters Axel Kohlmeyer
15:55 [lammps-users] Problems with compass parameters Rosa Osorio
14:08 Re: [lammps-users] Inquiry on LAMMPS fix_deform and variable formula" MASATO KOIZUMI
13:51 Re: [lammps-users] Inquiry on LAMMPS fix_deform and variable formula" Axel Kohlmeyer
13:38 Re: [lammps-users] Inquiry on LAMMPS fix_deform and variable formula" Axel Kohlmeyer
13:31 Re: [lammps-users] Inquiry on LAMMPS fix_deform and variable formula" MASATO KOIZUMI
12:42 Re: [lammps-users] [EXTERNAL] Help lj/gromacs/coul/gromacs + pppm + respa + shake Moore, Stan
11:24 Re: [lammps-users] Checking/visualizing the data file before running it with LAMMPS Andrew Summers
11:23 Re: [lammps-users] Checking/visualizing the data file before running it with LAMMPS Axel Kohlmeyer
10:43 [lammps-users] Checking/visualizing the data file before running it with LAMMPS Jatin Kashyap
09:25 Re: [lammps-users] Is it possible to realize "horizontal" shifted LJ potential in LAMMPS? Wusheng Zhang
09:22 Re: [lammps-users] Is it possible to realize "horizontal" shifted LJ potential in LAMMPS? Stefan Paquay
09:20 Re: [lammps-users] [EXTERNAL] Help lj/gromacs/coul/gromacs + pppm + respa + shake Moore, Stan
09:07 [lammps-users] Help lj/gromacs/coul/gromacs + pppm + respa + shake Maria Silvina Moyano
09:06 [lammps-users] Is it possible to realize "horizontal" shifted LJ potential in LAMMPS? Jiang Minzhi
08:39 Re: [lammps-users] Regarding Periodicity in Z-direction for HCP crystal Steve Plimpton
05:16 Re: [lammps-users] nonperiodic boundary condition for wall Axel Kohlmeyer
01:46 [lammps-users] nonperiodic boundary condition for wall SHABNAM GHAHREMANIAN

July 26, 2017
22:05 Re: [lammps-users] [EXTERNAL] Re: Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Michael R Shirts
20:29 Re: [lammps-users] OPLSAA for lammps input using moltemplate Andrew Jewett
17:34 Re: [lammps-users] An interesting observation Mohammad Rafat Sadat
16:02 [lammps-users] An interesting observation Rajdeep Behera
11:57 [lammps-users] Regarding Periodicity in Z-direction for HCP crystal Sharma MD
09:55 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
09:11 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential Axel Kohlmeyer
07:49 Re: [lammps-users] Error in DPD-shardlow example Steve Plimpton
07:48 Re: [lammps-users] Fwd: doubt regarding values of 'drho' and 'dr' for .adp file for Ni-Fe system Steve Plimpton
07:13 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
05:41 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
05:26 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential Axel Kohlmeyer
05:19 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
04:28 Re: [lammps-users] lost atoms every iteration loop Axel Kohlmeyer
04:26 Re: [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential Axel Kohlmeyer
03:52 [lammps-users] lost atoms every iteration loop Orpe Ashish
03:30 [lammps-users] A question about Pair_style Lamm Gro
03:04 Re: [lammps-users] lammps-users Digest, Vol 134, Issue 83 Lamm Gro
02:44 [lammps-users] Error in DPD-shardlow example Nitish Singh
02:29 Re: [lammps-users] lammps-users Digest, Vol 134, Issue 83 Agilio Padua
01:16 [lammps-users] Neighbor list for calculating the local normals for Kolmogorov-Crespi potential ouyang
00:16 [lammps-users] Free energy Lamm Gro

July 25, 2017
21:44 Re: [lammps-users] Short question - Does 'Clear' command undo 'Package' command ? Axel Kohlmeyer
21:13 [lammps-users] Short question - Does 'Clear' command undo 'Package' command ? 공과대학 기계공학과
20:54 Re: [lammps-users] Fix atom/swap - atom charges Axel Kohlmeyer
20:50 Re: [lammps-users] Fix atom/swap - atom charges Phan, Anh
20:13 Re: [lammps-users] Fix atom/swap - atom charges Axel Kohlmeyer
19:41 [lammps-users] Fix atom/swap - atom charges Phan, Anh
15:07 Re: [lammps-users] Using LAMMPS on Cloud Supercomputers Titusi Forum
01:59 Re: [lammps-users] Fwd: doubt regarding values of 'drho' and 'dr' for .adp file for Ni-Fe system Anil Mangla
00:09 Re: [lammps-users] no error and no output generated Neda Rafiee

July 24, 2017
15:15 Re: [lammps-users] Silicon bulk Melting Point Ray Shan
14:49 Re: [lammps-users] Silicon bulk Melting Point Axel Kohlmeyer
14:41 Re: [lammps-users] Silicon bulk Melting Point Hao Chen
14:32 Re: [lammps-users] Silicon bulk Melting Point Axel Kohlmeyer
13:27 Re: [lammps-users] Setting a time-dependent dipole moment Axel Kohlmeyer
13:20 Re: [lammps-users] Silicon bulk Melting Point Hao Chen
13:18 Re: [lammps-users] Silicon bulk Melting Point Axel Kohlmeyer
12:57 [lammps-users] Silicon bulk Melting Point Djelel Djelloul
11:38 Re: [lammps-users] questions about fix ave/chunk density/number Stefan Paquay
11:17 [lammps-users] Position Available Gregory A. Voth
11:16 [lammps-users] Setting a time-dependent dipole moment Antonio Ortiz
10:23 Re: [lammps-users] NPT equilibration - very high pressure Kristof Bal
08:27 Re: [lammps-users] Fwd: doubt regarding values of 'drho' and 'dr' for .adp file for Ni-Fe system Steve Plimpton
08:23 Re: [lammps-users] Reg: LJ parameters for two same atom in different phase Steve Plimpton
08:17 Re: [lammps-users] ERROR: Subsequent read data induced too many bonds per atom Ivan Moncayo
08:07 Re: [lammps-users] restarting fix integrate npt Noam Bernstein
08:05 Re: [lammps-users] restarting fix integrate npt Axel Kohlmeyer
08:02 [lammps-users] restarting fix integrate npt Noam Bernstein
08:02 Re: [lammps-users] OPLSAA for lammps input using moltemplate Axel Kohlmeyer
08:00 Re: [lammps-users] Net force acting on region defined as wall using fix gran/wall/region Axel Kohlmeyer
07:57 Re: [lammps-users] no error and no output generated Axel Kohlmeyer
07:53 Re: [lammps-users] ill formed system with huge pressure Axel Kohlmeyer
07:51 Re: [lammps-users] NPT equilibration - very high pressure Axel Kohlmeyer
07:49 Re: [lammps-users] voronoi Axel Kohlmeyer
07:45 Re: [lammps-users] fix temp/berendsen Axel Kohlmeyer
07:32 [lammps-users] fix temp/berendsen SHABNAM GHAHREMANIAN
02:12 [lammps-users] Potential for Alloys with Iridium Lamm Gro
01:20 [lammps-users] voronoi Bom Salman

July 23, 2017
21:15 [lammps-users] ?????? Create ellipse region 709832702
20:12 Re: [lammps-users] Create ellipse region Axel Kohlmeyer
20:09 [lammps-users] Create ellipse region 709832702
12:51 [lammps-users] Fw: ill formed system with huge pressure Meral Sharkas
08:57 [lammps-users] ill formed system with huge pressure Meral Sharkas
08:05 [lammps-users] Fwd: doubt regarding values of 'drho' and 'dr' for .adp file for Ni-Fe system Anil Mangla
06:36 [lammps-users] NPT equilibration - very high pressure Meral Sharkas
06:04 [lammps-users] (no subject) mohammad amrolahi
03:41 [lammps-users] no error and no output generated Neda Rafiee

July 22, 2017
23:39 Re: [lammps-users] ERROR: Subsequent read data induced too many bonds per atom Amin Koochaki
18:56 [lammps-users] ERROR: Subsequent read data induced too many bonds per atom Ivan Moncayo
16:35 [lammps-users] Net force acting on region defined as wall using fix gran/wall/region Sonu Kumar
09:52 Re: [lammps-users] Using LAMMPS on Cloud Supercomputers Titusi Forum
09:46 Re: [lammps-users] Using LAMMPS on Cloud Supercomputers Titusi Forum
09:09 Re: [lammps-users] [EXTERNAL] Re: Hooke/Herz force and the problem of negative (attractive) forces Axel Kohlmeyer
04:31 [lammps-users] Reg: LJ parameters for two same atom in different phase Zeeshan Ahmed

July 21, 2017
22:24 Re: [lammps-users] [EXTERNAL] Re: Hooke/Herz force and the problem of negative (attractive) forces habib rahbari
22:12 Re: [lammps-users] [EXTERNAL] Re: Hooke/Herz force and the problem of negative (attractive) forces Axel Kohlmeyer
19:31 [lammps-users] OPLSAA for lammps input using moltemplate John Smith
16:12 Re: [lammps-users] [EXTERNAL] Re: Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Thompson, Aidan
15:45 Re: [lammps-users] Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Steve Plimpton
13:41 Re: [lammps-users] Bond quartic question Carsten Svaneborg
12:36 Re: [lammps-users] Using LAMMPS on Cloud Supercomputers Titusi Forum
10:45 Re: [lammps-users] Using LAMMPS on Cloud Supercomputers Rajeev Dhongar
09:37 Re: [lammps-users] adding energy to a single atom Fernanda S Teixeira
07:18 [lammps-users] doubt regarding values of 'drho' and 'dr' for .adp file for Ni-Fe system Anil Mangla
06:16 Re: [lammps-users] trouble using rigid bodies in simulation Axel Kohlmeyer
06:01 [lammps-users] trouble using rigid bodies in simulation surendra jain
05:23 Re: [lammps-users] Airebo potential units Kristof Bal
01:50 [lammps-users] Airebo potential units zhaoxiao@...4953...
00:20 [lammps-users] creating al2o3 nanoparticle Zeeshan Ahmed

July 20, 2017
22:27 Re: [lammps-users] [EXTERNAL] Re: Hooke/Herz force and the problem of negative (attractive) forces Axel Kohlmeyer
21:55 Re: [lammps-users] [EXTERNAL] Re: Hooke/Herz force and the problem of negative (attractive) forces habib rahbari
20:57 Re: [lammps-users] regarding scaling up LAMMPS on CPU/GPU Titusi Forum
19:22 [lammps-users] Using LAMMPS on Cloud Supercomputers Titusi Forum
15:52 Re: [lammps-users] Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Michael R Shirts
13:54 Re: [lammps-users] Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Michael R Shirts
13:11 Re: [lammps-users] Errors when define a region after reading a data file Axel Kohlmeyer
13:07 Re: [lammps-users] Errors when define a region after reading a data file Cong Dai
13:01 Re: [lammps-users] Errors when define a region after reading a data file Axel Kohlmeyer
12:45 [lammps-users] Errors when define a region after reading a data file Cong Dai
12:43 Re: [lammps-users] an Error when saving restart files Axel Kohlmeyer
11:56 [lammps-users] an Error when saving restart files Yutong Bi
09:12 [lammps-users] zero barrier from NEB calculations anyy zsj
08:10 Re: [lammps-users] Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Steve Plimpton
08:05 Re: [lammps-users] Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Steve Plimpton
07:58 Re: [lammps-users] Bond quartic question Steve Plimpton
07:39 Re: [lammps-users] Regarding the dissipated energy in granular simulation Steve Plimpton
07:20 [lammps-users] How to estimate time constant for thermostat (Berendsen, Langevin)? Christophe Ortiz
05:01 [lammps-users] TIP4P/ICE NIKIFORIDIS Vasileios
03:02 [lammps-users] Bond quartic question Carsten Svaneborg

