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LAMMPS Mail List Date Index

LAMMPS Mail List Date Index


There are 89822 messages in 26746 threads in the archives.

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09:44 Re: [lammps-users] Error "Segmentation Fault (Core Dumped) " Help? Axel Kohlmeyer
09:42 Re: [lammps-users] Error "Segmentation Fault (Core Dumped) " Help? Axel Kohlmeyer
09:34 [lammps-users] Error "Segmentation Fault (Core Dumped) " Help? jack quinn
09:21 [lammps-users] Videos about Molecular Dynamics Simulations LAMMPS Tube
08:57 Re: [lammps-users] Build molecule template Will Pisani
08:40 [lammps-users] Triaxial Test for an RVE with the pressure control commands Mehrdad
07:15 Re: [lammps-users] Build molecule template Musa Kamal
00:23 [lammps-users] Fw: MUHAMMAD SAAD ALI Muhammad Saad Ali
00:22 [lammps-users] Fw: MUHAMMAD SAAD ALI Muhammad Saad Ali

December 16, 2020
23:42 Re: [lammps-users] MUHAMMAD SAAD ALI Mahmudul Islam
23:26 Re: [lammps-users] Domino effect with bonds Will Pisani
22:26 [lammps-users] MUHAMMAD SAAD ALI Muhammad Saad Ali
21:51 [lammps-users] Bonds crossed boundary after relaxation Bo Gong
20:56 [lammps-users] Domino effect with bonds Sebastian S
15:24 [lammps-users] Videos from LAMMPS Simulation Package LAMMPS Tube
12:21 Re: [lammps-users] Hardware definition for Lammps simulations Paolo Botto
10:44 Re: [lammps-users] Hardware definition for Lammps simulations Axel Kohlmeyer
09:50 [lammps-users] Hardware definition for Lammps simulations Paolo Botto
09:02 Re: [lammps-users] Question on a collision command Kritikos, Efstratios
09:00 Re: [lammps-users] Help about accelerate script Axel Kohlmeyer
08:24 Re: [lammps-users] Irradiation in materials Steve Plimpton
08:15 Re: [lammps-users] Question on a collision command Steve Plimpton
08:08 Re: [lammps-users] [EXTERNAL] Re: Help about accelerate script Moore, Stan
03:45 Re: [lammps-users] Help about accelerate script mohammad rezaei

December 15, 2020
21:45 [lammps-users] Irradiation in materials 汪骞
18:51 Re: [lammps-users] The accuracy and format of trj files Axel Kohlmeyer
18:40 Re: [lammps-users] problem with "compute dipole/chunk" Wei Chen
18:34 Re: [lammps-users] Question on a collision command Axel Kohlmeyer
18:22 Re: [lammps-users] Help about accelerate script Axel Kohlmeyer
18:17 [lammps-users] The accuracy and format of trj files 吴标
17:51 Re: [lammps-users] Question on a collision command Kritikos, Efstratios
17:23 Re: [lammps-users] Question on a collision command Steve Plimpton
17:22 Re: [lammps-users] Bond creation Movie Steve Plimpton
16:35 Re: [lammps-users] Help about accelerate script mohammad rezaei
16:08 Re: [lammps-users] intra-molecular pair interaction Axel Kohlmeyer
15:55 Re: [lammps-users] Help about accelerate script Axel Kohlmeyer
14:09 Re: [lammps-users] intra-molecular pair interaction Chandana Mondal
13:32 Re: [lammps-users] intra-molecular pair interaction Axel Kohlmeyer
13:20 [lammps-users] intra-molecular pair interaction Chandana Mondal
13:07 Re: [lammps-users] Question on a collision command Axel Kohlmeyer
11:44 Re: [lammps-users] Bond creation Movie Axel Kohlmeyer
09:12 [lammps-users] Help about accelerate script mohammad rezaei
07:41 [lammps-users] Question on a collision command Kritikos, Efstratios
07:13 Re: [lammps-users] Bond creation Movie Jacob Gissinger

December 14, 2020
23:31 Re: [lammps-users] problem with "compute dipole/chunk" Axel Kohlmeyer
22:11 [lammps-users] Bond creation Movie Musa Kamal
20:36 Re: [lammps-users] problem with "compute dipole/chunk" Wei Chen
13:48 Re: [lammps-users] Sporadic Segmentation faults Axel Kohlmeyer
13:23 [lammps-users] Sporadic Segmentation faults aved akesnof
11:24 Re: [lammps-users] MD simulation of a LAngmuir-Blodgett trough Paolo Botto
10:25 [lammps-users] Pictures from LAMMPS Simulation Package LAMMPS Tube
09:53 [lammps-users] improper_style class2 command ml mehrabian
09:07 Re: [lammps-users] lammps installation help/ GLIBCXX_3.4.20' not found santhosh mathesan
08:49 Re: [lammps-users] Problems with NEB method Steve Plimpton
08:45 Re: [lammps-users] thermo_style---etotal,emol Steve Plimpton
08:33 Re: [lammps-users] MD simulation of a LAngmuir-Blodgett trough Steve Plimpton
08:02 Re: [lammps-users] problems with "pair_style hybird" Axel Kohlmeyer
07:30 Re: [lammps-users] Problems about kinetic energy calculation Axel Kohlmeyer
06:57 [lammps-users] Problems about kinetic energy calculation 刘江辉
05:08 Re: [lammps-users] Problem with the command msd/chunk Jose Carlos Madrid Madrid
01:54 Re: [lammps-users] [EXTERNAL] Fwd: LAMMPS Elastic Constant Computation Poonam Pahari
01:43 [lammps-users] thermo_style---etotal,emol 吴标
00:53 [lammps-users] Problems with NEB method stefano.segantin

December 13, 2020
23:17 Re: [lammps-users] problems with "pair_style hybird" 王满
20:56 [lammps-users] 回复: [EXTERNAL] 回复: Help: pair_style reax/c with ReaxFF-lg force fieldcannot reproduce the published benchmark result. LIANG Tengfei
20:09 Re: [lammps-users] problem with "compute dipole/chunk" Axel Kohlmeyer
19:56 Re: [lammps-users] Compile cpp and h file in src Axel Kohlmeyer
19:33 [lammps-users] Compile cpp and h file in src Wenhao Yao
18:34 Re: [lammps-users] Build molecule template Jacob Gissinger
18:04 Re: [lammps-users] problem with "compute dipole/chunk" Wei Chen
15:54 Re: [lammps-users] Interatomic Potential Axel Kohlmeyer
15:33 Re: [lammps-users] compute chunk/atom molecule, bin/sphere. Ndensity Axel Kohlmeyer
15:23 Re: [lammps-users] Ndensity Axel Kohlmeyer
15:13 Re: [lammps-users] [EXTERNAL] 回复: Help: pair_style reax/c with ReaxFF-lg force fieldcannot reproduce the published benchmark result. Thompson, Aidan
12:54 Re: [lammps-users] Build molecule template Musa Kamal
12:49 Re: [lammps-users] Build molecule template Pinky Mazumder
12:46 [lammps-users] Build molecule template Musa Kamal
11:25 Re: [lammps-users] Interatomic Potential Pascal Brault
11:20 Re: [lammps-users] Interatomic Potential Pascal Brault
09:30 Re: [lammps-users] Interatomic Potential Axel Kohlmeyer
09:25 Re: [lammps-users] Interatomic Potential Axel Kohlmeyer
09:15 Re: [lammps-users] Poor performance with multiple partitions Okenyi, Matthew T O
08:38 Re: [lammps-users] Interatomic Potential Pascal Brault
06:43 [lammps-users] Interatomic Potential LAMMPS Tube
06:35 [lammps-users] Ndensity CUPB-Yang Feng
03:02 Re: [lammps-users] MD simulation of a LAngmuir-Blodgett trough Paolo Botto
02:20 [lammps-users] compute chunk/atom molecule, bin/sphere. Ndensity CUPB-Yang Feng

December 12, 2020
21:40 Re: [lammps-users] Poor performance with multiple partitions Axel Kohlmeyer
19:41 Re: [lammps-users] how to compile the new added cpp and h file Axel Kohlmeyer
17:47 [lammps-users] how to compile the new added cpp and h file Wenhao Yao
14:33 [lammps-users] History of LAMMPS software LAMMPS Tube
12:57 Re: [lammps-users] Simulation of CO2 with a piston Kasia Walczak
07:18 [lammps-users] Poor performance with multiple partitions Okenyi, Matthew T O

December 11, 2020
15:06 Re: [lammps-users] minimize command mohammed lemaalem
14:51 Re: [lammps-users] minimize command Steve Plimpton
14:39 Re: [lammps-users] Simulation of CO2 with a piston Axel Kohlmeyer
12:28 Re: [lammps-users] problem with "compute dipole/chunk" Axel Kohlmeyer
11:29 Re: [lammps-users] Shock modelling of polymer Ray Shan
11:24 [lammps-users] Shock modelling of polymer Ankur Chaurasia
11:17 [lammps-users] Simulation of CO2 with a piston Kasia Walczak
00:15 Re: [lammps-users] fix langevin command and restart file Maryam Bahrami

December 10, 2020
20:12 [lammps-users] problem with "compute dipole/chunk" chenwei
19:11 [lammps-users] 回复: Help: pair_style reax/c with ReaxFF-lg force fieldcannot reproduce the published benchmark result. LIANG Tengfei
16:59 Re: [lammps-users] Shock Modelling of Polymer Andrew Jewett
14:56 Re: [lammps-users] Problem with the command msd/chunk Steve Plimpton
13:56 Re: [lammps-users] Problem with the command msd/chunk Axel Kohlmeyer
13:23 [lammps-users] minimize command mohammed lemaalem
11:59 Re: [lammps-users] Problem with the command msd/chunk Jose Carlos Madrid Madrid
11:39 [lammps-users] Polymeric Structure Simulation with LAMMPS LAMMPS Tube
11:24 [lammps-users] Shock Modelling of Polymer Ankur Chaurasia
09:39 Re: [lammps-users] [EXTERNAL] Fwd: LAMMPS Elastic Constant Computation Thompson, Aidan
08:31 Re: [lammps-users] MD simulation of Metallic glass nanocomposites Axel Kohlmeyer
08:25 Re: [lammps-users] Help: pair_style reax/c with ReaxFF-lg force field cannot reproduce the published benchmark result. Axel Kohlmeyer
08:22 [lammps-users] 回复: Help: pair_style reax/c with ReaxFF-lg force fieldcannot reproduce the published benchmark result. LIANG Tengfei
08:13 Re: [lammps-users] How to place Graphene on a SiO2 substrate Ray Shan
08:13 Re: [lammps-users] MD simulation of Metallic glass nanocomposites Ray Shan
08:10 Re: [lammps-users] Problem with the command msd/chunk Ray Shan
08:08 Re: [lammps-users] Help: pair_style reax/c with ReaxFF-lg force field cannot reproduce the published benchmark result. Ray Shan
06:18 Re: [lammps-users] Problem with the command msd/chunk Jose Carlos Madrid Madrid
02:21 [lammps-users] MD simulation of Metallic glass nanocomposites Kibria Imtiaz Shabbir
00:30 Re: [lammps-users] Issue with 1D compression and Gay-Berne potential Bandera, Sara
00:02 [lammps-users] How to place Graphene on a SiO2 substrate Ocean Rusty

December 09, 2020
22:48 [lammps-users] Help: pair_style reax/c with ReaxFF-lg force field cannot reproduce the published benchmark result. LIANG Tengfei
16:30 Re: [lammps-users] Appropriate ensemble for FIX boundry Steve Plimpton
16:27 Re: [lammps-users] Issue with 1D compression and Gay-Berne potential Steve Plimpton
14:02 Re: [lammps-users] Phana Tool Axel Kohlmeyer
13:21 Re: [lammps-users] Thin film interaction Axel Kohlmeyer
13:18 [lammps-users] Phana Tool Amir Behbahanian
12:28 Re: [lammps-users] Thin film interaction Musa Kamal
12:18 Re: [lammps-users] Thin film interaction Axel Kohlmeyer
12:00 [lammps-users] Thin film interaction Musa Kamal
11:59 Re: [lammps-users] [EXTERNAL] Re: Question about fix atom/swap Thompson, Aidan
11:32 [lammps-users] Appropriate ensemble for FIX boundry Asadollahzadeh
10:54 [lammps-users] Issue with 1D compression and Gay-Berne potential Bandera, Sara
10:17 Re: [lammps-users] if command for grouping molecules Steve Plimpton
10:13 Re: [lammps-users] Questions on ATC Package Axel Kohlmeyer
10:09 Re: [lammps-users] Subsequent simulations in multiple PKA cascade mode Axel Kohlmeyer
09:55 Re: [lammps-users] Regarding corrections for centre of mass velocity contributions in stress and temperature Steve Plimpton
09:39 [lammps-users] R: Subsequent simulations in multiple PKA cascade mode stefano.segantin
09:35 Re: [lammps-users] Problem with the command msd/chunk Steve Plimpton
09:34 [lammps-users] Questions on ATC Package Khaled Mohamed
09:27 Re: [lammps-users] about compute temp/partial Steve Plimpton
09:17 Re: [lammps-users] query for running simulation at verly low temperature and getting nan while using rigid/nvt Steve Plimpton
09:14 Re: [lammps-users] calculate local heat flux Steve Plimpton
09:05 Re: [lammps-users] One dimension simulation in LAMMPS Steve Plimpton
09:01 Re: [lammps-users] MD simulation of a LAngmuir-Blodgett trough Steve Plimpton
08:57 Re: [lammps-users] Subsequent simulations in multiple PKA cascade mode Steve Plimpton
08:52 Re: [lammps-users] using fix box/relax command Steve Plimpton
08:44 Re: [lammps-users] Subsequent simulations in multiple PKA cascade mode Axel Kohlmeyer
08:44 Re: [lammps-users] Gaussian white noise Steve Plimpton
08:37 Re: [lammps-users] write coeff in hybrid style Steve Plimpton
08:35 [lammps-users] R: Subsequent simulations in multiple PKA cascade mode stefano.segantin
08:34 Re: [lammps-users] dynamic group Steve Plimpton
08:32 Re: [lammps-users] Question About LAMMPS ATC Steve Plimpton
07:30 Re: [lammps-users] problem regarding setting point dipole on an elliptical particle. Axel Kohlmeyer
07:27 Re: [lammps-users] fix langevin command and restart file Axel Kohlmeyer
07:23 Re: [lammps-users] facing issue in Linux version Axel Kohlmeyer
07:14 Re: [lammps-users] Contact angle simulation Axel Kohlmeyer
05:32 [lammps-users] problem regarding setting point dipole on an elliptical particle. Soumik Ghosh
01:12 [lammps-users] fix langevin command and restart file Maryam Bahrami
00:45 [lammps-users] Contact angle simulation Rajorshi Chattopadhyay

December 08, 2020
13:12 Re: [lammps-users] Making a fix work with USER-INTEL Shern Tee
12:13 Re: [lammps-users] Making a fix work with USER-INTEL Brown, Michael W
08:14 Re: [lammps-users] Making a fix work with USER-INTEL Shern Tee
07:25 [lammps-users] facing issue in Linux version Ankit Chauhan
06:17 Re: [lammps-users] Inquiry about the Lennard Jones 9-6 equation used in LAMMPS shahin mohamadnejad
05:21 [lammps-users] using fix box/relax command isra muscati
03:36 Re: [lammps-users] Output after minimization and equilbration vibhuti taneja
03:27 Re: [lammps-users] Inquiry about the Lennard Jones 9-6 equation used in LAMMPS Ευάγγελος Βογιατζής
03:06 Re: [lammps-users] Inquiry about the Lennard Jones 9-6 equation used in LAMMPS Axel Kohlmeyer
02:56 Re: [lammps-users] Output after minimization and equilbration Axel Kohlmeyer
02:15 [lammps-users] Output after minimization and equilbration vibhuti taneja
00:41 [lammps-users] Inquiry about the Lennard Jones 9-6 equation used in LAMMPS shahin mohamadnejad