July 19, 2017
17:36 Re: [lammps-users] region & group Lamm Gro
14:06 [lammps-users] questions about fix ave/chunk density/number ruiyan
13:17 [lammps-users] Issue with pressure control not giving the correct fluctuation properties with Lennard-Jones solids Michael R Shirts
12:51 [lammps-users] Regarding the dissipated energy in granular simulation saikat roy
12:33 [lammps-users] zero barrier from NEB calculations anyy zsj
10:53 Re: [lammps-users] Inquiry on LAMMPS special_bond and pair_style Axel Kohlmeyer
10:37 Re: [lammps-users] Inquiry on LAMMPS special_bond and pair_style MASATO KOIZUMI
10:21 Re: [lammps-users] Reflecting surfaces momentum conservation Steve Plimpton
10:00 Re: [lammps-users] adding energy to a single atom Axel Kohlmeyer
09:43 Re: [lammps-users] adding energy to a single atom Fernanda S Teixeira
07:37 Re: [lammps-users] region & group Anders Hafreager
07:37 Re: [lammps-users] MPI profiling HUILIN YE
07:20 Re: [lammps-users] MPI profiling Axel Kohlmeyer
07:03 [lammps-users] MPI profiling HUILIN YE
05:24 Re: [lammps-users] Question on: The results about coul interaction energy obtained by Lammps and MS are very different Axel Kohlmeyer
05:18 Re: [lammps-users] concatenating two systems Axel Kohlmeyer
04:53 [lammps-users] concatenating two systems Neda Rafiee
02:11 Re: [lammps-users] Reflecting surfaces momentum conservation Stefan Paquay
01:48 [lammps-users] region & group Lamm Gro
01:16 [lammps-users] Question on: The results about coul interaction energy obtained by Lammps and MS are very different sunny

July 18, 2017
22:32 Re: [lammps-users] Question about set up step potential in gcmc lammps Axel Kohlmeyer
21:44 Re: [lammps-users] Question about set up step potential in gcmc lammps vo thuy phuong Vo
21:07 [lammps-users] Postdoctoral Research Associate opening at the University of Massachusetts Boston Jason R. Green
15:46 Re: [lammps-users] ERROR while using custom MEAM potential file Axel Kohlmeyer
15:18 [lammps-users] ERROR while using custom MEAM potential file Singh, Navdeep
14:55 [lammps-users] Reflecting surfaces momentum conservation Vaidyanathan M.S
13:12 Re: [lammps-users] Error: All pair coeffs are not set Axel Kohlmeyer
12:38 Re: [lammps-users] Cannot open file data. Axel Kohlmeyer
12:32 [lammps-users] Cannot open file data. Ana Cristina Ramírez
12:12 Re: [lammps-users] [EXTERNAL] Re: GCMC with Reax Moore, Stan
11:32 Re: [lammps-users] Strange behavior of pressure Axel Kohlmeyer
11:26 Re: [lammps-users] Strange behavior of pressure Sandra Cristina Costa Prado
10:26 [lammps-users] Error: All pair coeffs are not set yang hong
09:41 Re: [lammps-users] [EXTERNAL] Re: GCMC with Reax Axel Kohlmeyer
08:10 Re: [lammps-users] fix halt with condition on derivative? Christophe Ortiz
08:04 Re: [lammps-users] fix halt with condition on derivative? Steve Plimpton
07:47 Re: [lammps-users] [EXTERNAL] Re: GCMC with Reax Sencer Selcuk
04:55 Re: [lammps-users] how to use VMD to better visulize the surface of a crystal Axel Kohlmeyer
04:52 Re: [lammps-users] how to use VMD to better visulize the surface of a crystal ruiyan
03:45 [lammps-users] eflux estimation in fix heat Daipayan Sarkar
02:07 [lammps-users] fix halt with condition on derivative? Christophe Ortiz

July 17, 2017
23:57 Re: [lammps-users] Question about set up step potential in gcmc lammps vo thuy phuong Vo
15:11 Re: [lammps-users] Problem with pair style interacting with neighbor list Axel Kohlmeyer
14:48 Re: [lammps-users] Strange behavior of pressure Axel Kohlmeyer
13:18 Re: [lammps-users] [EXTERNAL] Re: Cores and GPUs with Kokkos and CUDA James Kress
13:01 Re: [lammps-users] incorrect data file format Axel Kohlmeyer
12:24 Re: [lammps-users] [EXTERNAL] Re: Cores and GPUs with Kokkos and CUDA Moore, Stan
11:41 Re: [lammps-users] incorrect data file format John Smith
10:19 Re: [lammps-users] incorrect data file format Axel Kohlmeyer
10:15 [lammps-users] incorrect data file format John Smith
09:52 [lammps-users] Sandia Post-doc opening for SNAP interatomic potentials Thompson, Aidan
09:28 [lammps-users] Problem with pair style interacting with neighbor list Matthew Wander
08:23 Re: [lammps-users] [EXTERNAL] Re: GCMC with Reax Moore, Stan
08:00 Re: [lammps-users] Fwd: atoms lost even i used fix wall/reflact command Axel Kohlmeyer
07:49 [lammps-users] Fwd: atoms lost even i used fix wall/reflact command Mathur Nil
07:44 Re: [lammps-users] Fwd: Vashishta Potential vs Al.eam.alloy potential Zeeshan Ahmed
07:40 Re: [lammps-users] Fwd: Vashishta Potential vs Al.eam.alloy potential Steve Plimpton
07:29 Re: [lammps-users] Nanoindentation of Graphene Axel Kohlmeyer
07:28 [lammps-users] Strange behavior of pressure Sandra Cristina Costa Prado
07:23 Re: [lammps-users] Nanoindentation of Graphene Jit Sarkar
07:16 Re: [lammps-users] atoms lost even i used fix wall/reflact command Axel Kohlmeyer
06:50 [lammps-users] atoms lost even i used fix wall/reflact command Mathur Nil
06:35 Re: [lammps-users] adding energy to a single atom Fernanda S Teixeira
06:20 Re: [lammps-users] Question about set up step potential in gcmc lammps Axel Kohlmeyer
06:17 Re: [lammps-users] Question about set up step potential in gcmc lammps Axel Kohlmeyer
06:10 Re: [lammps-users] A weird bulk drift and a overestimated MSD at GPU run. Axel Kohlmeyer
06:06 Re: [lammps-users] Assigning BornMayer potential+ ZBL potential Meral Sharkas
06:03 Re: [lammps-users] Assigning BornMayer potential+ ZBL potential Axel Kohlmeyer
05:52 Re: [lammps-users] Nanoindentation of Graphene Axel Kohlmeyer
05:28 Re: [lammps-users] adding energy to a single atom Fernanda S Teixeira
04:07 Re: [lammps-users] Assigning BornMayer potential+ ZBL potential Meral Sharkas
02:42 [lammps-users] A weird bulk drift and a overestimated MSD at GPU run. 공과대학 기계공학과
01:36 Re: [lammps-users] Question about set up step potential in gcmc lammps vo thuy phuong Vo
00:14 Re: [lammps-users] Question about set up step potential in gcmc lammps vo thuy phuong Vo
00:03 Re: [lammps-users] Nanoindentation of Graphene Jit Sarkar

July 16, 2017
23:37 Re: [lammps-users] Nanoindentation of Graphene Axel Kohlmeyer
22:37 [lammps-users] Nanoindentation of Graphene Jit Sarkar
21:56 [lammps-users] Fwd: Vashishta Potential vs Al.eam.alloy potential Zeeshan Ahmed
21:34 Re: [lammps-users] GCMC with Reax Axel Kohlmeyer
20:38 [lammps-users] GCMC with Reax Sencer Selcuk
19:15 Re: [lammps-users] lammps-users Digest, Vol 134, Issue 53 Chowdhury, Sanjib Chandra
16:18 Re: [lammps-users] Which LAMMPS command can give me short range attractive force and long range (nearly) no interaction? Wusheng Zhang
16:16 Re: [lammps-users] Which LAMMPS command can give me short range attractive force and long range (nearly) no interaction? Axel Kohlmeyer
15:26 Re: [lammps-users] Which LAMMPS command can give me short range attractive force and long range (nearly) no interaction? Wusheng Zhang
15:14 Re: [lammps-users] Necking Axel Kohlmeyer
15:11 Re: [lammps-users] Necking Asadollahzadeh
15:09 Re: [lammps-users] Necking Axel Kohlmeyer
15:06 Re: [lammps-users] Necking Axel Kohlmeyer
15:02 Re: [lammps-users] Necking Asadollahzadeh
14:59 Re: [lammps-users] Necking Asadollahzadeh
14:54 Re: [lammps-users] Necking Axel Kohlmeyer
14:52 Re: [lammps-users] Energy Minimization Axel Kohlmeyer
14:50 Re: [lammps-users] Necking Asadollahzadeh
13:27 [lammps-users] Energy Minimization Meral Sharkas
13:20 Re: [lammps-users] reax/c with eam Axel Kohlmeyer
12:10 Re: [lammps-users] kspace_style Axel Kohlmeyer
12:09 Re: [lammps-users] Necking Axel Kohlmeyer
12:07 Re: [lammps-users] pair_style Axel Kohlmeyer
11:22 Re: [lammps-users] reax/c with eam Ray Shan
11:10 Re: [lammps-users] reax/c with eam Axel Kohlmeyer
09:46 Re: [lammps-users] reax/c with eam Ray Shan
01:21 [lammps-users] kspace_style SHABNAM GHAHREMANIAN
01:12 [lammps-users] pair_style SHABNAM GHAHREMANIAN

July 15, 2017
23:22 [lammps-users] Necking Asadollahzadeh
22:20 [lammps-users] reax/c with eam Subodh Tiwari
13:22 [lammps-users] Vashishta Potential vs Al.eam.alloy potential Zeeshan Ahmed
11:11 Re: [lammps-users] adding energy to a single atom Steve Plimpton
09:01 Re: [lammps-users] Fwd: Doubt regarding AlCu.adp file and how to create .adp file Axel Kohlmeyer
08:59 Re: [lammps-users] Al2O3 data file using Vashishta potential Axel Kohlmeyer
07:43 [lammps-users] Al2O3 data file using Vashishta potential Zeeshan Ahmed
06:52 [lammps-users] Fwd: Doubt regarding AlCu.adp file and how to create .adp file Anil Mangla
06:43 Re: [lammps-users] CG-graphene thermal conductivity simulation Axel Kohlmeyer
06:39 Re: [lammps-users] adding energy to a single atom Axel Kohlmeyer
06:19 Re: [lammps-users] adding energy to a single atom nandast

July 14, 2017
20:17 [lammps-users] CG-graphene thermal conductivity simulation Ziyu Cong
18:27 Re: [lammps-users] adding energy to a single atom Axel Kohlmeyer
18:22 Re: [lammps-users] couette flow with walls at different temperatures Axel Kohlmeyer
18:14 Re: [lammps-users] summing too many variables in a loop Mostafa Nejatolahi
18:05 Re: [lammps-users] summing too many variables in a loop Axel Kohlmeyer
17:40 [lammps-users] summing too many variables in a loop Mostafa Nejatolahi
15:46 [lammps-users] couette flow with walls at different temperatures m n
14:31 [lammps-users] adding energy to a single atom Fernanda S Teixeira
12:42 Re: [lammps-users] ERROR: All pair coeffs are not set (../pair.cpp:228) Axel Kohlmeyer
12:39 Re: [lammps-users] ERROR: All pair coeffs are not set (../pair.cpp:228) Axel Kohlmeyer
12:28 [lammps-users] ERROR: All pair coeffs are not set (../pair.cpp:228) Sharma MD
11:34 Re: [lammps-users] Replication command Thomas Asche
10:59 Re: [lammps-users] Replication command Axel Kohlmeyer
10:40 Re: [lammps-users] Replication command Meral Sharkas
08:43 Re: [lammps-users] Replication command Kristof Bal
08:30 Re: [lammps-users] Replication command Meral Sharkas
08:20 Re: [lammps-users] Replication command Meral Sharkas
07:59 Re: [lammps-users] change potential parameter by code Steve Plimpton
07:58 Re: [lammps-users] Replication command Kristof Bal
07:57 Re: [lammps-users] How to cancel atom_modify first and neigh_modify include commands? Steve Plimpton
07:54 Re: [lammps-users] change potential parameter by code Axel Kohlmeyer
07:52 Re: [lammps-users] Changing boundary conditions from periodic to non-periodic to simulate shock in a polymer Steve Plimpton
07:15 [lammps-users] change potential parameter by code ??????
07:05 Re: [lammps-users] WARNING: More than one compute coord/atom (../compute_coord_atom.cpp:105) Stefan Paquay
07:03 Re: [lammps-users] WARNING: More than one compute coord/atom (../compute_coord_atom.cpp:105) Stefan Paquay
06:08 Re: [lammps-users] Replication command Meral Sharkas
05:40 Re: [lammps-users] Replication command Axel Kohlmeyer
05:31 Re: [lammps-users] Replication command Meral Sharkas
05:03 Re: [lammps-users] Replication command Axel Kohlmeyer
05:01 Re: [lammps-users] BUG: atom->v and atom->x mixed up Axel Kohlmeyer
05:00 Re: [lammps-users] Replication command Meral Sharkas
04:47 [lammps-users] Replication command Meral Sharkas
04:09 [lammps-users] How to cancel atom_modify first and neigh_modify include commands? Christophe Ortiz
03:59 [lammps-users] BUG: atom->v and atom->x mixed up Frank Zack
02:46 [lammps-users] WARNING: More than one compute coord/atom (../compute_coord_atom.cpp:105) Jan Fikar
00:31 Re: [lammps-users] Out of range atoms - cannot compute PPPM: With rerun command Vishnu K

July 13, 2017
15:21 Re: [lammps-users] Changing boundary conditions from periodic to non-periodic to simulate shock in a polymer S. Ramaswami
13:45 Re: [lammps-users] Changing boundary conditions from periodic to non-periodic to simulate shock in a polymer Axel Kohlmeyer
12:59 [lammps-users] Changing boundary conditions from periodic to non-periodic to simulate shock in a polymer S. Ramaswami
05:14 Re: [lammps-users] Errors in lubricate/poly ? Ranga Radhakrishnan

July 12, 2017
22:51 [lammps-users] LAMMPS交流论坛 iSimuLy
21:45 Re: [lammps-users] Question about set up step potential in gcmc lammps Axel Kohlmeyer
21:39 Re: [lammps-users] Question about set up step potential in gcmc lammps vo thuy phuong Vo
20:38 Re: [lammps-users] minor propose changes to read-the-docs website Axel Kohlmeyer
20:14 [lammps-users] minor propose changes to read-the-docs website Quang Ha
14:56 Re: [lammps-users] Converting Aziz potential for He-He to lj/cut family Axel Kohlmeyer
14:41 [lammps-users] Converting Aziz potential for He-He to lj/cut family Afshin Arjangmehr
11:32 [lammps-users] ?????? ?????? (no subject) htc
09:59 Re: [lammps-users] 回复: (no subject) Axel Kohlmeyer
09:28 [lammps-users] ?????? (no subject) htc
07:24 Re: [lammps-users] (no subject) Axel Kohlmeyer
02:12 [lammps-users] (no subject) htc

July 11, 2017
17:49 Re: [lammps-users] Difference between box's region & atoms' region Axel Kohlmeyer
17:45 [lammps-users] Difference between box's region & atoms' region Asadollahzadeh
13:44 Re: [lammps-users] Dumping Modified Copies of the Current System State Without Restart Files Axel Kohlmeyer
13:26 Re: [lammps-users] problems of compiling with multiple gpu types Moore, Stan
13:24 Re: [lammps-users] use kokkos in lammps library Moore, Stan
12:54 Re: [lammps-users] (no subject) Axel Kohlmeyer
12:45 [lammps-users] Dumping Modified Copies of the Current System State Without Restart Files Ian Chesser
11:57 [lammps-users] (no subject) htc
11:06 Re: [lammps-users] DLC film quench Axel Kohlmeyer
10:50 Re: [lammps-users] 回复: 回复: about the command "fix rigid/nve/small molecule" Axel Kohlmeyer
10:47 Re: [lammps-users] about the command "dump custom"and"dump local" Axel Kohlmeyer
10:41 [lammps-users] about the command "dump custom"and"dump local" htc
10:34 [lammps-users] 回复: 回复: about the command "fix rigid/nve/small molecule" htc
10:19 Re: [lammps-users] 回复: about the command "fix rigid/nve/small molecule" Axel Kohlmeyer
09:05 [lammps-users] DLC film quench 詹胜鹏
08:06 [lammps-users] ?????? about the command "fix rigid/nve/small molecule" htc
07:50 Re: [lammps-users] use kokkos in lammps library Steve Plimpton
07:39 Re: [lammps-users] about the command "fix rigid/nve/small molecule" Axel Kohlmeyer
07:34 Re: [lammps-users] about the command "fix rigid/nve/small molecule" Axel Kohlmeyer
07:23 [lammps-users] about the command "fix rigid/nve/small molecule" htc
06:59 Re: [lammps-users] Fw: Reading Energy in Custom Pair Function Axel Kohlmeyer
06:44 Re: [lammps-users] How to accelerate the calculation speed by using existing hardware ? Axel Kohlmeyer
06:43 Re: [lammps-users] use kokkos in lammps library Axel Kohlmeyer
04:35 Re: [lammps-users] Modifying LAMMPS / accessing variable from another fix Axel Kohlmeyer
02:36 [lammps-users] Modifying LAMMPS / accessing variable from another fix ONOFRIO, Nicolas [AP]
01:12 [lammps-users] use kokkos in lammps library Duan, Zhiyao

July 10, 2017
23:41 Re: [lammps-users] problems of compiling with multiple gpu types Chiang Yi
21:09 Re: [lammps-users] How to accelerate the calculation speed by using existing hardware ? 王淑婷
20:50 Re: [lammps-users] Fw: Reading Energy in Custom Pair Function S M
14:20 Re: [lammps-users] [EXTERNAL] Re: feature request: hybrid monte carlo Efrem Braun
13:34 Re: [lammps-users] soft potential Axel Kohlmeyer
12:42 [lammps-users] soft potential Monir Hosseini Anvari
12:29 Re: [lammps-users] compute temp without removing the bias Mostafa Nejatolahi
12:07 Re: [lammps-users] compute temp without removing the bias Axel Kohlmeyer
11:55 Re: [lammps-users] [EXTERNAL] Can the sigma bong, the Pi bond and other bond be distinguished and output in REAXFF? Thompson, Aidan
11:52 Re: [lammps-users] compute temp without removing the bias Mostafa Nejatolahi
11:15 Re: [lammps-users] [EXTERNAL] Re: feature request: hybrid monte carlo Thompson, Aidan
11:06 Re: [lammps-users] compute temp without removing the bias Axel Kohlmeyer
11:05 Re: [lammps-users] [EXTERNAL] Fwd: Modify pressure Thompson, Aidan
10:51 Re: [lammps-users] [EXTERNAL] Fwd: Selection of chemical potential or excess chemical potential in fix gcmc Thompson, Aidan
10:36 Re: [lammps-users] compute temp without removing the bias Mostafa Nejatolahi
08:09 Re: [lammps-users] problems of compiling with multiple gpu types Steve Plimpton
08:06 Re: [lammps-users] want to fix lattice vector Steve Plimpton
07:47 Re: [lammps-users] Massless atom with charge Axel Kohlmeyer
07:12 [lammps-users] Massless atom with charge surendra jain
05:23 Re: [lammps-users] Friction coefient calculation getting error in thermo style Axel Kohlmeyer
05:21 Re: [lammps-users] Can the sigma bong, the Pi bond and other bond be distinguished and output in REAXFF? Axel Kohlmeyer
05:14 Re: [lammps-users] want to fix lattice vector Axel Kohlmeyer
05:10 Re: [lammps-users] compute temp without removing the bias Axel Kohlmeyer
05:08 Re: [lammps-users] Question about set up step potential in gcmc lammps Axel Kohlmeyer
05:04 Re: [lammps-users] How to accelerate the calculation speed by using existing hardware ? Axel Kohlmeyer
05:00 [lammps-users] Friction coefient calculation getting error in thermo style tanni bhattacharjee
04:57 Re: [lammps-users] about shake atoms error Axel Kohlmeyer
03:08 [lammps-users] problems of compiling with multiple gpu types Chiang Yi

July 09, 2017
23:14 [lammps-users] Can the sigma bong, the Pi bond and other bond be distinguished and output in REAXFF? ws930819
21:47 [lammps-users] Question about set up step potential in gcmc lammps vo thuy phuong Vo
20:40 [lammps-users] How to accelerate the calculation speed by using existing hardware ? 王淑婷
14:58 [lammps-users] about shake atoms error reza N.Z
09:48 Re: [lammps-users] In which situations v_A or $A should be used for an variable? JWG
05:00 [lammps-users] In which situations v_A or $A should be used for an variable? JWG