December 07, 2020
22:09 Re: [lammps-users] Pressure calculation of water system via stress/atom Axel Kohlmeyer
20:56 [lammps-users] Pressure calculation of water system via stress/atom Yakang JIN
16:23 Re: [lammps-users] Miscalculation of Dihedrals in n-Alkane system Andrew Jewett
16:14 Re: [lammps-users] Miscalculation of Dihedrals in n-Alkane system Andrew Jewett
15:59 Re: [lammps-users] Number of contacts between two groups of atoms Axel Kohlmeyer
15:36 [lammps-users] Number of contacts between two groups of atoms Eduardo Estevez
14:26 Re: [lammps-users] NPT cannot hold the pressure Joe Zhang
14:15 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
14:10 Re: [lammps-users] NPT cannot hold the pressure Joe Zhang
14:02 [lammps-users] Miscalculation of Dihedrals in n-Alkane system Jesus Gutierrez Plascencia
14:01 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
13:42 Re: [lammps-users] NPT cannot hold the pressure Joe Zhang
11:36 Re: [lammps-users] [EXTERNAL] Fwd: Wurtzite structure example in documentation "lattice" probably wrong Axel Kohlmeyer
08:19 Re: [lammps-users] Different fix invocation sequence Kritikos, Efstratios
08:16 Re: [lammps-users] Making a fix work with USER-INTEL Axel Kohlmeyer
07:56 [lammps-users] Making a fix work with USER-INTEL Shern Tee
07:55 Re: [lammps-users] Different fix invocation sequence Axel Kohlmeyer
07:39 Re: [lammps-users] Simulation of chips sliding on Graphene Axel Kohlmeyer
07:38 [lammps-users] Different fix invocation sequence Kritikos, Efstratios
07:15 Re: [lammps-users] fix wall/gran Axel Kohlmeyer
07:14 Re: [lammps-users] Simulation of chips sliding on Graphene taisei tokuda
06:54 Re: [lammps-users] fix wall/gran aved akesnof
06:48 Re: [lammps-users] Simulation of chips sliding on Graphene Axel Kohlmeyer
06:46 Re: [lammps-users] Subsequent simulations in multiple PKA cascade mode Axel Kohlmeyer
06:06 Re: [lammps-users] Insert ILs Agilio Padua
05:57 Re: [lammps-users] [EXTERNAL] Fwd: Wurtzite structure example in documentation "lattice" probably wrong Andreas Kyritsakis
05:50 [lammps-users] Subsequent simulations in multiple PKA cascade mode stefano.segantin
02:58 [lammps-users] Simulation of chips sliding on Graphene taisei tokuda
01:41 Re: [lammps-users] Insert ILs Ali M
01:31 Re: [lammps-users] Doubts about intermolecular potential parameters (lj/cut/coul/long) Emerson Parazzi Lyra
00:43 Re: [lammps-users] Ellipsoidal shaped particles in dusty plasma Andrew Jewett
00:36 Re: [lammps-users] Ellipsoidal shaped particles in dusty plasma Andrew Jewett
00:21 Re: [lammps-users] Fix widom question Betim Bahtiri

December 06, 2020
23:38 Re: [lammps-users] Doubts about intermolecular potential parameters (lj/cut/coul/long) Axel Kohlmeyer
22:51 [lammps-users] Doubts about intermolecular potential parameters (lj/cut/coul/long) Emerson Parazzi Lyra
21:59 Re: [lammps-users] fix wall/gran Axel Kohlmeyer
20:11 [lammps-users] fix wall/gran aved akesnof
19:28 Re: [lammps-users] Insert ILs Axel Kohlmeyer
13:37 Re: [lammps-users] Gaussian white noise Charlie Sievers
12:53 [lammps-users] Gaussian white noise Zahra Fazli
10:19 [lammps-users] Insert ILs Ali M
05:24 [lammps-users] dynamic group omid gh

December 05, 2020
19:25 Re: [lammps-users] NPT cannot hold the pressure Joe Zhang
18:52 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
18:28 Re: [lammps-users] NPT cannot hold the pressure Joe Zhang
16:23 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
16:18 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
13:02 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
11:31 Re: [lammps-users] [EXTERNAL] Fwd: Wurtzite structure example in documentation "lattice" probably wrong Thompson, Aidan
11:22 Re: [lammps-users] NPT cannot hold the pressure Joe Zhang
09:07 Re: [lammps-users] NPT cannot hold the pressure Axel Kohlmeyer
02:56 Re: [lammps-users] Quench method yen fred woguem

December 04, 2020
21:55 Re: [lammps-users] Conversion check from Gromacs to Lammps Andrew Jewett
21:54 Re: [lammps-users] Conversion check from Gromacs to Lammps Andrew Jewett
21:54 [lammps-users] NPT cannot hold the pressure Joe Zhang
17:53 Re: [lammps-users] Is the webpage of LAMMPS and the mail archive down? Axel Kohlmeyer
17:27 [lammps-users] Is the webpage of LAMMPS and the mail archive down? Devanjith Fonseka
16:23 [lammps-users] Simulation of Deformation Behavior in Amorphous Polymer LAMMPS Tube
16:17 [lammps-users] Simulation of Deformation Behavior in Amorphous Polymer LAMMPS Tube
15:29 Re: [lammps-users] lammps installation help/ GLIBCXX_3.4.20' not found Axel Kohlmeyer
15:11 [lammps-users] lammps installation help/ GLIBCXX_3.4.20' not found santhosh mathesan
14:30 Re: [lammps-users] Fix widom question Ευάγγελος Βογιατζής
13:44 Re: [lammps-users] Question About LAMMPS ATC Axel Kohlmeyer
13:29 [lammps-users] Question About LAMMPS ATC Khaled Mohamed
12:58 Re: [lammps-users] Wurtzite structure example in documentation "lattice" probably wrong Steve Plimpton
12:52 Re: [lammps-users] Fix widom question Steve Plimpton
12:51 Re: [lammps-users] Ellipsoidal shaped particles Steve Plimpton
12:38 Re: [lammps-users] Quench method Axel Kohlmeyer
09:59 Re: [lammps-users] Quench method yen fred woguem
09:39 Re: [lammps-users] NEB simulation Axel Kohlmeyer
09:37 Re: [lammps-users] Quench method Axel Kohlmeyer
09:35 Re: [lammps-users] Volume unit in Metal Units Axel Kohlmeyer
09:34 Re: [lammps-users] Heat source for TTM or ATC Axel Kohlmeyer
09:29 Re: [lammps-users] Minimization of step 0 changing results Axel Kohlmeyer
08:57 [lammps-users] Minimization of step 0 changing results Alec m
08:01 Re: [lammps-users] Heat source for TTM or ATC Khaled Mohamed
07:58 Re: [lammps-users] Hybrid command - mixed system with water and one organic molecule Axel Kohlmeyer
07:27 Re: [lammps-users] Volume unit in Metal Units Axel Kohlmeyer
07:04 [lammps-users] Volume unit in Metal Units Abedi, Mostafa
06:59 [lammps-users] Volume unit in Metal Units Abedi, Mostafa
04:03 Re: [lammps-users] Hybrid command - mixed system with water and one organic molecule Paolo Botto
03:34 Re: [lammps-users] Ellipsoidal shaped particles in dusty plasma Axel Kohlmeyer
03:09 Re: [lammps-users] Ellipsoidal shaped particles in dusty plasma mamta yadav
01:11 [lammps-users] Quench method yen fred woguem

December 03, 2020
22:38 Re: [lammps-users] Ellipsoidal shaped particles mamta yadav
21:32 [lammps-users] NEB simulation Nitin Chaudhary
19:41 Re: [lammps-users] Heat source for TTM or ATC Axel Kohlmeyer
18:31 Re: [lammps-users] Converting a lammps dump file to lammps data file Andrew Jewett
18:24 Re: [lammps-users] Converting a lammps dump file to lammps data file Andrew Jewett
17:41 [lammps-users] Heat source for TTM or ATC Khaled Mohamed
17:10 Re: [lammps-users] Ellipsoidal shaped particles Andrew Jewett
10:33 Re: [lammps-users] Regarding Carbohydrates simulation Pinky Mazumder
10:19 Re: [lammps-users] Regarding Carbohydrates simulation Axel Kohlmeyer
09:26 [lammps-users] Regarding Carbohydrates simulation Pinky Mazumder
09:18 Re: [lammps-users] Converting a lammps dump file to lammps data file Joe Zhang
09:05 Re: [lammps-users] problems with "pair_style hybird" Axel Kohlmeyer
09:01 Re: [lammps-users] [EXTERNAL] Re: KOKKOS's poor performance Moore, Stan
08:47 Re: [lammps-users] Converting a lammps dump file to lammps data file Axel Kohlmeyer
08:37 [lammps-users] Converting a lammps dump file to lammps data file Joe Zhang
08:33 Re: [lammps-users] Ellipsoidal shaped particles in dusty plasma Axel Kohlmeyer
08:08 Re: [lammps-users] ave/time "ave running" and "ave one" Axel Kohlmeyer
04:57 [lammps-users] Ellipsoidal shaped particles in dusty plasma mamta yadav
04:53 [lammps-users] Wurtzite structure example in documentation "lattice" probably wrong Andreas Kyritsakis

December 02, 2020
22:59 [lammps-users] problems with "pair_style hybird" 王满
21:49 [lammps-users] ave/time "ave running" and "ave one" ??????
17:08 Re: [lammps-users] Cooling of Non-equilibrium Box Axel Kohlmeyer
16:46 Re: [lammps-users] Cooling of Non-equilibrium Box Khaled Mohamed
16:42 Re: [lammps-users] Feeding a file containing discrete time vs position data to LAMMPS Axel Kohlmeyer
16:31 Re: [lammps-users] kspace cutoff when separating an atom from the surface - limitation or error? Axel Kohlmeyer
15:30 Re: [lammps-users] Cooling of Non-equilibrium Box Axel Kohlmeyer
15:11 Re: [lammps-users] Cooling of Non-equilibrium Box Khaled Mohamed
15:10 [lammps-users] Feeding a file containing discrete time vs position data to LAMMPS Devanjith Fonseka
15:00 Re: [lammps-users] Cooling of Non-equilibrium Box Axel Kohlmeyer
14:45 Re: [lammps-users] Cooling of Non-equilibrium Box Khaled Mohamed
13:30 Re: [lammps-users] Cooling of Non-equilibrium Box Axel Kohlmeyer
12:09 Re: [lammps-users] kspace cutoff when separating an atom from the surface - limitation or error? Morrissey, Liam S.
10:56 Re: [lammps-users] Error: Illegal compute ptm/atom Axel Kohlmeyer
10:52 Re: [lammps-users] Hybrid command - mixed system with water and one organic molecule Axel Kohlmeyer
10:51 [lammps-users] Error: Illegal compute ptm/atom raja elapolu
10:35 [lammps-users] Hybrid command - mixed system with water and one organic molecule Paolo Botto
09:36 Re: [lammps-users] [EXTERNAL] Re: KOKKOS's poor performance Moore, Stan
08:56 [lammps-users] Cooling of Non-equilibrium Box Khaled Mohamed
01:42 Re: [lammps-users] aminos-modifed CNT Andrew Jewett
00:43 Re: [lammps-users] aminos-modifed CNT Musa Kamal
00:31 Re: [lammps-users] aminos-modifed CNT Andrew Jewett

December 01, 2020
19:02 Re: [lammps-users] [EXTERNAL] Re: KOKKOS's poor performance 吴标
17:37 Re: [lammps-users] trouble building LAMMPS with Kokkos Bradley D. Keister
16:50 Re: [lammps-users] Modified CH.rebo potential - LCBOPII potential Nicolas Leconte
16:44 Re: [lammps-users] ReaxFF for polymers Axel Kohlmeyer
15:43 Re: [lammps-users] ReaxFF for polymers Musa Kamal
15:42 Re: [lammps-users] trouble building LAMMPS with Kokkos Axel Kohlmeyer
15:37 Re: [lammps-users] trouble building LAMMPS with Kokkos Bradley D. Keister
15:29 Re: [lammps-users] ReaxFF for polymers Axel Kohlmeyer
15:26 [lammps-users] ReaxFF for polymers Musa Kamal
12:41 Re: [lammps-users] trouble building LAMMPS with Kokkos Axel Kohlmeyer
12:39 Re: [lammps-users] [EXTERNAL] Re: trouble building LAMMPS with Kokkos Moore, Stan
12:18 Re: [lammps-users] Plumed vs colvars Axel Kohlmeyer
11:57 [lammps-users] Plumed vs colvars MD Simulation
11:53 Re: [lammps-users] ERROR_ Cannot yet use pair hybrid with Kokkos Eduardo Estevez
11:47 Re: [lammps-users] trouble building LAMMPS with Kokkos Bradley D. Keister
11:17 Re: [lammps-users] Build LAMMPS with make nd cmake Axel Kohlmeyer
11:15 Re: [lammps-users] Build LAMMPS with make nd cmake Musa Kamal
11:11 Re: [lammps-users] Build LAMMPS with make nd cmake Axel Kohlmeyer
11:04 [lammps-users] Build LAMMPS with make nd cmake Musa Kamal
11:00 Re: [lammps-users] ERROR_ Cannot yet use pair hybrid with Kokkos Axel Kohlmeyer
10:37 [lammps-users] ERROR_ Cannot yet use pair hybrid with Kokkos Eduardo Estevez
08:24 Re: [lammps-users] [EXTERNAL] Re: trouble building LAMMPS with Kokkos Moore, Stan
08:20 Re: [lammps-users] [EXTERNAL] Re: KOKKOS's poor performance Moore, Stan
07:00 Re: [lammps-users] trouble building LAMMPS with Kokkos Bradley D. Keister
05:16 [lammps-users] Fix widom question Betim Bahtiri
05:12 Re: [lammps-users] ERROR: fix widom Betim Bahtiri
00:12 [lammps-users] Ellipsoidal shaped particles Mamta

November 30, 2020
23:53 [lammps-users] Ellipsoidal shaped particles mamta yadav
23:39 Re: [lammps-users] KOKKOS's poor performance 吴标
19:53 Re: [lammps-users] fix reax/c/species---cutoff Ray Shan
19:25 [lammps-users] fix reax/c/species---cutoff 吴标
15:50 Re: [lammps-users] [EXTERNAL] Re: trouble building LAMMPS with Kokkos Moore, Stan
14:15 Re: [lammps-users] [EXTERNAL] Building and Running LAMMPS Axel Kohlmeyer
13:42 Re: [lammps-users] [EXTERNAL] Building and Running LAMMPS Pascal Brault
13:31 Re: [lammps-users] trouble building LAMMPS with Kokkos Axel Kohlmeyer
13:22 Re: [lammps-users] [EXTERNAL] Building and Running LAMMPS Thompson, Aidan
12:50 Re: [lammps-users] trouble building LAMMPS with Kokkos Bradley D. Keister
10:18 Re: [lammps-users] [EXTERNAL] Re: trouble building LAMMPS with Kokkos Moore, Stan
09:39 Re: [lammps-users] trouble building LAMMPS with Kokkos Axel Kohlmeyer
09:29 [lammps-users] trouble building LAMMPS with Kokkos Bradley D. Keister
08:22 Re: [lammps-users] [EXTERNAL] Re: KOKKOS's poor performance Moore, Stan
06:55 Re: [lammps-users] query on kspace_modify slab to add vacuum Axel Kohlmeyer
06:51 Re: [lammps-users] KOKKOS's poor performance Axel Kohlmeyer
06:47 Re: [lammps-users] query on kspace_modify slab to add vacuum Ankit Chauhan
06:29 Re: [lammps-users] query on kspace_modify slab to add vacuum Axel Kohlmeyer
06:27 Re: [lammps-users] command to avoid elongation of bonds Ankit Chauhan
06:21 Re: [lammps-users] Conversion check from Gromacs to Lammps Axel Kohlmeyer
06:06 [lammps-users] query on kspace_modify slab to add vacuum Ankit Chauhan
06:03 Re: [lammps-users] command to avoid elongation of bonds Axel Kohlmeyer
06:01 [lammps-users] Conversion check from Gromacs to Lammps Li Xuejiao
05:23 Re: [lammps-users] ERROR: fix widom Axel Kohlmeyer
02:18 Re: [lammps-users] ERROR: fix widom Betim Bahtiri
02:09 [lammps-users] command to avoid elongation of bonds Ankit Chauhan
02:05 Re: [lammps-users] ERROR: fix widom Axel Kohlmeyer
01:15 Re: [lammps-users] ERROR: fix widom Betim Bahtiri
00:33 [lammps-users] write coeff in hybrid style omid gh

November 29, 2020
17:57 Re: [lammps-users] KOKKOS's poor performance 吴标
11:18 Re: [lammps-users] ERROR: fix widom Axel Kohlmeyer
06:21 Re: [lammps-users] KOKKOS's poor performance Axel Kohlmeyer
06:20 Re: [lammps-users] KOKKOS's poor performance 吴标
06:02 Re: [lammps-users] KOKKOS's poor performance Axel Kohlmeyer
05:35 [lammps-users] KOKKOS's poor performance 吴标
03:42 [lammps-users] ERROR: fix widom Betim Bahtiri
02:30 [lammps-users] Fw: Saad Muhammad Saad Ali

November 28, 2020
09:29 Re: [lammps-users] Issue generated by keywords aconstrain in fix bond/create/angle in large system Axel Kohlmeyer
00:19 [lammps-users] Issue generated by keywords aconstrain in fix bond/create/angle in large system Daibei Yang

November 27, 2020
12:32 Re: [lammps-users] granular fluctuations during equilibration Axel Kohlmeyer
12:23 Re: [lammps-users] Installation of Reactive force field with latest version of LAMMPS Axel Kohlmeyer
11:36 Re: [lammps-users] granular fluctuations during equilibration Devanjith Fonseka
07:27 [lammps-users] Installation of Reactive force field with latest version of LAMMPS Ankur Chaurasia
06:51 Re: [lammps-users] Spring Constant in fix spring/self command Axel Kohlmeyer
06:44 Re: [lammps-users] polymer edge sharp crack Chowdhury, Sanjib
06:35 Re: [lammps-users] polymer edge sharp crack Chowdhury, Sanjib
03:50 [lammps-users] Problem with the command msd/chunk Jose Carlos Madrid Madrid
00:03 Re: [lammps-users] polymer edge sharp crack Frank N

November 26, 2020
21:27 Re: [lammps-users] polymer edge sharp crack Chowdhury, Sanjib
21:01 Re: [lammps-users] How to compute ave/chunk Number Density along z axis? DMITRII RAKOV
20:52 Re: [lammps-users] polymer edge sharp crack Frank N
20:37 [lammps-users] about compute temp/partial rufer
19:10 Re: [lammps-users] Spring Constant in fix spring/self command Md.Mosarof Hossain
16:29 Re: [lammps-users] Spring Constant in fix spring/self command Axel Kohlmeyer
16:22 [lammps-users] Spring Constant in fix spring/self command Md.Mosarof Hossain
15:44 Re: [lammps-users] atomic atom style Axel Kohlmeyer
09:48 [lammps-users] atomic atom style rizky.ruliandini71
08:42 Re: [lammps-users] query for equilbration of system Ankit Chauhan
08:41 Re: [lammps-users] query for equilbration of system Ankit Chauhan
08:37 Re: [lammps-users] Running parallel Lammps on Windows Paolo Botto
08:27 Re: [lammps-users] Feeding fix output back into fix Axel Kohlmeyer
08:18 Re: [lammps-users] Running parallel Lammps on Windows Axel Kohlmeyer
04:01 [lammps-users] Running parallel Lammps on Windows Paolo Botto
02:53 Re: [lammps-users] [EXTERNAL] KOKKOS 吴标

November 25, 2020
22:25 [lammps-users] Feeding fix output back into fix S M
20:22 Re: [lammps-users] polymer edge sharp crack Chowdhury, Sanjib
14:49 [lammps-users] polymer edge sharp crack Frank N
13:14 Re: [lammps-users] pushing down the wall Taheri Afarani, Hajar
11:57 Re: [lammps-users] pushing down the wall Axel Kohlmeyer
09:22 [lammps-users] pushing down the wall Taheri Afarani, Hajar
09:00 Re: [lammps-users] [EXTERNAL] KOKKOS Moore, Stan
08:55 Re: [lammps-users] query for equilbration of system Vignesh M
04:39 Re: [lammps-users] query for equilbration of system Axel Kohlmeyer
04:30 Re: [lammps-users] How to compute ave/chunk Number Density along z axis? Axel Kohlmeyer
04:23 Re: [lammps-users] Segmentation fault after simulation Axel Kohlmeyer
03:10 [lammps-users] query for equilbration of system Ankit Chauhan
02:53 [lammps-users] How to compute ave/chunk Number Density along z axis? DMITRII RAKOV
00:32 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
00:31 [lammps-users] Segmentation fault after simulation Betim Bahtiri
00:27 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri

November 24, 2020
22:11 [lammps-users] query for running simulation at verly low temperature and getting nan while using rigid/nvt Ankit Chauhan
21:04 Re: [lammps-users] KOKKOS Axel Kohlmeyer
21:01 Re: [lammps-users] granular fluctuations during equilibration Devanjith Fonseka
20:53 Re: [lammps-users] granular fluctuations during equilibration Axel Kohlmeyer
18:46 [lammps-users] KOKKOS 吴标
17:09 Re: [lammps-users] Question about OMP Reza Namakian
17:05 Re: [lammps-users] Extract Atom ID across all Processors Axel Kohlmeyer
16:47 Re: [lammps-users] granular fluctuations during equilibration Devanjith Fonseka
15:51 Re: [lammps-users] Extract Atom ID across all Processors S M
14:37 Re: [lammps-users] the time in units lj Steve Plimpton
14:34 Re: [lammps-users] Question about OMP Steve Plimpton
14:23 Re: [lammps-users] About reaxx potential Steve Plimpton
13:36 [lammps-users] granular fluctuations during equilibration Devanjith Fonseka
12:10 [lammps-users] Green-Kubo HACF Mayank Gupta
01:27 [lammps-users] calculate local heat flux Wada,Makoto

November 23, 2020
18:05 Re: [lammps-users] aminos-modifed CNT Jacob Gissinger
17:51 Re: [lammps-users] aminos-modifed CNT Axel Kohlmeyer
17:25 Re: [lammps-users] Help with freezing atom positions Axel Kohlmeyer
14:50 [lammps-users] aminos-modifed CNT Musa Kamal
13:30 Re: [lammps-users] creating atom fractions with minimum spacing Axel Kohlmeyer
13:25 Re: [lammps-users] creating atom fractions with minimum spacing Bradley D. Keister
12:29 Re: [lammps-users] creating atom fractions with minimum spacing Jacob Gissinger
11:25 [lammps-users] creating atom fractions with minimum spacing Bradley D. Keister
11:14 [lammps-users] Help with freezing atom positions Justice Nkemakolam Iroegbu
06:50 Re: [lammps-users] Issue with set type/subset and mpi Prhashanna Ammu

November 22, 2020
22:56 Re: [lammps-users] the time in units lj Axel Kohlmeyer
22:46 Re: [lammps-users] the time in units lj Shuai Zhang
22:41 Re: [lammps-users] KOKKOS Axel Kohlmeyer
22:01 [lammps-users] KOKKOS 吴标
20:48 [lammps-users] Fwd: contact angle measurement Jyoti Roy Choudhuri
18:41 Re: [lammps-users] Question about OMP Reza Namakian
10:18 Re: [lammps-users] contact angle measurement Axel Kohlmeyer
10:15 Re: [lammps-users] Edge crack for amorphous polymer Axel Kohlmeyer
10:11 Re: [lammps-users] Help with applying electric potential Axel Kohlmeyer
10:05 Re: [lammps-users] the time in units lj Axel Kohlmeyer
08:05 Re: [lammps-users] fix deform on wrapped pr unwrapped Penghua Ying
04:19 [lammps-users] the time in units lj Shuai Zhang

November 21, 2020
23:45 [lammps-users] Edge crack for amorphous polymer Musa Kamal
19:21 Re: [lammps-users] request for information Steve Plimpton
19:04 Re: [lammps-users] Question about OMP Steve Plimpton
11:32 [lammps-users] Help with applying electric potential Justice Nkemakolam Iroegbu
07:54 Re: [lammps-users] Convert all atom EPDM pdb to lammps data Steve Plimpton
07:51 Re: [lammps-users] Stress fluctuations during a quasi-static granular compression simulation and stress tensor Steve Plimpton
04:43 [lammps-users] contact angle measurement vibhuti taneja
03:45 Re: [lammps-users] About ssDNA simulation Andrew Jewett
01:47 Re: [lammps-users] End to end distance for polymer Axel Kohlmeyer
01:41 Re: [lammps-users] Issue with set type/subset and mpi Axel Kohlmeyer
00:00 [lammps-users] End to end distance for polymer Musa Kamal

November 20, 2020
20:49 Re: [lammps-users] About ssDNA simulation Dezhao Huang
18:48 Re: [lammps-users] Issue with set type/subset and mpi Prhashanna Ammu
15:34 Re: [lammps-users] About ssDNA simulation Grey Geng
13:54 Re: [lammps-users] Issue with set type/subset and mpi Axel Kohlmeyer
13:43 [lammps-users] Issue with set type/subset and mpi Prhashanna Ammu
10:15 Re: [lammps-users] About ssDNA simulation Axel Kohlmeyer
10:04 Re: [lammps-users] [EXTERNAL] Re: Re: Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" Moore, Stan
09:53 [lammps-users] About ssDNA simulation Grey Geng
09:09 Re: [lammps-users] [EXTERNAL] Re: member named "inumeric" not found Moore, Stan
08:36 Re: [lammps-users] the difference of forcefield functional form between forcefield files and the lammps website Axel Kohlmeyer
08:27 [lammps-users] the difference of forcefield functional form between forcefield files and the lammps website 高攀
04:56 Re: [lammps-users] comm&modify Axel Kohlmeyer
01:06 [lammps-users] comm&modify 吴标
00:44 Re: [lammps-users] member named "inumeric" not found Betim Bahtiri
00:23 [lammps-users] member named "inumeric" not found Betim Bahtiri

November 19, 2020
23:04 Re: [lammps-users] [EXTERNAL] Re: Re: Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" 阮永金
12:59 Re: [lammps-users] Calculate forces on a rigid body in pair style DPD Axel Kohlmeyer
12:56 Re: [lammps-users] Calculate forces on a rigid body in pair style DPD Tanvir Hossain
12:39 Re: [lammps-users] Out of range atoms - cannot compute PPPM Axel Kohlmeyer
12:30 [lammps-users] Out of range atoms - cannot compute PPPM Musa Kamal
12:17 Re: [lammps-users] Calculate forces on a rigid body in pair style DPD Axel Kohlmeyer
11:42 [lammps-users] Calculate forces on a rigid body in pair style DPD Tan H
09:58 Re: [lammps-users] color-coding polymer blend based on polymer material Axel Kohlmeyer
09:51 [lammps-users] color-coding polymer blend based on polymer material Frank N
08:28 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault running on multiple nodes with kokkos and reaxff Moore, Stan
08:17 Re: [lammps-users] [EXTERNAL] Re: Re: Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" Moore, Stan
03:06 Re: [lammps-users] fix Wall Axel Kohlmeyer
01:40 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
00:39 [lammps-users] fix Wall Syed Shuja Zaidi (P19PH007)

November 18, 2020
22:39 Re: [lammps-users] Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" 阮永金
19:52 [lammps-users] fix deform on wrapped pr unwrapped Musa Kamal
15:10 [lammps-users] Fw: [EXTERNAL] Re: Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" Moore, Stan
14:42 Re: [lammps-users] [EXTERNAL] Re: gpu Axel Kohlmeyer
14:37 Re: [lammps-users] Setting the rdf computation in lammps Michael Chen
14:37 Re: [lammps-users] [EXTERNAL] Re: gpu Axel Kohlmeyer
14:35 Re: [lammps-users] [EXTERNAL] Re: Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" Moore, Stan
14:24 Re: [lammps-users] [EXTERNAL] Re: gpu Moore, Stan
14:22 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault running on multiple nodes with kokkos and reaxff Moore, Stan
14:10 Re: [lammps-users] [EXTERNAL] Re: Make new pair style compatible acceleration package Moore, Stan
14:01 Re: [lammps-users] Setting the rdf computation in lammps Axel Kohlmeyer
13:55 Re: [lammps-users] Setting the rdf computation in lammps Michael Chen
12:51 Re: [lammps-users] Setting the rdf computation in lammps Axel Kohlmeyer
09:00 Re: [lammps-users] Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" Axel Kohlmeyer
06:41 [lammps-users] Setting the rdf computation in lammps Michael Chen

November 17, 2020
23:10 Re: [lammps-users] mpirun/mpiexec/-omp Axel Kohlmeyer
22:58 [lammps-users] mpirun/mpiexec/-omp 吴标
16:14 [lammps-users] Test LAMMPS with Kokkos while meeting "invalid permissions for mapped object at address" 阮永金
15:05 [lammps-users] One fully-funded PhD position in computational nanomaterials at the University of Vermont Jihong Ma
13:59 Re: [lammps-users] Merge two forcefield Axel Kohlmeyer
13:44 [lammps-users] Merge two forcefield Musa Kamal
08:15 [lammps-users] 回复: How to install the user-vcsgc into lammps Zhang Xiangkai
05:46 Re: [lammps-users] How to install the user-vcsgc into lammps Axel Kohlmeyer

November 16, 2020
23:46 [lammps-users] How to install the user-vcsgc into lammps Zhang Xiangkai
14:12 Re: [lammps-users] compute energy by group/group Michael Chen
14:06 Re: [lammps-users] compute energy by group/group Axel Kohlmeyer
14:01 Re: [lammps-users] compute energy by group/group Michael Chen
13:33 Re: [lammps-users] compute energy by group/group Axel Kohlmeyer
12:40 [lammps-users] compute energy by group/group Michael Chen
11:16 [lammps-users] (no subject) Ma, Duancheng
11:15 [lammps-users] (no subject) Ma, Duancheng
08:28 Re: [lammps-users] bonded interaction warnings Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
08:17 Re: [lammps-users] bonded interaction warnings Axel Kohlmeyer
07:31 [lammps-users] bonded interaction warnings Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
01:41 Re: [lammps-users] FIX WALL Command and OPLS force field Paolo Botto

November 15, 2020
11:29 Re: [lammps-users] FIX WALL Command and OPLS force field Axel Kohlmeyer
09:12 Re: [lammps-users] FIX WALL Command and OPLS force field Paolo Botto
05:00 Re: [lammps-users] FIX WALL Command and OPLS force field Axel Kohlmeyer
04:31 [lammps-users] FIX WALL Command and OPLS force field Paolo Botto

November 14, 2020
22:52 Re: [lammps-users] Add compatibilizer to polymer blend Andrew Jewett
07:26 Re: [lammps-users] An error while install MESSAGE package Axel Kohlmeyer
06:33 [lammps-users] An error while install MESSAGE package 李吉辰

November 13, 2020
19:51 Re: [lammps-users] Extract Atom ID across all Processors Axel Kohlmeyer
18:53 [lammps-users] Extract Atom ID across all Processors S M
17:20 Re: [lammps-users] request for information Mahmudul Islam
08:39 [lammps-users] request for information Asmat Ullah
02:38 Re: [lammps-users] No effect of Self-propulsion on the dynamics of the particle in 3D simulations while it is working in 2D simulations. Jitendra Bahadur
00:06 Re: [lammps-users] No effect of Self-propulsion on the dynamics of the particle in 3D simulations while it is working in 2D simulations. Axel Kohlmeyer

November 12, 2020
23:15 [lammps-users] No effect of Self-propulsion on the dynamics of the particle in 3D simulations while it is working in 2D simulations. kumarpraveen
09:01 Re: [lammps-users] kspace cutoff when separating an atom from the surface - limitation or error? Morrissey, Liam S.