July 08, 2017
18:46 Re: [lammps-users] feature request: hybrid monte carlo Efrem Braun
16:50 Re: [lammps-users] Different cutoff for hybrid/overly coul/dsf Kota Ito
15:47 [lammps-users] compute temp without removing the bias Mostafa Nejatolahi
07:05 Re: [lammps-users] Binding Energy by Reaxff Lamm Gro
07:02 Re: [lammps-users] system validation Meral Sharkas
06:52 [lammps-users] want to fix lattice vector Mathur Nil

July 07, 2017
22:37 Re: [lammps-users] Suggestion for adding a new fix command iSimuLy
22:25 Re: [lammps-users] Suggestion for adding a new fix command Wusheng Zhang
22:16 [lammps-users] Suggestion for adding a new fix command Wende Tian
21:57 Re: [lammps-users] Binding Energy by Reaxff JeJoon Yeon
20:23 Re: [lammps-users] Binding Energy by Reaxff Lamm Gro
15:21 Re: [lammps-users] Binding Energy by Reaxff Ray Shan
14:09 Re: [lammps-users] feature request: hybrid monte carlo Ana Silveira
13:17 Re: [lammps-users] problem in combining dump file Axel Kohlmeyer
13:06 Re: [lammps-users] problem in combining dump file Mathur Nil
12:53 Re: [lammps-users] damp fix press/berendsen and fix langevin Axel Kohlmeyer
11:53 Re: [lammps-users] feature request: hybrid monte carlo Efrem Braun
10:41 Re: [lammps-users] damp fix press/berendsen and fix langevin ruiyan
08:56 Re: [lammps-users] damp fix press/berendsen and fix langevin Axel Kohlmeyer
08:42 Re: [lammps-users] inconsistent vdWaals-parameters Force field parameters for element CA Kristof Bal
08:42 Re: [lammps-users] feature request: hybrid monte carlo Steve Plimpton
08:42 Re: [lammps-users] Different cutoff for hybrid/overly coul/dsf Axel Kohlmeyer
08:37 Re: [lammps-users] Different cutoff for hybrid/overly coul/dsf Steve Plimpton
08:33 Re: [lammps-users] Difference in results for atomstyle charge and dipole Steve Plimpton
08:32 Re: [lammps-users] feature request: hybrid monte carlo Efrem Braun
08:29 Re: [lammps-users] Ncount bin sensitivity Steve Plimpton
08:26 Re: [lammps-users] feature request: hybrid monte carlo Axel Kohlmeyer
08:26 Re: [lammps-users] system validation Steve Plimpton
08:06 [lammps-users] inconsistent vdWaals-parameters Force field parameters for element CA 11637044
07:57 Re: [lammps-users] Regarding examples/user/diffraction results for XRD Ni and my result Axel Kohlmeyer
07:34 [lammps-users] Regarding examples/user/diffraction results for XRD Ni and my result Anil Mangla
06:55 Re: [lammps-users] Different slope in stress_strain curve Stefan Paquay
06:10 Re: [lammps-users] Different slope in stress_strain curve Asadollahzadeh
05:57 [lammps-users] feature request: hybrid monte carlo Efrem Braun
05:06 [lammps-users] damp fix press/berendsen and fix langevin ruiyan
04:41 Re: [lammps-users] About thermostat layer in the indentation Axel Kohlmeyer
02:26 [lammps-users] Binding Energy by Reaxff Lamm Gro
02:08 [lammps-users] About thermostat layer in the indentation shjeong

July 06, 2017
23:47 [lammps-users] Different slope in stress_strain curve Asadollahzadeh
19:42 Re: [lammps-users] request: allow fix bond/break to change atom types Andrew Jewett
17:06 [lammps-users] Different cutoff for hybrid/overly coul/dsf Kota Ito
16:39 Re: [lammps-users] Installing lammps on a Mac using homebrew Axel Kohlmeyer
16:37 Re: [lammps-users] Difference in results for atomstyle charge and dipole Axel Kohlmeyer
16:18 Re: [lammps-users] Difference in results for atomstyle charge and dipole John Smith
15:47 Re: [lammps-users] Difference in results for atomstyle charge and dipole John Smith
15:43 Re: [lammps-users] determination of structure after NPT run abrar Quadery
15:32 Re: [lammps-users] Difference in results for atomstyle charge and dipole Axel Kohlmeyer
15:29 Re: [lammps-users] Difference in results for atomstyle charge and dipole John Smith
15:08 [lammps-users] Installing lammps on a Mac using homebrew Padmanabhan, Venkat
14:18 Re: [lammps-users] Difference in results for atomstyle charge and dipole Axel Kohlmeyer
14:14 Re: [lammps-users] Difference in results for atomstyle charge and dipole John Smith
13:56 Re: [lammps-users] ERROR: Unknown compute style (../modify.cpp:964) Axel Kohlmeyer
13:43 Re: [lammps-users] Ncount bin sensitivity Eric Murphy
13:38 Re: [lammps-users] Coul/cut gradients question Axel Kohlmeyer
12:29 Re: [lammps-users] Difference in results for atomstyle charge and dipole Axel Kohlmeyer
12:28 Re: [lammps-users] I fix the sph-multiphase + some extra question Axel Kohlmeyer
12:27 Re: [lammps-users] Difference in results for atomstyle charge and dipole John Smith
12:27 Re: [lammps-users] Difference in results for atomstyle charge and dipole John Smith
11:25 Re: [lammps-users] Ncount bin sensitivity Roberts, Andrew
10:51 Re: [lammps-users] Coul/cut gradients question Matthew Wander
10:32 [lammps-users] I fix the sph-multiphase + some extra question Quang Ha
10:01 Re: [lammps-users] How can I realize Langevin Dynamics without inertia (Brownian Dynamics) by fix langevin or other command? Eric Murphy
09:34 [lammps-users] system validation Meral Sharkas
09:02 Re: [lammps-users] ERROR: Unknown compute style (../modify.cpp:964) Anil Mangla
09:01 [lammps-users] ERROR: Unknown compute style (../modify.cpp:964) Anil Mangla
08:48 Re: [lammps-users] 回复: 回复: some questions about serial and parallel environments Axel Kohlmeyer
08:40 Re: [lammps-users] Transition from EEM to QEq when implementing ReaxFF in LAMMPS Ray Shan
08:31 Re: [lammps-users] How can I realize Langevin Dynamics without inertia (Brownian Dynamics) by fix langevin or other command? Stefan Paquay
08:30 [lammps-users] ?????? ?????? some questions about serial and parallel environments htc
08:30 Re: [lammps-users] histogram of dihedral angles Axel Kohlmeyer
08:24 Re: [lammps-users] determination of structure after NPT run Axel Kohlmeyer
08:22 Re: [lammps-users] histogram of dihedral angles Steve Plimpton
08:20 Re: [lammps-users] determination of structure after NPT run Steve Plimpton
08:19 Re: [lammps-users] request: allow fix bond/break to change atom types Steve Plimpton
08:17 Re: [lammps-users] Coul/cut gradients question Axel Kohlmeyer
08:15 Re: [lammps-users] 回复: some questions about serial and parallel environments Axel Kohlmeyer
08:11 Re: [lammps-users] How to calculate: J-integral, strain energy release rate, and crack size? Steve Plimpton
08:08 Re: [lammps-users] How to implement a new method for determining MEPs? Steve Plimpton
08:08 [lammps-users] Coul/cut gradients question Matthew Wander
08:03 Re: [lammps-users] Fw: request: allow fix bond/break to change atom types Jacob Gissinger
07:43 [lammps-users] ?????? some questions about serial and parallel environments htc
07:32 [lammps-users] histogram of dihedral angles Nima Emadi
07:01 Re: [lammps-users] Transition from EEM to QEq when implementing ReaxFF in LAMMPS Georg Heinze

July 05, 2017
22:52 [lammps-users] determination of structure after NPT run abrar Quadery
20:58 Re: [lammps-users] request: allow fix bond/break to change atom types Andrew Jewett
18:24 [lammps-users] How can I realize Langevin Dynamics without inertia (Brownian Dynamics) by fix langevin or other command? Wusheng Zhang
17:05 Re: [lammps-users] Difference in results for atomstyle charge and dipole Axel Kohlmeyer
16:39 [lammps-users] Difference in results for atomstyle charge and dipole John Smith
16:18 Re: [lammps-users] Assigning MPI jobs to different coprocessor Axel Kohlmeyer
16:13 Re: [lammps-users] Radiation damage post processing Axel Kohlmeyer
15:45 [lammps-users] Assigning MPI jobs to different coprocessor Xiaoyu Wang
15:18 Re: [lammps-users] About forming bond to get a cross link Axel Kohlmeyer
15:14 Re: [lammps-users] Ice Formation Axel Kohlmeyer
15:09 [lammps-users] About forming bond to get a cross link Arun Bikram Thapa
15:07 [lammps-users] Radiation damage post processing Meral Sharkas
14:30 Re: [lammps-users] Ice Formation Sridhar,S Arun Srikant
13:40 Re: [lammps-users] Ncount bin sensitivity Eric Murphy
13:33 Re: [lammps-users] How to calculate: J-integral, strain energy release rate, and crack size? Mohammad Reza Zamani Kouhpanji
13:31 [lammps-users] Ice Formation Pakhomenko, Evgeny
10:51 Re: [lammps-users] Transition from EEM to QEq when implementing ReaxFF in LAMMPS Ray Shan
10:48 Re: [lammps-users] xrd , ERROR: Unknown compute style (../modify.cpp:964) Stefan Paquay
10:45 Re: [lammps-users] xrd , ERROR: Unknown compute style (../modify.cpp:964) Stefan Paquay
10:16 [lammps-users] xrd , ERROR: Unknown compute style (../modify.cpp:964) Anil Mangla
09:18 Re: [lammps-users] Ncount bin sensitivity Roberts, Andrew
08:36 Re: [lammps-users] How to implement a new method for determining MEPs? Alfonso Gijón
08:03 Re: [lammps-users] request: allow fix bond/break to change atom types Steve Plimpton
07:36 [lammps-users] request: allow fix bond/break to change atom types Andrew Jewett
07:10 Re: [lammps-users] Cannot use neigh_modify exclude with GPU neighbor builds Anders Hafreager
06:03 Re: [lammps-users] (no subject) Axel Kohlmeyer
05:57 Re: [lammps-users] Cannot use neigh_modify exclude with GPU neighbor builds Christophe Ortiz
05:54 Re: [lammps-users] regarding scaling up LAMMPS on CPU/GPU Axel Kohlmeyer
05:28 Re: [lammps-users] Infused Rigid Particles moves diagonally Axel Kohlmeyer
04:54 [lammps-users] Cannot use neigh_modify exclude with GPU neighbor builds Christophe Ortiz
03:45 Re: [lammps-users] (no subject) PRASAD RAMA