November 11, 2020
22:28 Re: [lammps-users] About reaxx potential ashish singh
21:39 Re: [lammps-users] Regarding pressure calculation of a NVT Simulation Axel Kohlmeyer
21:31 Re: [lammps-users] Regarding pressure calculation of a NVT Simulation Shrabanti Bhattacharya
21:14 Re: [lammps-users] Regarding pressure calculation of a NVT Simulation Axel Kohlmeyer
20:19 [lammps-users] Regarding pressure calculation of a NVT Simulation Shrabanti Bhattacharya
14:09 Re: [lammps-users] Coordinates of interacting pairs Axel Kohlmeyer
08:29 [lammps-users] Coordinates of interacting pairs Giuseppe Petrillo
08:08 Re: [lammps-users] ClayFF force field - Bond coefficients Axel Kohlmeyer
06:37 [lammps-users] ClayFF force field - Bond coefficients Isa Silveira Araujo
06:00 Re: [lammps-users] Electrode/ionic liquid interface with CPM on LAMMPS: Difference between using hybrid lj/cut/coul/long and lj/cut/coul/long LJ parameters Agilio Padua
05:36 [lammps-users] Help needed for potentials/Au_u3.eam yen fred woguem
05:19 Re: [lammps-users] Help needed for potentials/Au_u3.eam Axel Kohlmeyer
03:45 Re: [lammps-users] Electrode/ionic liquid interface with CPM on LAMMPS: Difference between using hybrid lj/cut/coul/long and lj/cut/coul/long LJ parameters DMITRII RAKOV
02:44 Re: [lammps-users] Electrode/ionic liquid interface with CPM on LAMMPS: Difference between using hybrid lj/cut/coul/long and lj/cut/coul/long LJ parameters Agilio Padua
02:17 Re: [lammps-users] Question about fix atom/swap Hao Chen
00:05 [lammps-users] Electrode/ionic liquid interface with CPM on LAMMPS: Difference between using hybrid lj/cut/coul/long and lj/cut/coul/long LJ parameters DMITRII RAKOV

November 10, 2020
14:26 Re: [lammps-users] Issue with gather_atoms in 29 Oct 2020 release Pelin S Bulutoglu
13:54 Re: [lammps-users] Issue with gather_atoms in 29 Oct 2020 release Richard Berger
12:37 [lammps-users] Issue with gather_atoms in 29 Oct 2020 release Pelin S Bulutoglu
12:20 [lammps-users] Issue with gather_atoms in 29 Oct 2020 release Pelin S Bulutoglu
12:06 Re: [lammps-users] problem with compute group/group in rerun Axel Kohlmeyer
11:56 Re: [lammps-users] problem with compute group/group in rerun Zari kargar
07:55 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
07:51 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Axel Kohlmeyer
07:29 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
07:26 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Axel Kohlmeyer
07:16 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
06:39 Re: [lammps-users] Inserting fix widom in older Lammps version Axel Kohlmeyer
06:38 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Axel Kohlmeyer
06:19 Re: [lammps-users] Problem about CG and fix box/relax Axel Kohlmeyer
06:01 [lammps-users] Problem about CG and fix box/relax yen fred woguem
05:21 [lammps-users] Inserting fix widom in older Lammps version Betim Bahtiri
04:17 Re: [lammps-users] hardware 吴标
02:51 Re: [lammps-users] passing variables through to a fix that calls another fix Axel Kohlmeyer
02:22 Re: [lammps-users] About reaxx potential Axel Kohlmeyer

November 09, 2020
23:38 [lammps-users] About reaxx potential ashish singh
21:12 [lammps-users] passing variables through to a fix that calls another fix Shern Tee
19:41 Re: [lammps-users] gpu Axel Kohlmeyer
19:32 Re: [lammps-users] gpu Ray Shan
19:27 Re: [lammps-users] gpu Axel Kohlmeyer
19:22 Re: [lammps-users] gpu 吴标
17:19 Re: [lammps-users] Issues With Dumping Variable in LAMMPS Axel Kohlmeyer
14:16 [lammps-users] Issues With Dumping Variable in LAMMPS Palchowdhury, Sourav
11:38 Re: [lammps-users] Problems with peridynamics add-on Axel Kohlmeyer
11:27 Re: [lammps-users] gpu Axel Kohlmeyer
08:30 [lammps-users] gpu 吴标
07:37 [lammps-users] kspace cutoff when separating an atom from the surface - limitation or error? Morrissey, Liam S.
07:27 [lammps-users] Problems with peridynamics add-on All Hail To Mary
06:43 [lammps-users] Phase factor in dihedral term Ankit Chauhan
02:59 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri

November 08, 2020
21:36 Re: [lammps-users] Problem with fix self/propel RAJIB SAHOO
09:11 Re: [lammps-users] Problem with fix self/propel Axel Kohlmeyer
09:07 Re: [lammps-users] problem with compute group/group in rerun Axel Kohlmeyer

November 07, 2020
13:29 [lammps-users] if command for grouping molecules omid gh
11:27 [lammps-users] Problem with fix self/propel RAJIB SAHOO
09:23 [lammps-users] problem with compute group/group in rerun Zari kargar

November 06, 2020
13:31 Re: [lammps-users] heat current calculation Axel Kohlmeyer
13:23 Re: [lammps-users] heat current calculation Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
13:15 Re: [lammps-users] heat current calculation Axel Kohlmeyer
10:26 Re: [lammps-users] heat current calculation Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
10:08 Re: [lammps-users] Granular potential energy zero Axel Kohlmeyer
09:54 Re: [lammps-users] Granular potential energy zero Devanjith Fonseka
02:53 [lammps-users] Question about fix atom/swap Hao Chen

November 05, 2020
13:48 Re: [lammps-users] The error in ELASTIC sample Yi Yao
13:47 Re: [lammps-users] The error in ELASTIC sample Yi Yao
12:10 Re: [lammps-users] heat current calculation Axel Kohlmeyer
12:05 Re: [lammps-users] heat current calculation Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
11:49 Re: [lammps-users] The error in ELASTIC sample Axel Kohlmeyer
10:38 Re: [lammps-users] Granular potential energy zero Axel Kohlmeyer
09:37 Re: [lammps-users] Dihedral syntax Ankit Chauhan
09:11 [lammps-users] Granular potential energy zero Devanjith Fonseka
08:37 Re: [lammps-users] The error in ELASTIC sample Yi Yao
03:25 Re: [lammps-users] Monolayer tilt angles from LAMMPS inertia tensor output Axel Kohlmeyer
00:15 Re: [lammps-users] hardware 吴标

November 04, 2020
18:38 Re: [lammps-users] Monolayer tilt angles from LAMMPS inertia tensor output Marie Armbruster
17:38 Re: [lammps-users] Modified CH.rebo potential - LCBOPII potential Nicolas Leconte
16:56 Re: [lammps-users] Modified CH.rebo potential - LCBOPII potential Axel Kohlmeyer
16:51 Re: [lammps-users] hardware Axel Kohlmeyer
16:42 Re: [lammps-users] CNT Parameters for pair_style bop Axel Kohlmeyer
16:34 Re: [lammps-users] Monolayer tilt angles from LAMMPS inertia tensor output Axel Kohlmeyer
13:43 [lammps-users] CNT Parameters for pair_style bop Mohamed Gaber
13:41 [lammps-users] Monolayer tilt angles from LAMMPS inertia tensor output Marie Armbruster
09:37 Re: [lammps-users] The error in ELASTIC sample Axel Kohlmeyer
08:28 [lammps-users] The error in ELASTIC sample Yi Yao
06:52 Re: [lammps-users] Issue about read_data command and the number of CPUs processors Ivan Moncayo
01:59 [lammps-users] hardware 吴标

November 03, 2020
22:54 [lammps-users] Modified CH.rebo potential - LCBOPII potential Nicolas Leconte
16:34 Re: [lammps-users] Issue about read_data command and the number of CPUs processors Axel Kohlmeyer
13:34 Re: [lammps-users] Expected floating point parameter in input script error for fix wall/gran Axel Kohlmeyer
12:05 Re: [lammps-users] Expected floating point parameter in input script error for fix wall/gran Devanjith Fonseka
11:52 Re: [lammps-users] Issue about read_data command and the number of CPUs processors Ivan Moncayo
11:20 Re: [lammps-users] Expected floating point parameter in input script error for fix wall/gran Axel Kohlmeyer
10:37 [lammps-users] Expected floating point parameter in input script error for fix wall/gran Devanjith Fonseka
10:31 Re: [lammps-users] Issue about read_data command and the number of CPUs processors Axel Kohlmeyer
10:11 [lammps-users] Issue about read_data command and the number of CPUs processors Ivan Moncayo
05:59 [lammps-users] One dimension simulation in LAMMPS Mohammed Alhissi
02:23 Re: [lammps-users] REAXFF-atom_style charge Axel Kohlmeyer
02:13 Re: [lammps-users] Problem With Running an Example in Ubuntu Axel Kohlmeyer
01:56 [lammps-users] LAMMPS simulation for droplet spreading on surface UTSAV SAHU

November 02, 2020
22:31 Re: [lammps-users] REAXFF-atom_style charge 吴标
22:04 [lammps-users] Problem With Running an Example in Ubuntu Yeasir Mohammad Akib
19:09 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
11:16 [lammps-users] Add compatibilizer to polymer blend Musa Kamal
11:08 [lammps-users] MD simulation of a LAngmuir-Blodgett trough Paolo Botto
10:23 Re: [lammps-users] obtaining forces from each potential with pair_style hybrid/overlay Axel Kohlmeyer
10:02 Re: [lammps-users] RV: Granular and Hybrid neighbor list. Axel Kohlmeyer
09:47 [lammps-users] obtaining forces from each potential with pair_style hybrid/overlay Leonid Kahle
09:42 Re: [lammps-users] RV: Granular and Hybrid neighbor list. Axel Kohlmeyer
09:34 Re: [lammps-users] Regarding pot_style and minimize Anirudh Nandakumar
09:15 Re: [lammps-users] Regarding pot_style and minimize Axel Kohlmeyer
08:57 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Axel Kohlmeyer
08:48 Re: [lammps-users] REAXFF-atom_style charge Axel Kohlmeyer
07:11 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
06:59 [lammps-users] Regarding pot_style and minimize Anirudh Nandakumar
05:56 [lammps-users] RV: Granular and Hybrid neighbor list. Oier Arcelus
05:47 [lammps-users] REAXFF-atom_style charge 吴标
01:15 [lammps-users] Question about OMP Reza Namakian
00:27 Re: [lammps-users] Flip in fix deform Vishnu V. Krishnan

November 01, 2020
14:45 Re: [lammps-users] Flip in fix deform David Nicholson
13:15 Re: [lammps-users] Minimization of reaxff simulation Axel Kohlmeyer
13:12 [lammps-users] Minimization of reaxff simulation Betim Bahtiri
12:57 Re: [lammps-users] large time required for tension test simulations Axel Kohlmeyer
12:48 Re: [lammps-users] Fw: pair_write doesn't work with pair granular Axel Kohlmeyer
12:29 [lammps-users] Fw: pair_write doesn't work with pair granular Setare Dodangeh
10:09 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
08:53 Re: [lammps-users] elastic constant script for non-orthogonal lattice Axel Kohlmeyer
08:44 [lammps-users] elastic constant script for non-orthogonal lattice Michael Brunsteiner
08:24 Re: [lammps-users] hot-drawing polymer nanofiber by fix addforce Axel Kohlmeyer
08:01 Re: [lammps-users] Coulombic interactions causing "Pair coeffs not set" error Axel Kohlmeyer
04:45 Re: [lammps-users] Print Energy contribution from Ei and Eaa separately Ankit Chauhan
03:22 [lammps-users] Coulombic interactions causing "Pair coeffs not set" error KRUTARTH HEMANT KHOT 17110075

October 31, 2020
21:08 Re: [lammps-users] Why fix deform command won't stop deforming? Axel Kohlmeyer
20:50 [lammps-users] Why fix deform command won't stop deforming? Hossein Goushov
18:00 [lammps-users] hot-drawing polymer nanofiber by fix addforce Musa Kamal
16:19 Re: [lammps-users] compute rdf vs. compute pressure/cylinder Axel Kohlmeyer
16:10 [lammps-users] compute rdf vs. compute pressure/cylinder Musa Kamal
09:59 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Axel Kohlmeyer
09:38 Re: [lammps-users] Rigid molecule explosion Axel Kohlmeyer
09:32 Re: [lammps-users] Print Energy contribution from Ei and Eaa separately Axel Kohlmeyer
07:51 [lammps-users] Print Energy contribution from Ei and Eaa separately Ankit Chauhan
07:19 Re: [lammps-users] problem with fix propel/self and atom_style hybrid Zahra Fazli
03:45 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri
03:11 Re: [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Axel Kohlmeyer
03:02 Re: [lammps-users] problem with fix propel/self and atom_style hybrid Axel Kohlmeyer
02:41 [lammps-users] problem with fix propel/self and atom_style hybrid Zahra Fazli
01:57 [lammps-users] Segmentation fault running on multiple nodes with kokkos and reaxff Betim Bahtiri

October 30, 2020
23:24 [lammps-users] use psf file with xyz dump file omid gh
10:54 [lammps-users] Postdoc position - Purdue/ARL Larentzos, James P CIV USARMY CCDC ARL (USA)
10:00 Re: [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Eric Murphy
09:56 Re: [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Devanjith Fonseka
09:54 Re: [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Eric Murphy
08:34 Re: [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Axel Kohlmeyer
08:24 Re: [lammps-users] calculationg the number of collision Axel Kohlmeyer
08:16 Re: [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Devanjith Fonseka
08:08 [lammps-users] calculationg the number of collision hamid babaiean
07:56 Re: [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Axel Kohlmeyer
07:48 Re: [lammps-users] Granular and Hybrid neighbor list. Axel Kohlmeyer
07:18 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
07:18 Re: [lammps-users] Granular and Hybrid neighbor list. Oier Arcelus
07:17 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
07:16 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
07:14 [lammps-users] Meaning of temperature in a NPT/sphere granular simulation Devanjith Fonseka
07:14 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
07:12 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
07:11 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
07:02 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
06:52 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
06:50 [lammps-users] Flip in fix deform Vishnu V. Krishnan
06:49 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
06:45 Re: [lammps-users] Granular and Hybrid neighbor list. Axel Kohlmeyer
06:43 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
06:38 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
06:26 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
06:21 Re: [lammps-users] Granular and Hybrid neighbor list. Oier Arcelus
06:03 Re: [lammps-users] Granular and Hybrid neighbor list. Axel Kohlmeyer
04:50 Re: [lammps-users] Granular and Hybrid neighbor list. Oier Arcelus
04:47 Re: [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Axel Kohlmeyer
02:37 Re: [lammps-users] Rigid molecule explosion Sugden, Isaac J
02:14 [lammps-users] KOKKOS-OMP is slower than MPI with reaxff Betim Bahtiri
01:06 Re: [lammps-users] storing variables in loop at intermediate steps Axel Kohlmeyer
00:54 [lammps-users] storing variables in loop at intermediate steps Deepak Pawar

October 29, 2020
17:58 [lammps-users] new stable release Steve Plimpton
17:54 Re: [lammps-users] Granular and Hybrid neighbor list. Steve Plimpton
06:36 Re: [lammps-users] Dihedral parameters in pcff Ankit Chauhan
04:49 Re: [lammps-users] fix "propel/self" Axel Kohlmeyer
04:39 [lammps-users] fix "propel/self" masoud mirzaei