July 04, 2017
23:35 [lammps-users] (no subject) neda Sanchuli
22:50 [lammps-users] Infused Rigid Particles moves diagonally rofiques salehin
20:47 Re: [lammps-users] why still Unknown compute style when using compute voronoi/atom after voronoi has been installed in lammps JWG
18:32 Re: [lammps-users] How to calculate: J-integral, strain energy release rate, and crack size? Steve Plimpton
18:29 Re: [lammps-users] The force in fix indent Steve Plimpton
18:27 Re: [lammps-users] Regarding the tangential force in granular simulation when it slips Steve Plimpton
16:50 Re: [lammps-users] (no subject) Sridhar,S Arun Srikant
11:19 [lammps-users] (no subject) neda Sanchuli
10:38 [lammps-users] NANOMACHINING Abdulkadir, Lukman, (Mr) (s215102134)
10:37 [lammps-users] regarding scaling up LAMMPS on CPU/GPU Quang Ha
09:52 Re: [lammps-users] How to calculate: J-integral, strain energy release rate, and crack size? Axel Kohlmeyer
09:42 Re: [lammps-users] Solid state materials combustion Axel Kohlmeyer
09:37 Re: [lammps-users] Different outcomes with same *.data & *.in while changing the parallel core numbers Axel Kohlmeyer
09:28 Re: [lammps-users] The force in fix indent Axel Kohlmeyer
09:24 Re: [lammps-users] Phonon transmission in a mass-spring system Axel Kohlmeyer
09:21 Re: [lammps-users] why still Unknown compute style when using compute voronoi/atom after voronoi has been installed in lammps Axel Kohlmeyer
09:20 Re: [lammps-users] some questions about serial and parallel environments Axel Kohlmeyer
07:55 [lammps-users] some questions about serial and parallel environments htc
05:43 Re: [lammps-users] why still Unknown compute style when using compute voronoi/atom after voronoi has been installed in lammps JWG
05:31 [lammps-users] Regarding the tangential force in granular simulation when it slips saikat roy
05:20 [lammps-users] Phonon transmission in a mass-spring system Sen Gupta, Ashim
05:02 [lammps-users] The force in fix indent 万 京
03:43 [lammps-users] Fwd: Setting temperature during the pure shear's run Asadollahzadeh

July 03, 2017
23:39 [lammps-users] Different outcomes with same *.data & *.in while changing the parallel core numbers 高瞻
22:55 [lammps-users] why still Unknown compute style when using compute voronoi/atom after voronoi has been installed in lammps JWG
22:13 [lammps-users] How to calculate: J-integral, strain energy release rate, and crack size? Mohammad Reza Zamani Kouhpanji
19:20 Re: [lammps-users] Setting temperature during the pure shear's run Asadollahzadeh
18:46 [lammps-users] Solid state materials combustion renefbg
18:02 Re: [lammps-users] [EXTERNAL] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS Steve Plimpton
17:59 Re: [lammps-users] Ncount bin sensitivity Steve Plimpton
14:54 Re: [lammps-users] Installation of space package Axel Kohlmeyer
14:41 Re: [lammps-users] Installation of space package Carlos Azael Alvarez Zambrano
14:37 Re: [lammps-users] Installation of space package Axel Kohlmeyer
14:36 Re: [lammps-users] Installation of space package Stefan Paquay
14:32 [lammps-users] Installation of space package Carlos Azael Alvarez Zambrano
13:13 Re: [lammps-users] [EXTERNAL] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS James Kress
10:38 Re: [lammps-users] Setting temperature during the pure shear's run Axel Kohlmeyer
10:30 Re: [lammps-users] Setting temperature during the pure shear's run Asadollahzadeh
09:40 Re: [lammps-users] Ncount bin sensitivity Axel Kohlmeyer
08:47 Re: [lammps-users] [EXTERNAL] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS Steve Plimpton
08:39 Re: [lammps-users] [EXTERNAL] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS Moore, Stan
08:36 Re: [lammps-users] Fw: Reading Energy in Custom Pair Function Steve Plimpton
07:43 Re: [lammps-users] Setting temperature during the pure shear's run Axel Kohlmeyer
07:34 Re: [lammps-users] Metal based nanofluid thermal conductivity through MD Axel Kohlmeyer
07:22 Re: [lammps-users] Reg:LJ potential parameters at high temperature and pressure (phase change) Axel Kohlmeyer
07:18 Re: [lammps-users] Fwd: Doubt in LAMMPS: Loops and incrementing variables Axel Kohlmeyer
06:28 [lammps-users] Metal based nanofluid thermal conductivity through MD Zeeshan Ahmed
06:18 Re: [lammps-users] Transition from EEM to QEq when implementing ReaxFF in LAMMPS Georg Heinze
06:14 [lammps-users] Reg:LJ potential parameters at high temperature and pressure (phase change) Zeeshan Ahmed
05:41 Re: [lammps-users] Question on: ReaxFF + Fix deposit + Molecule Axel Kohlmeyer
04:12 [lammps-users] Setting temperature during the pure shear's run Asadollahzadeh

July 02, 2017
23:28 Re: [lammps-users] Fwd: Doubt in LAMMPS: Loops and incrementing variables ankur agrawal
23:26 [lammps-users] Question on: ReaxFF + Fix deposit + Molecule Cheng Liu
22:09 Re: [lammps-users] Fwd: Doubt in LAMMPS: Loops and incrementing variables Axel Kohlmeyer
22:05 Re: [lammps-users] Accessing etotal compute Axel Kohlmeyer
21:50 Re: [lammps-users] Accessing etotal compute ankur agrawal
21:49 Re: [lammps-users] Accessing etotal compute ankur agrawal
21:46 Re: [lammps-users] Accessing etotal compute Axel Kohlmeyer
21:44 Re: [lammps-users] Accessing etotal compute Axel Kohlmeyer
21:32 Re: [lammps-users] Accessing etotal compute ankur agrawal
14:05 Re: [lammps-users] Fw: Reading Energy in Custom Pair Function S M
11:54 Re: [lammps-users] Accessing etotal compute sanat tiwari
10:11 [lammps-users] Accessing etotal compute ankur agrawal
08:24 Re: [lammps-users] Fwd: Tersoff vs Vashishta potential Anders Hafreager
07:56 [lammps-users] Fwd: Doubt in LAMMPS: Loops and incrementing variables ankur agrawal
04:28 Re: [lammps-users] The whole system will rotate around Z axis Axel Kohlmeyer
01:14 Re: [lammps-users] [EXTERNAL] Fwd: Temperature control in fix gcmc with fix rigid/nvt/small Youzhi Hao
00:43 Re: [lammps-users] The whole system will rotate around Z axis Asadollahzadeh

July 01, 2017
17:41 [lammps-users] Ncount bin sensitivity Roberts, Andrew
16:38 Re: [lammps-users] Fw: Reading Energy in Custom Pair Function Axel Kohlmeyer
15:47 [lammps-users] Fw: Reading Energy in Custom Pair Function S M
10:40 [lammps-users] Verify hydrogen bond energy and van der Waals energy using Reax/c potential George Ray
10:04 Re: [lammps-users] Errors in lubricate/poly ? Ranga Radhakrishnan
07:19 Re: [lammps-users] Fwd: Tersoff vs Vashishta potential zhen xue
06:33 Re: [lammps-users] Regarding interaction energy between copper and carbon dioxide Sridhar,S Arun Srikant
06:33 Re: [lammps-users] Regarding interaction energy between copper and carbon dioxide Axel Kohlmeyer
03:37 [lammps-users] Regarding interaction energy between copper and carbon dioxide Zeeshan Ahmed
03:29 Re: [lammps-users] How the Pair_modify mix command work? Sridhar,S Arun Srikant
03:26 Re: [lammps-users] How the Pair_modify mix command work? Sridhar,S Arun Srikant

June 30, 2017
21:59 [lammps-users] How the Pair_modify mix command work? Jeams Anderson
14:31 Re: [lammps-users] intramolecular interactions Sridhar,S Arun Srikant
13:28 Re: [lammps-users] [EXTERNAL] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS Thompson, Aidan
13:00 Re: [lammps-users] intramolecular interactions jo jo
12:42 [lammps-users] intramolecular interactions jo jo
12:16 [lammps-users] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS James Kress
12:12 Re: [lammps-users] [EXTERNAL] Re: pair_style polymorphic command Zhou, Xiaowang
12:09 Re: [lammps-users] Define average density during simulation alberto
11:05 Re: [lammps-users] Fwd: Tersoff vs Vashishta potential Anders Hafreager
09:48 [lammps-users] High hydrogen bond energy and van der Waals energy using Reax/c potential George Ray
09:31 Re: [lammps-users] Thole damping function Steve Plimpton
09:29 Re: [lammps-users] Question associated with compute group/group and ave/time Axel Kohlmeyer
09:28 Re: [lammps-users] Fwd: Tersoff vs Vashishta potential Steve Plimpton
09:25 Re: [lammps-users] fix_modify for fix indent Steve Plimpton
09:19 Re: [lammps-users] pair_style polymorphic command Steve Plimpton
09:18 Re: [lammps-users] pair_style nb3b/harmonic implementation vs documentation Axel Kohlmeyer
09:15 Re: [lammps-users] About shearing simulation Steve Plimpton
09:12 Re: [lammps-users] Problem with TACF results Steve Plimpton
09:12 Re: [lammps-users] He_He_JW2013.table Steve Plimpton
09:09 Re: [lammps-users] Define average density during simulation Steve Plimpton
09:03 Re: [lammps-users] How to implement a new method for determining MEPs? Axel Kohlmeyer
09:02 [lammps-users] pair_style nb3b/harmonic implementation vs documentation Mordechai Kornbluth
08:18 Re: [lammps-users] Errors in lubricate/poly ? Heine, David R
05:37 Re: [lammps-users] The whole system will rotate around Z axis Axel Kohlmeyer
04:25 [lammps-users] How to implement a new method for determining MEPs? Alfonso Gijón
03:35 [lammps-users] Question associated with compute group/group and ave/time Jiawei Zhao Zhao
03:29 [lammps-users] Problem with free surface kamalakshi G

June 29, 2017
20:44 [lammps-users] Thole damping function jo jo
16:05 Re: [lammps-users] Semi-Flexible polymers in 2D Trung Nguyen
14:07 Re: [lammps-users] Applying strain to fcc gold modeled using lennard jones potential at 50 kelvin Axel Kohlmeyer
13:46 Re: [lammps-users] How can I change the pair_coeff so that when two spheres just touch each other, they are at the bottom of LJ potential curve? Axel Kohlmeyer
13:40 [lammps-users] Fwd: Tersoff vs Vashishta potential Zhen xu
13:23 [lammps-users] How can I change the pair_coeff so that when two spheres just touch each other, they are at the bottom of LJ potential curve? Wusheng Zhang
12:15 Re: [lammps-users] Applying strain to fcc gold modeled using lennard jones potential at 50 kelvin melika_ bm85
11:30 Re: [lammps-users] parallel implementation Ray Shan
09:08 [lammps-users] parallel implementation Quang Ha
07:34 Re: [lammps-users] The whole system will rotate around Z axis Axel Kohlmeyer
07:34 [lammps-users] fix_modify for fix indent JWG
07:02 [lammps-users] The whole system will rotate around Z axis Asadollahzadeh
05:53 Re: [lammps-users] GPU for granular simulations Axel Kohlmeyer
05:51 Re: [lammps-users] GPU for granular simulations habib rahbari
05:46 Re: [lammps-users] The whole system will rotate Axel Kohlmeyer
05:44 Re: [lammps-users] GPU for granular simulations Axel Kohlmeyer
04:07 Re: [lammps-users] lammps-users Digest, Vol 133, Issue 118 alberto
00:04 [lammps-users] The whole system will rotate Asadollahzadeh

June 28, 2017
20:28 [lammps-users] GPU for granular simulations habib rahbari
19:37 Re: [lammps-users] Fwd: Re: Problem installing lammps-1Feb14 in Ubuntu 16.04 Axel Kohlmeyer
18:16 [lammps-users] Fwd: Re: Problem installing lammps-1Feb14 in Ubuntu 16.04 Carlos Azael Alvarez Zambrano
18:12 Re: [lammps-users] How can I update LAMMPS via homebrew and git? Wusheng Zhang
18:06 Re: [lammps-users] How can I update LAMMPS via homebrew and git? Axel Kohlmeyer
17:57 Re: [lammps-users] Problem installing lammps-1Feb14 in Ubuntu 16.04 Axel Kohlmeyer
17:08 [lammps-users] How can I update LAMMPS via homebrew and git? Wusheng Zhang
16:36 Re: [lammps-users] [EXTERNAL] Fwd: Temperature control in fix gcmc with fix rigid/nvt/small Thompson, Aidan
16:28 [lammps-users] Problem installing lammps-1Feb14 in Ubuntu 16.04 Carlos Azael Alvarez Zambrano
15:08 Re: [lammps-users] question regarding post-processing for LAMMPS output Axel Kohlmeyer
13:44 [lammps-users] question regarding post-processing for LAMMPS output Quang Ha
11:53 Re: [lammps-users] Setting per-atom masses with fix property/atom rmass Axel Kohlmeyer
10:59 Re: [lammps-users] Setting per-atom masses with fix property/atom rmass Joshua Moore
10:52 Re: [lammps-users] Errors in lubricate/poly ? Ranga Radhakrishnan
09:39 Re: [lammps-users] adding my personal package within LAMMPS Axel Kohlmeyer
09:18 Re: [lammps-users] adding my personal package within LAMMPS Quang Ha
08:48 Re: [lammps-users] Binding energy Axel Kohlmeyer
08:27 Re: [lammps-users] adding my personal package within LAMMPS Axel Kohlmeyer
07:55 [lammps-users] adding my personal package within LAMMPS Quang Ha
07:51 Re: [lammps-users] Errors in lubricate/poly ? Heine, David R
07:37 [lammps-users] Binding energy El koraychy El yakout
04:32 Re: [lammps-users] 回复: some questions about ellipsoid Axel Kohlmeyer
04:09 Re: [lammps-users] Setting per-atom masses with fix property/atom rmass Axel Kohlmeyer
04:07 [lammps-users] atom deposition_segmentation fault (core dumped) Gaoyang
04:03 Re: [lammps-users] problem for using fix nve & fix aveforce Axel Kohlmeyer
03:59 [lammps-users] 回复: some questions about ellipsoid htc

June 27, 2017
23:00 [lammps-users] problem for using fix nve & fix aveforce Rouhollah Mirzaamiri
19:16 [lammps-users] Setting per-atom masses with fix property/atom rmass Joshua Moore
14:48 [lammps-users] pair_style polymorphic command Samantha Walker
14:02 Re: [lammps-users] Considering pH effect in LAMMPS Axel Kohlmeyer
13:50 Re: [lammps-users] Considering pH effect in LAMMPS Amin Koochaki
12:38 Re: [lammps-users] Problem with ave/time and ave/chunck Axel Kohlmeyer
12:37 Re: [lammps-users] Kokkos Reax Package Development Plan James Kress
12:20 Re: [lammps-users] Regarding force on one group due to another Axel Kohlmeyer
12:19 Re: [lammps-users] Kokkos Reax Package Development Plan Thompson, Aidan
11:19 Re: [lammps-users] Regarding force on one group due to another Sharma MD
11:19 Re: [lammps-users] Problem with mapping atoms in custom LJ potential Ankit Gupta
11:16 Re: [lammps-users] Kokkos Reax Package Development Plan Moore, Stan
10:49 Re: [lammps-users] Problem with ave/time and ave/chunck Hasan, Mohammad [mihasan]
10:32 Re: [lammps-users] [EXTERNAL] Fwd: Assigning BornMayer potential+ ZBL potential Thompson, Aidan
10:27 Re: [lammps-users] [EXTERNAL] Fwd: EAM/alloy cutoff with zbl spline Thompson, Aidan
09:12 Re: [lammps-users] Problem with ave/time and ave/chunck Axel Kohlmeyer
09:11 [lammps-users] About shearing simulation wangfan05
09:03 Re: [lammps-users] melting gold Axel Kohlmeyer
08:57 [lammps-users] Problem with ave/time and ave/chunck Hasan, Mohammad [mihasan]
08:43 [lammps-users] melting gold Maryam Alqassimi
08:12 Re: [lammps-users] Semi-Flexible polymers in 2D Stefan Paquay
07:38 [lammps-users] He_He_JW2013.table 吳 政倫
07:30 [lammps-users] Problem with TACF results GODEY , François
07:19 Re: [lammps-users] some questions about ellipsoid Axel Kohlmeyer
07:02 [lammps-users] some questions about ellipsoid htc
06:40 Re: [lammps-users] Considering pH effect in LAMMPS Axel Kohlmeyer
06:39 Re: [lammps-users] Problem with mapping atoms in custom LJ potential Axel Kohlmeyer
06:33 [lammps-users] Considering pH effect in LAMMPS Amin Koochaki
06:29 Re: [lammps-users] Problem with mapping atoms in custom LJ potential Ankit Gupta
06:25 Re: [lammps-users] Moire potential implementation Axel Kohlmeyer
06:17 Re: [lammps-users] introduce random particles at interface to model growth Axel Kohlmeyer
06:15 Re: [lammps-users] Applying strain to fcc gold modeled using lennard jones potential at 50 kelvin Axel Kohlmeyer
06:15 Re: [lammps-users] lammps-users Digest, Vol 133, Issue 109 Agilio Padua
06:11 Re: [lammps-users] Free energy of water Axel Kohlmeyer
05:47 Re: [lammps-users] Problem with mapping atoms in custom LJ potential Axel Kohlmeyer
04:34 [lammps-users] Problem with mapping atoms in custom LJ potential Ankit Gupta
04:07 Re: [lammps-users] Free energy of water Lamm Gro
03:07 Re: [lammps-users] Moire potential implementation Nicolas Leconte
02:58 [lammps-users] Applying strain to fcc gold modeled using lennard jones potential at 50 kelvin melika_ bm85
00:55 Re: [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Ashwin Padmanabhan
00:30 Re: [lammps-users] Moire potential implementation Nicolas Leconte

June 26, 2017
22:01 [lammps-users] introduce random particles at interface to model growth Quang Ha
21:46 Re: [lammps-users] Semi-Flexible polymers in 2D Trung Nguyen
17:28 Re: [lammps-users] Imbalanced cpu nodes T. Majdi
16:56 Re: [lammps-users] Semi-Flexible polymers in 2D Stefan Paquay
16:48 Re: [lammps-users] Semi-Flexible polymers in 2D Stefan Paquay
16:46 Re: [lammps-users] Imbalanced cpu nodes Axel Kohlmeyer
16:02 [lammps-users] Kokkos Reax Package Development Plan James Kress
15:41 Re: [lammps-users] Imbalanced cpu nodes T. Majdi
14:38 Re: [lammps-users] Define average density during simulation alberto
14:19 Re: [lammps-users] Semi-Flexible polymers in 2D Andrew Jewett
13:51 Re: [lammps-users] Imbalanced cpu nodes Axel Kohlmeyer
13:39 Re: [lammps-users] Semi-Flexible polymers in 2D Stefan Paquay
11:54 Re: [lammps-users] Define average density during simulation alberto
11:46 [lammps-users] Imbalanced cpu nodes T. Majdi
08:58 Re: [lammps-users] [EXTERNAL] Re: Fwd: Accelerate the simulation-kspace as the bottleneck Moore, Stan
08:21 Re: [lammps-users] lammps-users Digest, Vol 133, Issue 103 Agilio Padua
08:13 Re: [lammps-users] Semi-Flexible polymers in 2D Steve Plimpton
08:11 Re: [lammps-users] Fwd: Accelerate the simulation-kspace as the bottleneck Steve Plimpton
07:10 Re: [lammps-users] Free energy of water Lamm Gro
07:01 Re: [lammps-users] Moire potential implementation Axel Kohlmeyer
06:58 Re: [lammps-users] Free energy of water Axel Kohlmeyer
06:50 [lammps-users] Free energy of water Lamm Gro
06:35 Re: [lammps-users] Semi-Flexible polymers in 2D Steve Plimpton
06:33 Re: [lammps-users] Moire potential implementation Steve Plimpton
04:00 [lammps-users] Moire potential implementation Nicolas Leconte
01:53 Re: [lammps-users] out of range atoms - cannot compute PPPM Jana Pritam

June 25, 2017
20:54 Re: [lammps-users] Problem with Lammps dump movie command Axel Kohlmeyer
19:40 [lammps-users] Problem with Lammps dump movie command jami hessam
19:17 Re: [lammps-users] Testing the Kevin-Helmhotz instability with USER-SPH package Diaz,Adrian
15:11 [lammps-users] Testing the Kevin-Helmhotz instability with USER-SPH package Quang-Thinh Ha
07:37 Re: [lammps-users] parallel simulation Axel Kohlmeyer
07:29 Re: [lammps-users] parallel simulation Mathur Nil
03:30 Re: [lammps-users] Fwd: Accelerate the simulation-kspace as the bottleneck Azade Yazdan Yar