October 28, 2020
19:48 Re: [lammps-users] Make new pair style compatible acceleration package Axel Kohlmeyer
19:09 [lammps-users] Make new pair style compatible acceleration package liuh18
15:49 Re: [lammps-users] Best ensemble for polymer tensile test Will Pisani
14:29 Re: [lammps-users] Regarding a problem with Ellipsoid atom_style with self-propulsion and using a Hybrid style with self-propulsion deepthigomez@...16...
14:24 Re: [lammps-users] Regarding a problem with Ellipsoid atom_style with self-propulsion and using a Hybrid style with self-propulsion Axel Kohlmeyer
14:19 [lammps-users] Regarding a problem with Ellipsoid atom_style with self-propulsion and using a Hybrid style with self-propulsion deepthigomez@...16...
13:02 Re: [lammps-users] Crosslinking via python script Axel Kohlmeyer
12:52 Re: [lammps-users] Crosslinking via python script Frank N
12:35 Re: [lammps-users] Crosslinking via python script Axel Kohlmeyer
11:53 [lammps-users] Best ensemble for polymer tensile test Musa Kamal
08:54 Re: [lammps-users] special_bonds lj/coul command Axel Kohlmeyer
08:50 Re: [lammps-users] special_bonds lj/coul command Reisjalali, Maryam
08:32 Re: [lammps-users] Crosslinking via python script Frank N
06:42 Re: [lammps-users] Crosslinking via python script Jacob Gissinger
05:18 Re: [lammps-users] Crosslinking via python script Axel Kohlmeyer
05:05 Re: [lammps-users] Crosslinking via python script Frank N
04:38 Re: [lammps-users] Crosslinking via python script Axel Kohlmeyer
04:32 [lammps-users] Crosslinking via python script Frank N
02:22 Re: [lammps-users] Problem with reax force field for earlier versions of LAMMPS (10Aug15) Axel Kohlmeyer
02:14 Re: [lammps-users] Seeking Suggestions reagrding varying pH of system present in reduced units Axel Kohlmeyer
00:56 [lammps-users] Problem with reax force field for earlier versions of LAMMPS (10Aug15) Sumit Bawari

October 27, 2020
23:14 [lammps-users] Seeking Suggestions reagrding varying pH of system present in reduced units Rajesh Pothukuchi
11:52 Re: [lammps-users] CVFF interatomic potential Axel Kohlmeyer
11:52 Re: [lammps-users] CVFF interatomic potential Ray Shan
11:40 [lammps-users] CVFF interatomic potential CHABBA Hanae
10:17 Re: [lammps-users] Convert all atom EPDM pdb to lammps data Frank N
09:17 Re: [lammps-users] extend lammps Chandana Mondal
08:33 Re: [lammps-users] special_bonds lj/coul command Axel Kohlmeyer
08:23 Re: [lammps-users] special_bonds lj/coul command Reisjalali, Maryam
08:19 Re: [lammps-users] special_bonds lj/coul command Axel Kohlmeyer
07:40 Re: [lammps-users] LAMMPS GPU package bad performance Axel Kohlmeyer
07:29 Re: [lammps-users] LAMMPS GPU package bad performance Ohl, Michael
07:26 Re: [lammps-users] extend lammps Axel Kohlmeyer
07:21 [lammps-users] special_bonds lj/coul command Reisjalali, Maryam
03:57 [lammps-users] extend lammps Chandana Mondal
03:52 Re: [lammps-users] nematic active force Chandana Mondal
02:49 Re: [lammps-users] Granular and Hybrid neighbor list. Oier Arcelus

October 26, 2020
20:32 Re: [lammps-users] Convert all atom EPDM pdb to lammps data Hossein Goushov
17:11 Re: [lammps-users] Convert all atom EPDM pdb to lammps data Axel Kohlmeyer
15:44 [lammps-users] Convert all atom EPDM pdb to lammps data Frank N
13:55 Re: [lammps-users] [EXTERNAL] Diffusion Coefficient in 3d Follow up on John Smith Comments Diffuse Example Thompson, Aidan
13:39 Re: [lammps-users] Help in n-Dodecane Liquid-Vapor Equilibrium Simulation Axel Kohlmeyer
13:35 Re: [lammps-users] Seeking for help regarding water droplet evaporation from a surface Axel Kohlmeyer
13:12 Re: [lammps-users] [EXTERNAL] Diffusion Coefficient in 3d Follow up on John Smith Comments Diffuse Example Bell, Ian H. (Fed)
12:42 [lammps-users] Stress fluctuations during a quasi-static granular compression simulation and stress tensor Fonseka, Devanjith
12:01 [lammps-users] CORE SHELL MODEL omid gh
11:56 Re: [lammps-users] LAMMPS GPU package bad performance Axel Kohlmeyer
11:32 Re: [lammps-users] LAMMPS GPU package bad performance Ohl, Michael
10:39 Re: [lammps-users] [EXTERNAL] Output in Windows Platform Thompson, Aidan
10:38 Re: [lammps-users] Dihedral syntax Ankit Chauhan
10:38 Re: [lammps-users] Output in Windows Platform Axel Kohlmeyer
10:37 Re: [lammps-users] [EXTERNAL] Dihedral syntax Ankit Chauhan
10:34 Re: [lammps-users] Dihedral syntax Axel Kohlmeyer
10:33 Re: [lammps-users] [EXTERNAL] Dihedral syntax Thompson, Aidan
10:21 [lammps-users] Dihedral syntax Ankit Chauhan
10:19 [lammps-users] Output in Windows Platform Yeasir Mohammad Akib
10:03 Re: [lammps-users] [EXTERNAL] Diffusion Coefficient in 3d Follow up on John Smith Comments Diffuse Example Thompson, Aidan
09:43 [lammps-users] Machine-learning post-doc opening Thompson, Aidan
09:10 [lammps-users] Seeking for help regarding water droplet evaporation from a surface SAMYABRATA CHATTERJEE 18210074
08:50 Re: [lammps-users] LAMMPS GPU package bad performance Axel Kohlmeyer
08:37 Re: [lammps-users] LAMMPS GPU package bad performance Ohl, Michael
08:09 [lammps-users] FW: Rigid molecule explosion Sugden, Isaac J

October 25, 2020
19:22 [lammps-users] Diffusion Coefficient in 3d Follow up on John Smith Comments Diffuse Example Jordan Campbell

October 24, 2020
20:52 [lammps-users] Help in n-Dodecane Liquid-Vapor Equilibrium Simulation Jesus Gutierrez Plascencia
17:42 [lammps-users] Fwd: Fwd: How To Model Graphene Sheets Under Constant In-plane Stress (W/O IN-PLANE DEFORMATION) ? Hossein Goushov
15:49 Re: [lammps-users] read_restart doesn't set the simulation box Antoine Rincent
13:35 Re: [lammps-users] read_restart doesn't set the simulation box Axel Kohlmeyer
13:30 Re: [lammps-users] read_restart doesn't set the simulation box Axel Kohlmeyer
13:01 [lammps-users] read_restart doesn't set the simulation box Antoine Rincent
12:49 Re: [lammps-users] large time required for tension test simulations Will Pisani
11:24 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
10:13 Re: [lammps-users] Fwd: How To Model Graphene Sheets Under Constant In-plane Stress (W/O IN-PLANE DEFORMATION) ? Axel Kohlmeyer
09:13 [lammps-users] Fwd: How To Model Graphene Sheets Under Constant In-plane Stress (W/O IN-PLANE DEFORMATION) ? Hossein Goushov
06:21 [lammps-users] comments not mentioned for some entries Ankit Chauhan
06:18 Re: [lammps-users] Using atom_style template Axel Kohlmeyer
04:41 Re: [lammps-users] Unrecognized fix style (src/modify.cpp:901) Axel Kohlmeyer
04:37 [lammps-users] Unrecognized fix style (src/modify.cpp:901) masoud mirzaei
03:29 Re: [lammps-users] How to set the temperature of NEB process Axel Kohlmeyer
01:43 Re: [lammps-users] Dihedral parameters in pcff Andrew Jewett
01:12 Re: [lammps-users] Dihedral parameters in pcff Ankit Chauhan
00:58 [lammps-users] How to set the temperature of NEB process 丁茜
00:54 Re: [lammps-users] Dihedral parameters in pcff Andrew Jewett
00:47 [lammps-users] How to set the temperature of NEB process 丁茜
00:25 [lammps-users] Dihedral parameters in pcff Ankit Chauhan

October 23, 2020
14:48 Re: [lammps-users] Using atom_style template ericabird
14:28 Re: [lammps-users] Using atom_style template Axel Kohlmeyer
14:14 Re: [lammps-users] Chain initialization Andrew Jewett
14:01 Re: [lammps-users] Using atom_style template ericabird
13:59 Re: [lammps-users] Using atom_style template ericabird
13:57 Re: [lammps-users] Chain initialization Andrew Jewett
12:50 Re: [lammps-users] (no subject) Steve Plimpton
12:44 Re: [lammps-users] Granular and Hybrid neighbor list. Steve Plimpton
12:35 Re: [lammps-users] Chain initialization Steve Plimpton
12:30 Re: [lammps-users] nematic active force Steve Plimpton
12:24 [lammps-users] next stable release Steve Plimpton
11:50 Re: [lammps-users] Calculating per-atom quantity from dihedral list before force computation Nikolai D. Petsev
05:38 Re: [lammps-users] LAMMPS GPU package bad performance Axel Kohlmeyer
05:29 Re: [lammps-users] Dump to memory instead of disk? Axel Kohlmeyer
04:59 Re: [lammps-users] Dump to memory instead of disk? Vishnu V. Krishnan
04:35 Re: [lammps-users] Dump to memory instead of disk? Axel Kohlmeyer
04:27 Re: [lammps-users] Dump to memory instead of disk? Vishnu V. Krishnan
04:14 [lammps-users] LAMMPS GPU package bad performance Ingo Meyer
02:09 Re: [lammps-users] Dump to memory instead of disk? Axel Kohlmeyer
01:35 Re: [lammps-users] Dump to memory instead of disk? Vishnu V. Krishnan
01:04 Re: [lammps-users] Dump to memory instead of disk? Axel Kohlmeyer
01:03 Re: [lammps-users] Dump to memory instead of disk? Axel Kohlmeyer
00:52 Re: [lammps-users] Dump to memory instead of disk? Vishnu V. Krishnan
00:49 [lammps-users] Dump to memory instead of disk? Vishnu V. Krishnan

October 22, 2020
23:59 Re: [lammps-users] [lammp-users] neb question Axel Kohlmeyer
23:52 Re: [lammps-users] Using atom_style template Axel Kohlmeyer
23:44 Re: [lammps-users] [lammp-users] neb question Jay Wai
22:51 Re: [lammps-users] Using atom_style template ericabird
21:17 Re: [lammps-users] Using atom_style template Axel Kohlmeyer
21:12 Re: [lammps-users] Using atom_style template ericabird
19:07 Re: [lammps-users] Using atom_style template Axel Kohlmeyer
18:01 [lammps-users] Using atom_style template ericabird
16:39 Re: [lammps-users] [lammp-users] neb question Axel Kohlmeyer
16:25 Re: [lammps-users] [lammp-users] neb question Jay Wai
11:54 Re: [lammps-users] (no subject) anis chaouachi
08:52 Re: [lammps-users] (no subject) Axel Kohlmeyer
08:50 [lammps-users] (no subject) anis chaouachi
07:43 Re: [lammps-users] RV: Granular and Hybrid neighbor list. Oier Arcelus
07:40 Re: [lammps-users] RV: Granular and Hybrid neighbor list. Axel Kohlmeyer
07:07 [lammps-users] RV: Granular and Hybrid neighbor list. Oier Arcelus
07:03 Re: [lammps-users] Granular and Hybrid neighbor list. Axel Kohlmeyer
07:00 Re: [lammps-users] Granular and Hybrid neighbor list. Oier Arcelus
06:50 Re: [lammps-users] [lammp-users] neb question Axel Kohlmeyer
06:41 [lammps-users] [lammp-users] neb question Jay Wai
06:40 Re: [lammps-users] Granular and Hybrid neighbor list. Axel Kohlmeyer
06:15 [lammps-users] Granular and Hybrid neighbor list. Oier Arcelus
02:54 Re: [lammps-users] Regarding water script file Chamara Somarathna
02:37 [lammps-users] Regarding water script file B Sai Harshit

October 21, 2020
13:41 Re: [lammps-users] Calculating per-atom quantity from dihedral list before force computation Axel Kohlmeyer
12:26 Re: [lammps-users] Calculating per-atom quantity from dihedral list before force computation Nikolai D. Petsev
07:11 Re: [lammps-users] fix addforce command problem Julien Guénolé
07:05 Re: [lammps-users] fix addforce command problem Axel Kohlmeyer
06:59 Re: [lammps-users] fix addforce command problem Frank N
06:42 Re: [lammps-users] fix addforce command problem Axel Kohlmeyer
06:35 Re: [lammps-users] fix addforce command problem Frank N
06:01 Re: [lammps-users] fix addforce command problem Axel Kohlmeyer
05:43 [lammps-users] fix addforce command problem Frank N
00:53 Re: [lammps-users] Fwd: VMD topo fail Ting Hu

October 20, 2020
19:30 Re: [lammps-users] minimising Streitz-Mintmire potential Axel Kohlmeyer
18:44 Re: [lammps-users] Fwd: VMD topo fail Andrew Jewett
17:13 Re: [lammps-users] minimising Streitz-Mintmire potential Bipin kumar
15:11 [lammps-users] DREIDING force field Andrew Jewett
13:24 Re: [lammps-users] (no subject) alberto
12:44 [lammps-users] Final test for updated packaging of LAMMPS for Windows LAMMPS Developers
10:07 Re: [lammps-users] The relaxation for FeCoCrNiMo high entropy alloy Axel Kohlmeyer
10:05 Re: [lammps-users] The relaxation for FeCoCrNiMo high entropy alloy Sebastian Hütter
09:57 Re: [lammps-users] The relaxation for FeCoCrNiMo high entropy alloy Yi Yao
09:55 Re: [lammps-users] NVT ensemble Axel Kohlmeyer
09:48 [lammps-users] NVT ensemble Frank N
09:46 Re: [lammps-users] The relaxation for FeCoCrNiMo high entropy alloy Axel Kohlmeyer
09:10 [lammps-users] The relaxation for FeCoCrNiMo high entropy alloy Yi Yao
08:48 Re: [lammps-users] Chain initialization Bell, Ian H. (Fed)