June 24, 2017
22:45 [lammps-users] Semi-Flexible polymers in 2D Stefan Paquay
17:35 Re: [lammps-users] Question about Pair Coeff for Beads of same atoms types Axel Kohlmeyer
17:18 Re: [lammps-users] Question about Pair Coeff for Beads of same atoms types George Ray
14:03 Re: [lammps-users] Fwd: Accelerate the simulation-kspace as the bottleneck Axel Kohlmeyer
12:09 [lammps-users] Fwd: Accelerate the simulation-kspace as the bottleneck Azade Yazdan Yar
11:32 Re: [lammps-users] How Can You Specify An Arbitrary Wall-Particle Potential Via the Fix/Wall Function? Axel Kohlmeyer
11:13 [lammps-users] How Can You Specify An Arbitrary Wall-Particle Potential Via the Fix/Wall Function? Brenda Rubenstein
11:05 Re: [lammps-users] Assigning BornMayer potential+ ZBL potential Axel Kohlmeyer
11:00 Re: [lammps-users] Different outcomes with same *.data & *.in while changing the parallel core numbers Axel Kohlmeyer
10:50 Re: [lammps-users] Accelerate the simulation-kspace as the bottleneck Axel Kohlmeyer
10:36 Re: [lammps-users] Accelerate the simulation-kspace as the bottleneck Azade Yazdan Yar
08:56 Re: [lammps-users] Spline zbl option to EAM Axel Kohlmeyer
08:53 Re: [lammps-users] Using msi2lmp and clayff Axel Kohlmeyer
08:41 [lammps-users] Spline zbl option to EAM Alexandra Adrych-Brunning
08:35 Re: [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Axel Kohlmeyer
08:27 Re: [lammps-users] Accelerate the simulation-kspace as the bottleneck Axel Kohlmeyer
08:26 Re: [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Steve Plimpton
08:23 Re: [lammps-users] Creating crytal lattice Axel Kohlmeyer
08:20 Re: [lammps-users] Diffusion Coefficient in 2D Steve Plimpton
08:17 Re: [lammps-users] Creating crytal lattice Steve Plimpton
08:15 Re: [lammps-users] Pizza tools Steve Plimpton
04:43 Re: [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Ashwin Padmanabhan
04:15 [lammps-users] Accelerate the simulation-kspace as the bottleneck Azade Yazdan Yar
02:42 [lammps-users] Using msi2lmp and clayff neda Sanchuli

June 23, 2017
23:47 Re: [lammps-users] input file of mixture ‪azadeh daneshvar‬ ‪
23:02 Re: [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Ashwin Padmanabhan
21:07 [lammps-users] Different outcomes with same *.data & *.in while changing the parallel core numbers 高瞻
16:26 Re: [lammps-users] Diffusion Coefficient in 2D John Smith
15:25 Re: [lammps-users] Question about Pair Coeff for Beads of same atoms types Axel Kohlmeyer
14:07 [lammps-users] Question about Pair Coeff for Beads of same atoms types George Ray
12:58 Re: [lammps-users] Creating crytal lattice Meral Sharkas
12:54 [lammps-users] Assigning BornMayer potential+ ZBL potential Meral Sharkas
09:11 [lammps-users] Pizza tools Yasti Ghala
09:01 Re: [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Steve Plimpton
08:57 Re: [lammps-users] cna calculation on dynamic group defined by variable atom using cna results? Steve Plimpton
08:49 Re: [lammps-users] Define average density during simulation Steve Plimpton
08:45 Re: [lammps-users] About some discrepancy in the equations in lammps docs Steve Plimpton
08:43 Re: [lammps-users] regarding NEB Deepesh Giri
08:38 Re: [lammps-users] Diffusion Coefficient in 2D Steve Plimpton
08:35 Re: [lammps-users] regarding NEB Steve Plimpton
08:34 Re: [lammps-users] Output using ave/spatial Steve Plimpton
08:12 Re: [lammps-users] [EXTERNAL] Re: tip4p pair_style with triclinic cell Axel Kohlmeyer
08:03 Re: [lammps-users] Define average density during simulation alberto
06:32 [lammps-users] Inelastic collisions in atom_style hybrid sphere dipole Ashwin Padmanabhan
05:41 [lammps-users] cna calculation on dynamic group defined by variable atom using cna results? Christophe Ortiz
04:45 [lammps-users] About some discrepancy in the equations in lammps docs dry6211@...24...
02:51 [lammps-users] EAM/alloy cutoff with zbl spline Alexandra Adrych-Brunning

June 22, 2017
22:25 Re: [lammps-users] atom deposition_segmentation fault (core dumped) Axel Kohlmeyer
22:15 [lammps-users] atom deposition_segmentation fault (core dumped) Gaoyang
21:36 Re: [lammps-users] Temperature control in fix gcmc with fix rigid/nvt/small Youzhi Hao
16:55 Re: [lammps-users] Diffusion Coefficient in 2D John Smith
16:39 Re: [lammps-users] regarding NEB Deepesh Giri
16:31 Re: [lammps-users] [EXTERNAL] Re: tip4p pair_style with triclinic cell Axel Kohlmeyer
15:00 Re: [lammps-users] LAMMPS moltemplate membrane+protein example Andrew Jewett
14:20 [lammps-users] Output using ave/spatial Roberts, Andrew
12:08 Re: [lammps-users] Issue with keeping track of a pair distance, mismatched compute Axel Kohlmeyer
12:00 Re: [lammps-users] Issue with keeping track of a pair distance, mismatched compute Vũ Hoàng Nguyễn
08:17 Re: [lammps-users] Define average density during simulation alberto
07:44 Re: [lammps-users] Too many common neighbors in CNA Christophe Ortiz
07:41 Re: [lammps-users] Invalid compute ID in variable formula Steve Plimpton
07:39 Re: [lammps-users] Which potential is more reasonable for predicting the crack of graphene during nanoindentation Steve Plimpton
07:39 Re: [lammps-users] Diffusion Coefficient in 2D Steve Plimpton
07:36 Re: [lammps-users] Too many common neighbors in CNA Steve Plimpton
07:28 Re: [lammps-users] Scaling with PMMM Vasily Pisarev
06:46 [lammps-users] Invalid compute ID in variable formula Christophe Ortiz
04:05 Re: [lammps-users] LAMMPS moltemplate membrane+protein example Axel Kohlmeyer
03:28 [lammps-users] LAMMPS moltemplate membrane+protein example Bhargav Patel
02:29 [lammps-users] Scaling with PMMM jony.castagna
00:35 [lammps-users] Which potential is more reasonable for predicting the crack of graphene during nanoindentation JWG

June 21, 2017
17:47 Re: [lammps-users] Problem when calling back to LAMMPS from Python Axel Kohlmeyer
17:40 [lammps-users] Diffusion Coefficient in 2D John Smith
16:14 [lammps-users] Problem when calling back to LAMMPS from Python Shuang Yang
08:22 Re: [lammps-users] Errors in lubricate/poly ? Steve Plimpton
08:22 Re: [lammps-users] Problem with PPPM Steve Plimpton
08:20 Re: [lammps-users] Define average density during simulation Steve Plimpton
08:01 Re: [lammps-users] fix ti/spring pmoreira
07:59 Re: [lammps-users] energetic Au deposition into polymer Fernanda S Teixeira
07:52 Re: [lammps-users] fix ti/spring pmoreira
07:34 Re: [lammps-users] fix ti/spring Axel Kohlmeyer
07:12 [lammps-users] fix ti/spring pmoreira
07:05 Re: [lammps-users] Problem with PPPM Axel Kohlmeyer
06:42 [lammps-users] Problem with PPPM jony.castagna
05:22 Re: [lammps-users] ERROR: Invalid mass line in data file (../atom.cpp:1416) Anil Mangla
04:54 [lammps-users] Errors in lubricate/poly ? Ranga Radhakrishnan
04:39 Re: [lammps-users] Fix NPT aniso stabilises at incorrect pressure Dzepina, Branislav
04:08 Re: [lammps-users] Fix NPT aniso stabilises at incorrect pressure Axel Kohlmeyer
04:04 Re: [lammps-users] Creating crytal lattice Axel Kohlmeyer
03:59 Re: [lammps-users] Fix NPT aniso stabilises at incorrect pressure Dzepina, Branislav
03:56 Re: [lammps-users] Fix NPT aniso stabilises at incorrect pressure Axel Kohlmeyer
03:13 [lammps-users] Fix NPT aniso stabilises at incorrect pressure Dzepina, Branislav
01:50 [lammps-users] Creating crytal lattice Meral Sharkas

June 20, 2017
15:31 Re: [lammps-users] Issue with keeping track of a pair distance, mismatched compute Axel Kohlmeyer
15:25 Re: [lammps-users] Issue with keeping track of a pair distance, mismatched compute Vũ Hoàng Nguyễn
14:15 [lammps-users] Define average density during simulation alberto
13:25 Re: [lammps-users] Issue with keeping track of a pair distance, mismatched compute Axel Kohlmeyer
13:14 [lammps-users] Issue with keeping track of a pair distance, mismatched compute Vũ Hoàng Nguyễn
10:58 [lammps-users] energetic Au deposition into polymer Fernanda S Teixeira
09:14 Re: [lammps-users] out of range atoms - cannot compute PPPM S Arun Srikant Sridhar
09:03 Re: [lammps-users] Green-Kubo method for calculating viscosity Smith, Micholas D.
08:57 Re: [lammps-users] Green-Kubo method for calculating viscosity Majid Rezaei
08:23 Re: [lammps-users] Simulation of polymer migration in cavities Axel Kohlmeyer
08:23 [lammps-users] Too many common neighbors in CNA Christophe Ortiz
07:50 Re: [lammps-users] Total Kinetic Energy Axel Kohlmeyer
07:45 [lammps-users] Total Kinetic Energy Roberts, Andrew
06:52 Re: [lammps-users] input file of mixture Axel Kohlmeyer
06:45 [lammps-users] Simulation of polymer migration in cavities Nagarajan Karthik
06:40 [lammps-users] input file of mixture ‪azadeh daneshvar‬ ‪
02:56 Re: [lammps-users] out of range atoms - cannot compute PPPM Jana Pritam

June 19, 2017
20:31 [lammps-users] Postdoc position habib rahbari
19:44 Re: [lammps-users] Can lammps simulate five types of atoms ? 王淑婷
15:56 Re: [lammps-users] Can lammps simulate five types of atoms ? Steve Plimpton
14:48 Re: [lammps-users] Problem in Moltemplate installation Andrew Jewett
11:06 Re: [lammps-users] out of range atoms - cannot compute PPPM S Arun Srikant Sridhar
11:05 Re: [lammps-users] Pressure calculation MD Simulation
11:00 Re: [lammps-users] out of range atoms - cannot compute PPPM Jana Pritam
10:57 Re: [lammps-users] Pressure calculation Axel Kohlmeyer
10:09 Re: [lammps-users] out of range atoms - cannot compute PPPM S Arun Srikant Sridhar
09:43 Re: [lammps-users] out of range atoms - cannot compute PPPM Jana Pritam
09:12 [lammps-users] Pressure calculation MD Simulation
07:54 Re: [lammps-users] Imposing target volume/pressure Axel Kohlmeyer
07:45 Re: [lammps-users] Imposing target volume/pressure Axel Kohlmeyer
07:43 Re: [lammps-users] Imposing target volume/pressure Jonathan Severin
07:35 Re: [lammps-users] out of range atoms - cannot compute PPPM Axel Kohlmeyer
07:09 Re: [lammps-users] Different results in a constant script Axel Kohlmeyer
06:19 Re: [lammps-users] Temperature control in fix gcmc with fix rigid/nvt/small Youzhi Hao
06:06 Re: [lammps-users] Green-Kubo method for calculating viscosity Smith, Micholas D.
05:18 Re: [lammps-users] Can lammps simulate five types of atoms ? Axel Kohlmeyer
05:12 Re: [lammps-users] out of range atoms - cannot compute PPPM ss3763
04:54 Re: [lammps-users] out of range atoms - cannot compute PPPM Mohammad Rafat Sadat
04:45 [lammps-users] Green-Kubo method for calculating viscosity Majid Rezaei
04:35 Re: [lammps-users] out of range atoms - cannot compute PPPM ss3763
04:35 [lammps-users] Green-Kubo method for calculating viscosity Majid Rezaei
04:21 Re: [lammps-users] out of range atoms - cannot compute PPPM Mohammad Rafat Sadat
04:10 Re: [lammps-users] out of range atoms - cannot compute PPPM ss3763
04:00 Re: [lammps-users] Temperature control in fix gcmc with fix rigid/nvt/small Mohammad Rafat Sadat
02:58 Re: [lammps-users] out of range atoms - cannot compute PPPM Jana Pritam
02:27 [lammps-users] Temperature control in fix gcmc with fix rigid/nvt/small Youzhi Hao
01:20 [lammps-users] Can lammps simulate five types of atoms ? 王淑婷

June 18, 2017
23:01 Re: [lammps-users] Compute center of mass using wrapped coordinates Pengyu Huang
19:26 Re: [lammps-users] [EXTERNAL] Re: Pressure with an applied E-field Matthias Kahk
17:21 Re: [lammps-users] [EXTERNAL] Re: Pressure with an applied E-field Thompson, Aidan
14:28 [lammps-users] Problem in Moltemplate installation Sousa Javan Nikkhah
12:16 Re: [lammps-users] Reading Energy in Custom Pair Function S M
09:03 Re: [lammps-users] out of range atoms - cannot compute PPPM S Arun Srikant Sridhar
08:05 [lammps-users] out of range atoms - cannot compute PPPM Jana Pritam

June 17, 2017
19:14 Re: [lammps-users] Reading Energy in Custom Pair Function Axel Kohlmeyer
18:53 Re: [lammps-users] simulate Pt interact with H2O Axel Kohlmeyer
11:23 [lammps-users] simulate Pt interact with H2O Jiamin Wang
08:24 Re: [lammps-users] how to specify precision in the fix qeq/comb command when use comb3 potential ruiyan
06:23 [lammps-users] Different results in a constant script Nader Ameli
00:05 Re: [lammps-users] how to specify precision in the fix qeq/comb command when use comb3 potential Ray Shan

June 16, 2017
23:55 Re: [lammps-users] Reading Energy in Custom Pair Function Andrew Jewett
18:36 [lammps-users] Reading Energy in Custom Pair Function S M
15:09 Re: [lammps-users] [EXTERNAL] Re: SRD particles and lj units conversion Bolintineanu, Dan Stefan
13:12 Re: [lammps-users] Compute center of mass using wrapped coordinates Axel Kohlmeyer
12:57 Re: [lammps-users] Imposing target volume/pressure Axel Kohlmeyer
11:49 [lammps-users] how to specify precision in the fix qeq/comb command when use comb3 potential ruiyan
09:46 Re: [lammps-users] Imposing target volume/pressure Jonathan Severin
09:17 Re: [lammps-users] Imposing target volume/pressure S Arun Srikant Sridhar
08:49 Re: [lammps-users] number of processor Axel Kohlmeyer
08:42 [lammps-users] Imposing target volume/pressure Jonathan Severin
08:39 [lammps-users] Compute center of mass using wrapped coordinates Pengyu Huang
08:36 Re: [lammps-users] number of processor Mathur Nil
07:54 Re: [lammps-users] SRD particles and lj units conversion Steve Plimpton
07:50 Re: [lammps-users] Pressure with an applied E-field Steve Plimpton
06:45 Re: [lammps-users] [EXTERNAL] Re: tip4p pair_style with triclinic cell Axel Kohlmeyer
06:26 Re: [lammps-users] [EXTERNAL] Re: tip4p pair_style with triclinic cell soroush
01:31 Re: [lammps-users] Pressure with an applied E-field Matthias Kahk
01:27 [lammps-users] SRD particles and lj units conversion shirin shafiee

June 15, 2017
22:42 Re: [lammps-users] about the fix reax/c/species command in lammps Tony Liu
15:55 Re: [lammps-users] about the fix reax/c/species command in lammps Axel Kohlmeyer
10:35 Re: [lammps-users] About how to get forces between two atoms groups Axel Kohlmeyer
10:29 Re: [lammps-users] Problem with compute cluster/atom Axel Kohlmeyer
09:11 [lammps-users] About how to get forces between two atoms groups Arun Bikram Thapa
08:57 Re: [lammps-users] Knight-landing best practices? Moore, Stan
08:49 [lammps-users] About how to get forces between two atoms groups Arun Bikram Thapa
08:20 [lammps-users] Knight-landing best practices? Smith, Micholas D.
08:06 Re: [lammps-users] Pressure with an applied E-field Steve Plimpton
08:03 Re: [lammps-users] Diffusion Coefficient in 2d Steve Plimpton
06:12 [lammps-users] Transition from EEM to QEq when implementing ReaxFF in LAMMPS Georg Heinze

June 14, 2017
21:27 Re: [lammps-users] Can lammps build the structure of hollow sphere ? Axel Kohlmeyer
21:25 [lammps-users] Can lammps build the structure of hollow sphere ? 王淑婷
20:24 Re: [lammps-users] about the fix reax/c/species command in lammps Tony Liu
20:18 [lammps-users] Pressure with an applied E-field Matthias Kahk
18:31 Re: [lammps-users] ERROR: Insufficient Jacobi rotations for group::omega Venkatesh Meenakshisundaram
16:45 [lammps-users] Diffusion Coefficient in 2d John Smith
11:02 Re: [lammps-users] What are the relevant variables in pppm.cpp to output the electric field ? Romain Vermorel
10:58 Re: [lammps-users] Particle repulsion for random distribution Axel Kohlmeyer
10:50 Re: [lammps-users] What are the relevant variables in pppm.cpp to output the electric field ? Axel Kohlmeyer
10:44 [lammps-users] Particle repulsion for random distribution Roberts, Andrew
10:28 Re: [lammps-users] What are the relevant variables in pppm.cpp to output the electric field ? Romain Vermorel
10:15 Re: [lammps-users] What are the relevant variables in pppm.cpp to output the electric field ? Axel Kohlmeyer
10:08 [lammps-users] What are the relevant variables in pppm.cpp to output the electric field ? Romain Vermorel
09:58 Re: [lammps-users] reaxff James Kress
08:48 Re: [lammps-users] Fw: Reax/c benchmark on KNL fails with error: Non-Existent ReaxFF type Axel Kohlmeyer
08:38 Re: [lammps-users] Fw: Reax/c benchmark on KNL fails with error: Non-Existent ReaxFF type Smith, Micholas D.
08:29 Re: [lammps-users] SRD energy calculations Steve Plimpton
08:27 Re: [lammps-users] mpirun command giving error while trying to run a simulation involving NEB method. Steve Plimpton
08:27 Re: [lammps-users] Fw: Reax/c benchmark on KNL fails with error: Non-Existent ReaxFF type Axel Kohlmeyer
08:27 Re: [lammps-users] reaxff Axel Kohlmeyer
08:25 Re: [lammps-users] Computing interaction energy of each atom in group1 with another group2 Steve Plimpton
08:18 [lammps-users] reaxff Alexandra Davila
08:11 [lammps-users] Fw: Reax/c benchmark on KNL fails with error: Non-Existent ReaxFF type Smith, Micholas D.
06:51 Re: [lammps-users] about the fix reax/c/species command in lammps Axel Kohlmeyer
06:51 [lammps-users] 答复: Questions about the output of Colvars and Multiple-replica metadynamics Xinyi Shen
06:27 Re: [lammps-users] Problem with compute cluster/atom Axel Kohlmeyer
04:54 Re: [lammps-users] Questions about the output of Colvars and Multiple-replica metadynamics Giacomo Fiorin
04:37 [lammps-users] Problem with compute cluster/atom 1132033
02:38 Re: [lammps-users] Melting of Amorphous Silica S Arun Srikant Sridhar
02:25 Re: [lammps-users] User-defined variable in replica exchange simulations LC Liu
00:14 Re: [lammps-users] Melting of Amorphous Silica Rana Ali

June 13, 2017
23:43 [lammps-users] about the fix reax/c/species command in lammps Tony Liu
23:01 Re: [lammps-users] ERROR: Unknown fix style atom/swap (../modify.cpp:847) Ray Shan
22:48 [lammps-users] ERROR: Unknown fix style atom/swap (../modify.cpp:847) Anil Mangla
16:08 Re: [lammps-users] SRD energy calculations John Smith
13:05 Re: [lammps-users] mpirun command giving error while trying to run a simulation involving NEB method. Axel Kohlmeyer
12:57 Re: [lammps-users] mpirun command giving error while trying to run a simulation involving NEB method. Madhur Aggarwal
12:52 Re: [lammps-users] Regarding force on one group due to another Axel Kohlmeyer
11:42 Re: [lammps-users] Input script Axel Kohlmeyer
11:30 Re: [lammps-users] linesearch alpha is zero - LAMMPS17 Axel Kohlmeyer
11:24 [lammps-users] Regarding force on one group due to another Sharma MD
11:09 [lammps-users] Input script Shubham Kaushal
10:56 Re: [lammps-users] Problem using compute force/tally on multiple processors Srilok Srinivasan
10:53 [lammps-users] linesearch alpha is zero - LAMMPS17 Alexandra Davila
09:16 Re: [lammps-users] User-defined variable in replica exchange simulations Axel Kohlmeyer
09:08 [lammps-users] User-defined variable in replica exchange simulations Cyril Falvo
08:42 [lammps-users] Computing interaction energy of each atom in group1 with another group2 Christophe Ortiz
08:39 Re: [lammps-users] Polydispsersity and random packing Steve Plimpton
08:38 Re: [lammps-users] Units lj Steve Plimpton
08:37 Re: [lammps-users] Calculation of Plastic displacements of atoms Steve Plimpton
08:36 Re: [lammps-users] Polydispsersity and random packing Roberts, Andrew
08:36 Re: [lammps-users] SRD energy calculations Steve Plimpton
08:28 Re: [lammps-users] Polydispsersity and random packing Steve Plimpton
07:13 [lammps-users] Carbon-Carbon Long range inteaction using Lj potential Nasiri, Samaneh
06:41 [lammps-users] Carbon-Carbon Long range inteaction using Lj potential Nasiri, Samaneh
00:46 [lammps-users] Units lj ??????????
00:38 [lammps-users] Calculation of Plastic displacements of atoms Ashish .Chauniyal

June 12, 2017
20:39 Re: [lammps-users] Problem using compute force/tally on multiple processors Axel Kohlmeyer
17:31 [lammps-users] SRD energy calculations John Smith
16:08 Re: [lammps-users] Problem using compute force/tally on multiple processors