October 19, 2020
23:15 Re: [lammps-users] ERROR: Unknown identifier in data file: 12 atom types (../read_data.cpp:742) Ankit Chauhan
23:00 Re: [lammps-users] Fwd: VMD topo fail Ting Hu
22:58 Re: [lammps-users] Fwd: VMD topo fail Axel Kohlmeyer
22:57 Re: [lammps-users] MPI error with reax/c Filip Simeski
22:53 Re: [lammps-users] Fwd: VMD topo fail Ting Hu
21:48 Re: [lammps-users] Fwd: VMD topo fail Axel Kohlmeyer
21:38 [lammps-users] Fwd: Fwd: VMD topo fail Ting Hu
21:18 Re: [lammps-users] Fwd: VMD topo fail Axel Kohlmeyer
20:30 [lammps-users] Fwd: VMD topo fail Ting Hu
20:22 [lammps-users] non-conservation in nve ensemble (opls-aa force field) Xiaoyu Chen
17:26 [lammps-users] MPC Tool Khaled Mohamed
15:44 Re: [lammps-users] nematic active force Chandana Mondal
12:44 Re: [lammps-users] Restart parallel tempering using .mpiio file? Smith, Harper E.
12:29 Re: [lammps-users] Restart parallel tempering using .mpiio file? Axel Kohlmeyer
12:23 Re: [lammps-users] Restart parallel tempering using .mpiio file? Smith, Harper E.
11:47 Re: [lammps-users] MPI error with reax/c Axel Kohlmeyer
11:41 Re: [lammps-users] Restart parallel tempering using .mpiio file? Axel Kohlmeyer
11:09 Re: [lammps-users] MPI error with reax/c Guzman, Francisco
11:07 Re: [lammps-users] [EXTERNAL] Re: MPI error with reax/c Jones, Keith
10:58 Re: [lammps-users] pair style mm3/switch3/coulgauss/long not working with hybrid keyword Axel Kohlmeyer
10:57 [lammps-users] Question about the electron density function notation in the eam/fs style Arun Hegde
10:53 [lammps-users] Restart parallel tempering using .mpiio file? Smith, Harper E.
10:42 Re: [lammps-users] pair style mm3/switch3/coulgauss/long not working with hybrid keyword Jonathan Ruffley
10:23 Re: [lammps-users] MPI error with reax/c Filip Simeski
09:30 Re: [lammps-users] [EXTERNAL] Fwd: Can't replicate results of the enthalpy of mixing Thompson, Aidan
08:54 Re: [lammps-users] circular replicate Steve Plimpton
08:52 Re: [lammps-users] density map Steve Plimpton
08:47 Re: [lammps-users] Calculating per-atom quantity from dihedral list before force computation Steve Plimpton
08:40 Re: [lammps-users] circular replicate omid gh
08:38 Re: [lammps-users] (no subject) Steve Plimpton
08:35 Re: [lammps-users] ERROR: Unknown identifier in data file: 12 atom types (../read_data.cpp:742) Axel Kohlmeyer
08:34 Re: [lammps-users] nematic active force Steve Plimpton
08:34 Re: [lammps-users] density map omid gh
08:31 Re: [lammps-users] Coulomb subtraction issue with special_bond Ali Morshedi
08:28 Re: [lammps-users] circular replicate Steve Plimpton
08:27 Re: [lammps-users] Drude : Nano Units Steve Plimpton
08:23 Re: [lammps-users] density map Steve Plimpton
08:20 Re: [lammps-users] deep learning Steve Plimpton
08:18 Re: [lammps-users] Coulomb subtraction issue with special_bond Steve Plimpton
08:15 Re: [lammps-users] removing 1-4 coulomb interaction for a periodic molecule Steve Plimpton
07:59 Re: [lammps-users] ERROR: Unknown identifier in data file: 12 atom types (../read_data.cpp:742) Ankit Chauhan
07:38 Re: [lammps-users] MPI error with reax/c Ray Shan
07:24 Re: [lammps-users] MPI error with reax/c Guzman, Francisco

October 18, 2020
11:37 [lammps-users] MPI error with reax/c Filip Simeski
10:42 Re: [lammps-users] how to get the number of chunks Axel Kohlmeyer
09:32 [lammps-users] how to get the number of chunks 1185201182
05:16 Re: [lammps-users] cross pair coeff in data file Ευάγγελος Βογιατζής
03:41 [lammps-users] cross pair coeff in data file omid gh

October 16, 2020
14:41 Re: [lammps-users] pair style mm3/switch3/coulgauss/long not working with hybrid keyword Axel Kohlmeyer
14:30 Re: [lammps-users] Testers needed for new LAMMPS Windows installer packages LAMMPS Developers
14:28 [lammps-users] pair style mm3/switch3/coulgauss/long not working with hybrid keyword jonathan . f . ruffley
14:09 Re: [lammps-users] minimising Streitz-Mintmire potential Axel Kohlmeyer
08:37 [lammps-users] minimising Streitz-Mintmire potential Bipin kumar
07:56 Re: [lammps-users] force and energy values in the single function of angle style Ευάγγελος Βογιατζής
07:54 Re: [lammps-users] force and energy values in the single function of angle style Axel Kohlmeyer
07:41 [lammps-users] force and energy values in the single function of angle style Ευάγγελος Βογιατζής
00:31 Re: [lammps-users] LAMMPS logo animation (hi-res version) Axel Kohlmeyer

October 15, 2020
23:01 [lammps-users] LAMMPS logo animation (hi-res version) omid gh
18:38 Re: [lammps-users] Calculating per-atom quantity from dihedral list before force computation Axel Kohlmeyer
18:11 [lammps-users] Calculating per-atom quantity from dihedral list before force computation Nikolai D. Petsev
17:37 Re: [lammps-users] Restriction to Morse pair style Axel Kohlmeyer
17:35 [lammps-users] Restriction to Morse pair style Wagner Müller
14:17 [lammps-users] (no subject) alberto
10:47 Re: [lammps-users] ERROR: Unknown identifier in data file: 12 atom types (../read_data.cpp:742) Axel Kohlmeyer
04:16 [lammps-users] Coulomb subtraction issue with special_bond Ali Morshedi
03:55 [lammps-users] Regarding corrections for centre of mass velocity contributions in stress and temperature Sharma MD
02:44 Re: [lammps-users] nematic active force Chandana Mondal
02:33 [lammps-users] circular replicate omid gh
02:31 [lammps-users] About execution error on LAMMPS with FitSNAP randy jalem
02:22 Re: [lammps-users] About execution error on LAMMPS with FitSNAP Charlie Sievers

October 14, 2020
22:42 Re: [lammps-users] Moltemplate Andrew Jewett
17:54 Re: [lammps-users] nematic active force Steve Plimpton
17:47 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Steve Plimpton
13:31 Re: [lammps-users] LAMMPS install using cmake Pascal Brault
13:16 Re: [lammps-users] Problem with fix ave/time and jump loop Axel Kohlmeyer
13:06 [lammps-users] Problem with fix ave/time and jump loop Gonzalo dos Santos
07:25 Re: [lammps-users] LAMMPS install using cmake Axel Kohlmeyer
06:32 Re: [lammps-users] LAMMPS install using cmake Brault Pascal
05:32 Re: [lammps-users] LAMMPS install using cmake Axel Kohlmeyer
05:11 [lammps-users] nematic active force Chandana Mondal
04:57 Re: [lammps-users] Fwd: Cannot find bond_harmonic.cpp file Chandana Mondal
03:36 Re: [lammps-users] cmake build for SNAP with Kokkos CUDA backend Axel Kohlmeyer
03:33 [lammps-users] LAMMPS install using cmake Brault Pascal
03:15 Re: [lammps-users] valgrind Invalid read of size 8 Axel Kohlmeyer
02:03 Re: [lammps-users] valgrind Invalid read of size 8 Oier Arcelus
00:03 [lammps-users] cmake build for SNAP with Kokkos CUDA backend Rahulkumar Gayatri

October 13, 2020
15:01 [lammps-users] Non - Numerical Pressure Simulation Unstable only Cluster not of Personal Compute Sami, Sayeed Nafis
14:38 Re: [lammps-users] Non - Numerical Pressure Simulation Unstable only Cluster not of Personal Computer Axel Kohlmeyer
14:33 Re: [lammps-users] Non - Numerical Pressure Simulation Unstable only Cluster not of Personal Computer Axel Kohlmeyer
14:20 [lammps-users] Non - Numerical Pressure Simulation Unstable only Cluster not of Personal Computer Sami, Sayeed Nafis
12:40 Re: [lammps-users] Non - Numerical Pressure Simulation Unstable only Cluster not of Personal Computer Axel Kohlmeyer
10:45 [lammps-users] Non - Numerical Pressure Simulation Unstable only Cluster not of Personal Computer Sami, Sayeed Nafis
09:38 Re: [lammps-users] valgrind Invalid read of size 8 Axel Kohlmeyer
09:27 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Morrissey, Liam S.
09:06 Re: [lammps-users] valgrind Invalid read of size 8 Oier Arcelus
08:49 Re: [lammps-users] valgrind Invalid read of size 8 Axel Kohlmeyer
07:35 [lammps-users] valgrind Invalid read of size 8 Oier Arcelus
06:55 [lammps-users] Drude : Nano Units SIBOULET Olivier
05:46 Re: [lammps-users] Fwd: Cannot find bond_harmonic.cpp file Axel Kohlmeyer
05:43 Re: [lammps-users] CMake Error Axel Kohlmeyer
03:50 [lammps-users] Fwd: Cannot find bond_harmonic.cpp file Chandana Mondal
03:38 [lammps-users] CMake Error Oier Arcelus
02:45 [lammps-users] ERROR: Unknown identifier in data file: 12 atom types (../read_data.cpp:742) Ankit Chauhan
02:36 [lammps-users] fundamental constants of physics in LJ units Yanggang
01:03 Re: [lammps-users] cyclic stress perturbations application Atila, Achraf

October 12, 2020
16:33 Re: [lammps-users] cyclic stress perturbations application Axel Kohlmeyer
16:05 [lammps-users] cyclic stress perturbations application Ahmed El Hamdaoui
15:06 [lammps-users] NASA LAMMPS Spring 2021 internship position Casey, Stephen M. (LARC-B703)
10:51 Re: [lammps-users] Can't replicate results of the enthalpy of mixing Antoine Rincent
10:08 Re: [lammps-users] VACF with respect to the molecule center Axel Kohlmeyer
07:47 Re: [lammps-users] Cannot find bond_harmonic.cpp file Axel Kohlmeyer
07:01 Re: [lammps-users] Cannot find bond_harmonic.cpp file Chandana Mondal
04:52 Re: [lammps-users] Can't replicate results of the enthalpy of mixing Sebastian Hütter

October 11, 2020
21:41 Re: [lammps-users] Fwd: unmatched velocity in fix deposite Axel Kohlmeyer
21:03 Re: [lammps-users] Proper NVEs for Hybrid Full Sphere Dipole Axel Kohlmeyer
20:48 [lammps-users] Proper NVEs for Hybrid Full Sphere Dipole Sebastian S
17:22 Re: [lammps-users] Viscosity of argon Axel Kohlmeyer
16:11 Re: [lammps-users] Viscosity of argon Hasan Celik
14:46 [lammps-users] Fwd: unmatched velocity in fix deposite Movaffaq Kateb
14:05 Re: [lammps-users] Viscosity of argon Axel Kohlmeyer
13:46 [lammps-users] Viscosity of argon Hasan Celik
13:03 [lammps-users] VACF with respect to the molecule center 1185201182
11:55 Re: [lammps-users] Can't replicate results of the enthalpy of mixing Antoine Rincent
08:46 Re: [lammps-users] Modeling water and ions with the user-drudge package Axel Kohlmeyer
04:41 [lammps-users] Modeling water and ions with the user-drudge package Yunfeng Mao
00:23 Re: [lammps-users] Can't replicate results of the enthalpy of mixing Sandeep Kumar Singh

October 10, 2020
09:13 Re: [lammps-users] Can't replicate results of the enthalpy of mixing Antoine Rincent
07:41 Re: [lammps-users] Can't replicate results of the enthalpy of mixing Sebastian Hütter

October 09, 2020
20:37 [lammps-users] removing 1-4 coulomb interaction for a periodic molecule jamal kazazi
20:00 Re: [lammps-users] MPI task timing breakdown Axel Kohlmeyer
19:30 [lammps-users] MPI task timing breakdown 吴标
19:18 [lammps-users] Candidate for new stable LAMMPS release posted on Github LAMMPS Developers
18:44 Re: [lammps-users] unwrap doesn't work for water Axel Kohlmeyer
18:41 Re: [lammps-users] unwrap doesn't work for water Hongxia Hao
18:11 Re: [lammps-users] unwrap doesn't work for water Axel Kohlmeyer
18:05 [lammps-users] unwrap doesn't work for water Hongxia Hao
17:59 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Kévin Potier
16:53 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Morrissey, Liam S.
15:58 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Axel Kohlmeyer
15:53 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Axel Kohlmeyer
15:44 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Steve Plimpton
15:44 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Axel Kohlmeyer
15:39 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Steve Plimpton
15:20 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Axel Kohlmeyer
15:16 Re: [lammps-users] Further deconstructing potential energy contributions Steve Plimpton
15:12 Re: [lammps-users] Chain initialization Steve Plimpton
15:10 Re: [lammps-users] Further deconstructing potential energy contributions Bell, Ian H. (Fed)
15:04 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Steve Plimpton
13:50 Re: [lammps-users] Further deconstructing potential energy contributions Bell, Ian H. (Fed)
13:39 Re: [lammps-users] Further deconstructing potential energy contributions Axel Kohlmeyer
13:30 [lammps-users] Further deconstructing potential energy contributions Bell, Ian H. (Fed)
12:26 Re: [lammps-users] Chain initialization Bell, Ian H. (Fed)
12:00 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Morrissey, Liam S.
11:16 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Axel Kohlmeyer
11:11 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Morrissey, Liam S.
10:56 Re: [lammps-users] possible read data issue for atomic numbering - z height not consistent Axel Kohlmeyer
10:42 Re: [lammps-users] Chain initialization Axel Kohlmeyer
10:33 Re: [lammps-users] user-intel and neighbor multi Axel Kohlmeyer
10:19 [lammps-users] Chain initialization Bell, Ian H. (Fed)
10:00 [lammps-users] user-intel and neighbor multi Matias Factorovich
09:28 [lammps-users] possible read data issue for atomic numbering - z height not consistent Morrissey, Liam S.

October 08, 2020
08:35 Re: [lammps-users] Computing the variance of velocity distribution Axel Kohlmeyer
08:06 [lammps-users] Computing the variance of velocity distribution Mohammed Alhissi
03:07 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
02:19 Re: [lammps-users] large time required for tension test simulations Axel Kohlmeyer
01:54 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni

October 07, 2020
20:26 Re: [lammps-users] Trj.file Axel Kohlmeyer
20:09 Re: [lammps-users] Trj.file 吴标
12:38 Re: [lammps-users] Fixing the center of atoms and rotating around its axis Axel Kohlmeyer
12:28 Re: [lammps-users] Fixing the center of atoms and rotating around its axis Abdullah Arafat
12:02 Re: [lammps-users] Fixing the center of atoms and rotating around its axis Axel Kohlmeyer
11:49 [lammps-users] Fixing the center of atoms and rotating around its axis Abdullah Arafat
10:38 [lammps-users] package installed in lammps windows edition omid gh
09:09 Re: [lammps-users] large time required for tension test simulations Axel Kohlmeyer
08:56 Re: [lammps-users] large time required for tension test simulations Axel Kohlmeyer
08:52 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
08:48 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
08:02 [lammps-users] Can't replicate results of the enthalpy of mixing Antoine Rincent

October 06, 2020
21:12 [lammps-users] Updated LAMMPS installer packages for LAMMPS uploaded LAMMPS Developers
18:54 Re: [lammps-users] large time required for tension test simulations Axel Kohlmeyer
18:49 Re: [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
18:33 Re: [lammps-users] large time required for tension test simulations Axel Kohlmeyer
18:25 [lammps-users] large time required for tension test simulations Hrushikesh Kulkarni
17:24 Re: [lammps-users] Trj.file Axel Kohlmeyer
06:34 [lammps-users] Trj.file 吴标
02:33 Re: [lammps-users] Writing lammps data file in vmd for selected atoms Axel Kohlmeyer
02:32 Re: [lammps-users] The compounds information from species file seems like not right Axel Kohlmeyer
02:31 Re: [lammps-users] Cannot find bond_harmonic.cpp file Shafat Mubin
02:25 Re: [lammps-users] Cannot find bond_harmonic.cpp file Axel Kohlmeyer
02:22 Re: [lammps-users] Moltemplate Andrew Jewett
01:48 [lammps-users] Cannot find bond_harmonic.cpp file Chandana Mondal
01:42 [lammps-users] The compounds information from species file seems like not right 刘志伟
01:20 [lammps-users] Writing lammps data file in vmd for selected atoms Kumiszhan Dybyspayeva

October 05, 2020
14:47 [lammps-users] density map omid gh
14:31 Re: [lammps-users] Problems of pair coefficients mixing of EAM when hybrid/overly is used Wenqiang Liu
10:18 [lammps-users] deep learning omid gh
09:14 Re: [lammps-users] heat current calculation Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
08:55 Re: [lammps-users] heat current calculation Axel Kohlmeyer
08:51 Re: [lammps-users] what is the effect of the average of fix reax/c/species command? 刘志伟
08:30 Re: [lammps-users] Bond atoms missing after change box in periodic BC Axel Kohlmeyer
08:13 Re: [lammps-users] Bond atoms missing after change box in periodic BC Frank N
07:50 Re: [lammps-users] Bond atoms missing after change box in periodic BC Axel Kohlmeyer
07:48 Re: [lammps-users] what is the effect of the average of fix reax/c/species command? Axel Kohlmeyer
07:25 [lammps-users] Bond atoms missing after change box in periodic BC Frank N
06:59 [lammps-users] what is the effect of the average of fix reax/c/species command? 刘志伟
06:36 [lammps-users] heat current calculation Bernstein, Noam CIV USN NRL (6393) Washington DC (USA)
05:19 Re: [lammps-users] Regarding dump command Axel Kohlmeyer
01:17 [lammps-users] Regarding dump command Sharma MD

October 03, 2020
08:00 Re: [lammps-users] Running error: doping elements and potentials Axel Kohlmeyer
06:44 Re: [lammps-users] TIP4P water model and accelerator packages Axel Kohlmeyer
06:21 [lammps-users] TIP4P water model and accelerator packages Michal Krompiec

October 02, 2020
18:38 [lammps-users] Running error: doping elements and potentials Gustavo M. Fortes
17:10 Re: [lammps-users] Convert bulk to nanofiber (3d to 1d) Frank N
16:48 [lammps-users] Convert bulk to nanofiber (3d to 1d) Frank N
15:32 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Trung Nguyen
13:32 [lammps-users] surface binding energy using charged atoms (kspace/ewald) Morrissey, Liam S.
13:08 Re: [lammps-users] Using lj/class2/coul/long with non periodic boundary condition Axel Kohlmeyer
10:58 Re: [lammps-users] Bug in library interface Karl Hammond
10:31 Re: [lammps-users] Using lj/class2/coul/long with non periodic boundary condition abhiram br
08:55 Re: [lammps-users] Bug in library interface Axel Kohlmeyer
06:44 Re: [lammps-users] ERROR: Unrecognized pair style 'smtbq' is part of the USER-SMTBQ package which is not enabled in this LAMMPS binary. Axel Kohlmeyer
06:30 Re: [lammps-users] ERROR: Unrecognized pair style 'smtbq' is part of the USER-SMTBQ package which is not enabled in this LAMMPS binary. Víctor Juarros Cebrian
06:15 Re: [lammps-users] Fix propel/self Axel Kohlmeyer
06:00 [lammps-users] Fix propel/self Gokul Upadhyay
04:49 Re: [lammps-users] ERROR: Unrecognized pair style 'smtbq' is part of the USER-SMTBQ package which is not enabled in this LAMMPS binary. Axel Kohlmeyer
04:31 [lammps-users] ERROR: Unrecognized pair style 'smtbq' is part of the USER-SMTBQ package which is not enabled in this LAMMPS binary. Víctor Juarros Cebrian

October 01, 2020
19:15 Re: [lammps-users] About LAMMPS capacity Axel Kohlmeyer
19:08 [lammps-users] About LAMMPS capacity Ivan Moncayo
17:02 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Changnian (Gary) Han
16:56 Re: [lammps-users] ERROR: Incorrect atom format in data file (src/atom.cpp:892) BruceWang
16:55 Re: [lammps-users] dump_modify Axel Kohlmeyer
16:52 Re: [lammps-users] dump_modify Reza Namakian
16:31 Re: [lammps-users] ERROR: Incorrect atom format in data file (src/atom.cpp:892) Axel Kohlmeyer
16:23 Re: [lammps-users] ERROR: Incorrect atom format in data file (src/atom.cpp:892) BRUCE Wang
15:05 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Trung Nguyen
10:18 Re: [lammps-users] Bug in library interface Axel Kohlmeyer
08:55 Re: [lammps-users] Bug in library interface Karl Hammond
05:25 Re: [lammps-users] ERROR: Incorrect atom format in data file (src/atom.cpp:892) Axel Kohlmeyer
05:10 Re: [lammps-users] Testers needed for new LAMMPS Windows installer packages Axel Kohlmeyer
04:42 Re: [lammps-users] Testers needed for new LAMMPS Windows installer packages Sebastian Hütter
00:13 [lammps-users] ERROR: Incorrect atom format in data file (src/atom.cpp:892) BRUCE Wang

September 30, 2020
21:33 [lammps-users] Moltemplate Ting Hu
21:17 Re: [lammps-users] Total force in tensile tests using fix smd Axel Kohlmeyer
20:43 Re: [lammps-users] dump_modify Axel Kohlmeyer
20:08 Re: [lammps-users] Bug in library interface Axel Kohlmeyer
19:55 Re: [lammps-users] dump_modify Reza Namakian
19:32 Re: [lammps-users] shear rate Robert Hoy
18:46 Re: [lammps-users] high quality videos Axel Kohlmeyer
18:25 [lammps-users] Bug in library interface Karl Hammond
18:01 Re: [lammps-users] dump_modify Steve Plimpton
17:59 Re: [lammps-users] high quality videos Steve Plimpton
17:57 Re: [lammps-users] Total force in tensile tests using fix smd Steve Plimpton
17:53 Re: [lammps-users] Is it possible to put an imaginary wall into the simulation box? Steve Plimpton
17:48 Re: [lammps-users] Cyclic loading Steve Plimpton
17:44 Re: [lammps-users] accelerated molecular dynamics Steve Plimpton
17:43 Re: [lammps-users] (no subject) Steve Plimpton
17:38 Re: [lammps-users] Problems of pair coefficients mixing of EAM when hybrid/overly is used Steve Plimpton
17:18 Re: [lammps-users] How to simulate compressing a triclinic layer strcture under 10MPa pressure Steve Plimpton
17:16 Re: [lammps-users] using lattice custom to occupy specific interstitial sites Steve Plimpton
16:44 Re: [lammps-users] shear rate Robert Hoy
16:25 Re: [lammps-users] variable style and fix heat Politano Olivier
12:56 [lammps-users] dump_modify Reza Namakian
10:45 Re: [lammps-users] vmd-l: high quality videos Adupa Vasista
10:03 [lammps-users] high quality videos omid gh
08:33 Re: [lammps-users] shear rate Giacomo Fiorin
08:23 Re: [lammps-users] shear rate Atila, Achraf
08:09 [lammps-users] shear rate kai nan
05:12 Re: [lammps-users] fix ave/correlate and speed for thermal conductivity Axel Kohlmeyer

September 29, 2020
21:37 [lammps-users] Testers needed for new LAMMPS Windows installer packages LAMMPS Developers
16:17 Re: [lammps-users] visualization Will Pisani
15:17 Re: [lammps-users] visualization Will Pisani
08:28 [lammps-users] fix ave/correlate and speed for thermal conductivity Ernesto Barraza
08:18 [lammps-users] Total force in tensile tests using fix smd Julia Kamml
07:38 Re: [lammps-users] (no subject) Axel Kohlmeyer
00:50 Re: [lammps-users] accelerated molecular dynamics faribafardisi

September 28, 2020
21:16 Re: [lammps-users] Compute orientorder/atom for water has small values Axel Kohlmeyer
15:32 Re: [lammps-users] Compute orientorder/atom for water has small values Sheldon Cooper
15:28 Re: [lammps-users] Compute orientorder/atom for water has small values Axel Kohlmeyer
14:14 Re: [lammps-users] Compute orientorder/atom for water has small values Axel Kohlmeyer
14:04 Re: [lammps-users] Is it possible to put an imaginary wall into the simulation box? Atefeh Tarokh
13:17 [lammps-users] Is it possible to put an imaginary wall into the simulation box? Atefeh Tarokh
12:54 Re: [lammps-users] A problem with Fix evaporate command Atefeh Tarokh
12:42 [lammps-users] Compute orientorder/atom for water has small values Sheldon Cooper
10:53 [lammps-users] A problem with Fix evaporate command Atefeh Tarokh
09:40 Re: [lammps-users] add attractive force Axel Kohlmeyer
09:36 [lammps-users] add attractive force kai nan
09:06 Re: [lammps-users] (no subject) Axel Kohlmeyer
09:02 Re: [lammps-users] (no subject) Axel Kohlmeyer
09:00 [lammps-users] (no subject) santosh shiva
07:28 [lammps-users] How could I solve this issue with hybrid/overlay? Mixings for EAM sub-style failed Wenqiang Liu
06:50 Re: [lammps-users] Cyclic loading Axel Kohlmeyer
06:40 Re: [lammps-users] high quality image for paper Axel Kohlmeyer
05:42 Re: [lammps-users] How to create a new group based on id association Axel Kohlmeyer
04:00 Re: [lammps-users] high quality image for paper Syed Shuja Zaidi (P19PH007)
03:33 [lammps-users] How to create a new group based on id association 沈文皓
02:07 Re: [lammps-users] high quality image for paper Anders Hafreager
01:47 [lammps-users] high quality image for paper omid gh

September 27, 2020
21:55 [lammps-users] Cyclic loading Frank N
13:57 Re: [lammps-users] accelerated molecular dynamics Axel Kohlmeyer
13:04 [lammps-users] accelerated molecular dynamics faribafardisi
12:39 Re: [lammps-users] sinusoidal surface: Atila, Achraf
11:26 Re: [lammps-users] (no subject) Andrew Jewett

September 26, 2020
23:01 [lammps-users] sinusoidal surface: omid gh
18:07 Re: [lammps-users] Fix Addforce Units/Values Axel Kohlmeyer
15:54 [lammps-users] Fix Addforce Units/Values Sami, Sayeed Nafis
14:12 Re: [lammps-users] Problem with create_bonds command Axel Kohlmeyer
14:08 Re: [lammps-users] mmexport1601119058819 Axel Kohlmeyer
13:16 [lammps-users] Problem with create_bonds command Adamu Mohammed
05:31 [lammps-users] mmexport1601119058819 123753
00:23 [lammps-users] (no subject) omid gh

September 25, 2020
16:41 [lammps-users] One PhD position in computational nanomaterials at the University of Vermont Jihong Ma
15:09 Re: [lammps-users] Apply Tensile Stress to a Group of Atoms Axel Kohlmeyer
14:30 [lammps-users] Apply Tensile Stress to a Group of Atoms Sami, Sayeed Nafis
12:21 [lammps-users] Postdocs/Research Scientists Needed for ColabFit Project on Data-Driven Interatomic Potentials Ellad Tadmor
10:59 Re: [lammps-users] [EXTERNAL] Re: special_bonds gpu and sw potential Matias Factorovich
08:27 [lammps-users] Problems of pair coefficients mixing of EAM when hybrid/overly is used Wenqiang Liu
07:24 Re: [lammps-users] rerun using dump files of dcd format Axel Kohlmeyer
06:59 Re: [lammps-users] rerun using dump files of dcd format Purvaash Shankar
06:56 [lammps-users] reply ????????
06:43 Re: [lammps-users] reply Axel Kohlmeyer
06:39 [lammps-users] reply ????????
06:24 Re: [lammps-users] Temperature setting Axel Kohlmeyer
02:54 [lammps-users] Temperature setting guanguan

September 24, 2020
23:08 Re: [lammps-users] reply Axel Kohlmeyer
22:50 [lammps-users] reply ????????
20:55 Re: [lammps-users] Regarding Tensile Strain + Compression test Axel Kohlmeyer
20:50 Re: [lammps-users] YOUR APPLICATION TERMINATED WITH THE EXIT STRING: Segmentation fault (signal 11) Axel Kohlmeyer
20:29 [lammps-users] Regarding Tensile Strain + Compression test Kondaiah Samudrala
20:17 [lammps-users] YOUR APPLICATION TERMINATED WITH THE EXIT STRING: Segmentation fault (signal 11) guanguan
16:36 Re: [lammps-users] Has anyone used LAMMPS to do this? Axel Kohlmeyer
16:18 Re: [lammps-users] Has anyone used LAMMPS to do this? Andrew Jewett
13:22 Re: [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Suhas Gotla
13:08 Re: [lammps-users] speed up tricks Will Pisani
12:56 Re: [lammps-users] Contact Models Axel Kohlmeyer
12:37 Re: [lammps-users] rerun using dump files of dcd format Axel Kohlmeyer
12:32 Re: [lammps-users] Compression test Axel Kohlmeyer
11:36 [lammps-users] rerun using dump files of dcd format Purvaash Shankar
11:33 [lammps-users] Compression test ashish singh
10:58 [lammps-users] speed up tricks omid gh
10:56 Re: [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Axel Kohlmeyer
10:32 Re: [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Suhas Gotla
10:29 Re: [lammps-users] [EXTERNAL] Re: special_bonds gpu and sw potential Moore, Stan
10:06 Re: [lammps-users] special_bonds gpu and sw potential Axel Kohlmeyer
09:25 [lammps-users] special_bonds gpu and sw potential Matias Factorovich
08:47 [lammps-users] Contact Models Oier Arcelus
06:39 Re: [lammps-users] How to define the coefficients for LJ potential in the data file? Wenqiang Liu
04:16 Re: [lammps-users] Regarding uniaxial test Atila, Achraf
04:04 Re: [lammps-users] Has anyone used LAMMPS to do this? Axel Kohlmeyer
03:57 [lammps-users] Has anyone used LAMMPS to do this? ????????
03:55 Re: [lammps-users] How to make the trajectory file show the right bonds information in VMD Axel Kohlmeyer
03:24 Re: [lammps-users] How to define the coefficients for LJ potential in the data file? Syed Shuja Zaidi (P19PH007)
03:06 [lammps-users] Fw: Re: Re: Is temperature-rise period needed in ReaxFF MD? 刘志伟
03:03 [lammps-users] How to make the trajectory file show the right bonds information in VMD 刘志伟
01:49 Re: [lammps-users] Regarding uniaxial test Will Pisani
01:49 Re: [lammps-users] How to define the coefficients for LJ potential in the data file? Wenqiang Liu
01:39 Re: [lammps-users] How to define the coefficients for LJ potential in the data file? Wenqiang Liu
01:37 Re: [lammps-users] Regarding uniaxial test ashish singh
00:10 Re: [lammps-users] Making spatial bins Axel Kohlmeyer

September 23, 2020
23:44 [lammps-users] Making spatial bins nidhi verma
17:31 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Christian Kelley
16:07 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Axel Kohlmeyer
15:51 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Christian Kelley
15:46 Re: [lammps-users] Nested loops of universe variables in multiple partitions Axel Kohlmeyer
15:30 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Axel Kohlmeyer
15:15 [lammps-users] Nested loops of universe variables in multiple partitions C. MIGUEL BARRIUSO GUTIERREZ
15:14 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Christian Kelley
14:41 Re: [lammps-users] Dynamic atom type C. MIGUEL BARRIUSO GUTIERREZ
07:39 Re: [lammps-users] Regarding uniaxial test Axel Kohlmeyer
06:39 Re: [lammps-users] Error during GPU package compilation Axel Kohlmeyer
06:34 Re: [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
06:27 Re: [lammps-users] Error during GPU package compilation Axel Kohlmeyer
05:56 Re: [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
05:43 Re: [lammps-users] fix SMD pulling/pushing direction Axel Kohlmeyer
05:35 Re: [lammps-users] Error during GPU package compilation Axel Kohlmeyer
05:20 Re: [lammps-users] Error warnings Axel Kohlmeyer
04:59 [lammps-users] Error warnings Oier Arcelus
04:58 [lammps-users] Regarding uniaxial test ashish singh
04:53 [lammps-users] fix SMD pulling/pushing direction Ludovic Jami
03:13 Re: [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
02:15 Re: [lammps-users] VdW energies in a periodic system, conversion issue/lammps and gromacs disagree Michael Brunsteiner
00:44 Re: [lammps-users] Damping factor selection for Wolf summation Michael Chen

September 22, 2020
22:36 Re: [lammps-users] delete atoms Ting Hu
22:30 Re: [lammps-users] delete atoms omid gh
20:14 [lammps-users] delete atoms Ting Hu
13:59 Re: [lammps-users] dynamic bond probability and bond lifetime Jacob Gissinger
13:28 Re: [lammps-users] dynamic bond probability and bond lifetime Axel Kohlmeyer
13:19 Re: [lammps-users] VdW energies in a periodic system, conversion issue/lammps and gromacs disagree Axel Kohlmeyer
12:55 [lammps-users] VdW energies in a periodic system, conversion issue/lammps and gromacs disagree Michael Brunsteiner
12:43 Re: [lammps-users] Thermal Conductivity GK Segmentation Fault at high core Ernesto Barraza
12:37 Re: [lammps-users] Thermal Conductivity GK Segmentation Fault at high core Axel Kohlmeyer
12:33 [lammps-users] dynamic bond probability and bond lifetime Lauren Melcher (RIT Student)
11:17 [lammps-users] Thermal Conductivity GK Segmentation Fault at high core Ernesto Barraza
10:24 Re: [lammps-users] How to define the coefficients for LJ potential in the data file? Syed Shuja Zaidi (P19PH007)
08:11 Re: [lammps-users] Error during GPU package compilation Axel Kohlmeyer
07:58 Re: [lammps-users] How to define the coefficients for LJ potential in the data file? Axel Kohlmeyer
07:40 Re: [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
07:32 Re: [lammps-users] Error during GPU package compilation Axel Kohlmeyer
07:10 Re: [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
06:47 [lammps-users] How to define the coefficients for LJ potential in the data file? Wenqiang Liu
05:11 Re: [lammps-users] Error during GPU package compilation Axel Kohlmeyer
04:53 Re: [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
04:29 [lammps-users] Error during GPU package compilation Almeida-Hernández , Yasser , Dr .
03:59 Re: [lammps-users] Damping factor selection for Wolf summation Axel Kohlmeyer
03:33 Re: [lammps-users] lammps_lmp2arc Axel Kohlmeyer
03:23 [lammps-users] Damping factor selection for Wolf summation Michael Chen
03:21 Re: [lammps-users] Issues with tabulated potentials Axel Kohlmeyer

September 21, 2020
23:37 Re: [lammps-users] Issues with tabulated potentials Shazed Rahman
23:20 [lammps-users] lammps_lmp2arc 왕호림
23:10 [lammps-users] lammps_lmp2arc wang haolin
19:39 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Axel Kohlmeyer
19:37 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Axel Kohlmeyer
17:13 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Christian Kelley
17:11 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Christian Kelley
14:54 Re: [lammps-users] Selecting Random Group of Atoms of a Specific Type Axel Kohlmeyer
13:45 [lammps-users] Selecting Random Group of Atoms of a Specific Type Christian Kelley
11:47 Re: [lammps-users] ERROR: Illegal read_dump command Axel Kohlmeyer
11:40 Re: [lammps-users] ERROR: Illegal read_dump command Vishnu V. Krishnan
11:26 Re: [lammps-users] ERROR: Illegal read_dump command Axel Kohlmeyer
11:10 [lammps-users] ERROR: Illegal read_dump command Vishnu V. Krishnan
06:11 [lammps-users] lammps on HPC cpu usage problem omid gh
05:16 Re: [lammps-users] Error in LAMMPS on cluster computer Axel Kohlmeyer
04:57 [lammps-users] Error in LAMMPS on cluster computer Namrata Masli
04:23 Re: [lammps-users] [ Insufficient Jacobi rotations for group::omega ] granular sphere system Axel Kohlmeyer
01:47 [lammps-users] [ Insufficient Jacobi rotations for group::omega ] granular sphere system 조준범

September 20, 2020
17:44 Re: [lammps-users] reaxff error Axel Kohlmeyer
17:17 [lammps-users] reaxff error Md.Mosarof Hossain

September 19, 2020
16:24 Re: [lammps-users] fix spring/self Axel Kohlmeyer
14:44 [lammps-users] fix spring/self Reza Namakian
14:02 Re: [lammps-users] Dynamic atom type Axel Kohlmeyer
08:59 [lammps-users] Dynamic atom type C. MIGUEL BARRIUSO GUTIERREZ

September 18, 2020
18:12 Re: [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Axel Kohlmeyer
17:20 Re: [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Suhas Gotla

September 17, 2020
15:57 Re: [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Axel Kohlmeyer
15:29 [lammps-users] Relatively slower (12x slower) simulation on LAMMPS vs GROMACS Suhas Gotla
05:23 Re: [lammps-users] bond disorder Axel Kohlmeyer

September 16, 2020
23:16 Re: [lammps-users] bond disorder 杨俊
12:30 Re: [lammps-users] Kinetic energy partitioning in fix npt/sphere and fix nvt/sphere Axel Kohlmeyer
12:09 [lammps-users] Kinetic energy partitioning in fix npt/sphere and fix nvt/sphere Marshall Tekell
09:47 Re: [lammps-users] A proposal about additional reference structures in the pair_style meam/c command Sebastian Hütter
07:34 Re: [lammps-users] bond disorder Axel Kohlmeyer
07:33 Re: [lammps-users] A proposal about additional reference structures in the pair_style meam/c command Axel Kohlmeyer
03:43 Re: [lammps-users] delete atom dosent delete corresponding bonds omid gh
02:55 Re: [lammps-users] Compute displacement of center of mass Axel Kohlmeyer
02:19 [lammps-users] Compute displacement of center of mass Rupayan Das
00:47 [lammps-users] A proposal about additional reference structures in the pair_style meam/c command 신소재공학과

September 15, 2020
23:25 Re: [lammps-users] Choice of Potential Vijay Reddy
23:11 [lammps-users] bond disorder 杨俊
21:44 Re: [lammps-users] valency_val and valency_box 吴标
21:36 Re: [lammps-users] prombelm using fix npt with fix spring/self lqy
21:18 Re: [lammps-users] prombelm using fix npt with fix spring/self Axel Kohlmeyer
21:10 [lammps-users] ?????? prombelm using fix npt with fix spring/self lqy
21:02 Re: [lammps-users] valency_val and valency_box Axel Kohlmeyer
21:00 Re: [lammps-users] valency_val and valency_box 吴标
20:50 Re: [lammps-users] valency_val and valency_box Axel Kohlmeyer
20:46 Re: [lammps-users] prombelm using fix npt with fix spring/self Axel Kohlmeyer
20:36 [lammps-users] prombelm using fix npt with fix spring/self lqy
20:28 [lammps-users] valency_val and valency_box 吴标
09:58 Re: [lammps-users] How to calculate Z-value in any potential Axel Kohlmeyer
09:47 Re: [lammps-users] How to calculate Z-value in any potential Abid Channa
09:21 Re: [lammps-users] Choice of Potential Axel Kohlmeyer
08:18 Re: [lammps-users] How to calculate Z-value in any potential Axel Kohlmeyer
07:52 [lammps-users] Choice of Potential Khaled Mohamed
07:48 [lammps-users] How to calculate Z-value in any potential Abid Channa

September 14, 2020
23:51 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Changnian (Gary) Han
22:53 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Trung Nguyen
19:52 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Changnian (Gary) Han
17:25 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Steve Plimpton
16:37 Re: [lammps-users] Issues with tabulated potentials Axel Kohlmeyer
16:14 Re: [lammps-users] Issues with tabulated potentials Shazed Rahman
14:41 Re: [lammps-users] Issues with tabulated potentials Axel Kohlmeyer
14:36 Re: [lammps-users] Issues with tabulated potentials Shazed Rahman
13:00 Re: [lammps-users] Issues with tabulated potentials Axel Kohlmeyer
12:59 Re: [lammps-users] Issues with tabulated potentials Axel Kohlmeyer
12:57 Re: [lammps-users] Issues with tabulated potentials Shazed Rahman
12:35 Re: [lammps-users] Issues with tabulated potentials Axel Kohlmeyer
12:25 [lammps-users] Issues with tabulated potentials Shazed Rahman
08:50 Re: [lammps-users] Incorrect Stopping criterion in minimization Vishnu V. Krishnan
08:38 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
08:26 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
08:03 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
07:39 Re: [lammps-users] Incorrect Stopping criterion in minimization Axel Kohlmeyer
07:33 [lammps-users] ?????? variable equal to 0 using $() and v_ ??????
07:30 Re: [lammps-users] Incorrect Stopping criterion in minimization Vishnu V. Krishnan
07:23 Re: [lammps-users] variable equal to 0 using $() and v_ Axel Kohlmeyer
07:10 [lammps-users] ?????? variable equal to 0 using $() and v_ ??????
07:06 Re: [lammps-users] Incorrect Stopping criterion in minimization Axel Kohlmeyer
07:00 Re: [lammps-users] Is temperature-rise period needed in ReaxFF MD? Axel Kohlmeyer
06:56 Re: [lammps-users] variable equal to 0 using $() and v_ Axel Kohlmeyer
06:01 [lammps-users] Incorrect Stopping criterion in minimization Vishnu V. Krishnan
02:33 Re: [lammps-users] Is temperature-rise period needed in ReaxFF MD? Ευάγγελος Βογιατζής
01:24 [lammps-users] ?????? variable equal to 0 using $() and v_ ??????
00:45 [lammps-users] delete bonds between seperate molecules omid gh
00:40 [lammps-users] Is temperature-rise period needed in ReaxFF MD? 刘志伟

September 13, 2020
22:30 Re: [lammps-users] delete atom dosent delete corresponding bonds omid gh
21:52 Re: [lammps-users] variable equal to 0 using $() and v_ Axel Kohlmeyer
21:39 [lammps-users] variable equal to 0 using $() and v_ ??????
16:37 Re: [lammps-users] ERROR: Incorrect args for pair coefficients (../pair_eam_alloy.cpp:52) Sumit Kumar Maurya
15:31 Re: [lammps-users] ERROR: Incorrect args for pair coefficients (../pair_eam_alloy.cpp:52) Axel Kohlmeyer
15:21 [lammps-users] ERROR: Incorrect args for pair coefficients (../pair_eam_alloy.cpp:52) Sumit Kumar Maurya
12:33 Re: [lammps-users] Computational load distribution with srp potential Axel Kohlmeyer
12:16 [lammps-users] Computational load distribution with srp potential Anirban Pal

September 12, 2020
12:58 Re: [lammps-users] Tri-axial deformatio​n simulation Axel Kohlmeyer
12:43 [lammps-users] Tri-axial deformatio​n simulation ashish singh
12:25 Re: [lammps-users] Fwd: bond atom missing in image check/atom bond missing on proc #/atom lost Toon Tavas
11:50 [lammps-users] Fwd: bond atom missing in image check/atom bond missing on proc #/atom lost Andrew Jewett
11:36 Re: [lammps-users] Error - Segmentation fault - Invalid permissions Emerson Parazzi Lyra
11:33 Re: [lammps-users] Error - Segmentation fault - Invalid permissions Axel Kohlmeyer
11:30 Re: [lammps-users] Error - Segmentation fault - Invalid permissions Axel Kohlmeyer
11:09 Re: [lammps-users] delete atom dosent delete corresponding bonds omid gh
11:02 Re: [lammps-users] delete atom dosent delete corresponding bonds omid gh
10:43 [lammps-users] Error - Segmentation fault - Invalid permissions Emerson Parazzi Lyra
10:11 Re: [lammps-users] delete atom dosent delete corresponding bonds Axel Kohlmeyer
08:57 Re: [lammps-users] Using lj/class2/coul/long with non periodic boundary condition Axel Kohlmeyer
08:02 Re: [lammps-users] delete atom dosent delete corresponding bonds omid gh
03:15 [lammps-users] bond atom missing in image check/atom bond missing on proc #/atom lost Toon Tavas
02:35 Re: [lammps-users] delete atom dosent delete corresponding bonds Axel Kohlmeyer
02:26 Re: [lammps-users] The model of metal diffusion Axel Kohlmeyer
02:13 [lammps-users] The model of metal diffusion ????????????
00:12 [lammps-users] delete atom dosent delete corresponding bonds omid gh

September 11, 2020
18:26 Re: [lammps-users] Simulation Structure Tilting after Thermalization inside simulation box Axel Kohlmeyer
13:00 [lammps-users] Simulation Structure Tilting after Thermalization inside simulation box Sami, Sayeed Nafis
10:24 Re: [lammps-users] Is there any way to simulate virtual sites/lone-pairs (off-centered massless interaction sites)? Axel Kohlmeyer
10:17 [lammps-users] Is there any way to simulate virtual sites/lone-pairs (off-centered massless interaction sites)? Rafael Maglia
08:53 Re: [lammps-users] Lammps with GPU installation Axel Kohlmeyer
08:40 Re: [lammps-users] Lammps with GPU installation Stalin S
05:40 Re: [lammps-users] What the prerequisites are for fix rigid command to be properly initialized 123753
05:26 Re: [lammps-users] What the prerequisites are for fix rigid command to be properly initialized Axel Kohlmeyer
05:19 Re: [lammps-users] Simulation Structure Tilting after Thermalization inside simulation box Axel Kohlmeyer
02:07 [lammps-users] Simulation Structure Tilting after Thermalization inside simulation box Sami, Sayeed Nafis
01:50 [lammps-users] chinese hpc omid gh

September 10, 2020
21:26 [lammps-users] What the prerequisites are for fix rigid command to be properly initialized 123753
20:55 Re: [lammps-users] Operation aborted Axel Kohlmeyer
19:15 Re: [lammps-users] Operation aborted 吴标
09:30 Re: [lammps-users] ERROR: Unrecognized dihedral style 'fourier' Emerson Parazzi Lyra
09:21 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Changnian (Gary) Han
09:10 Re: [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Steve Plimpton
09:03 Re: [lammps-users] ERROR: Unrecognized dihedral style 'fourier' Axel Kohlmeyer
09:02 Re: [lammps-users] interaction Steve Plimpton
09:00 Re: [lammps-users] Problems and Questions about atom_style sphere Steve Plimpton
08:52 Re: [lammps-users] input example of many-body monatomic water model mW in LAMMPS Steve Plimpton
07:38 Re: [lammps-users] Operation aborted Axel Kohlmeyer
07:34 Re: [lammps-users] regarding use of 2 metal systems Axel Kohlmeyer
03:39 [lammps-users] Operation aborted 吴标
03:33 Re: [lammps-users] calculation of the pressure tensor element pxy 城野亮太
02:17 [lammps-users] regarding use of 2 metal systems Hrushikesh Kulkarni
01:13 Re: [lammps-users] ERROR: Unrecognized dihedral style 'fourier' Axel Kohlmeyer

September 09, 2020
22:54 [lammps-users] Issue of using dpd/gpu and dpd/tstat/gpu at the same time Changnian (Gary) Han
22:24 [lammps-users] ERROR: Unrecognized dihedral style 'fourier' Emerson Parazzi Lyra
21:27 Re: [lammps-users] Lammps example code in examples\USER\misc\drip cannot work Axel Kohlmeyer
21:18 Re: [lammps-users] Lammps example code in examples\USER\misc\drip cannot work Dan Jiadong
21:16 Re: [lammps-users] Lammps example code in examples\USER\misc\drip cannot work Axel Kohlmeyer
21:13 Re: [lammps-users] Lammps example code in examples\USER\misc\drip cannot work Dan Jiadong
21:09 Re: [lammps-users] Lammps example code in examples\USER\misc\drip cannot work Axel Kohlmeyer
20:42 Re: [lammps-users] calculation of the pressure tensor element pxy 城野亮太
20:36 Re: [lammps-users] LAMMPS MPI issue? Axel Kohlmeyer
20:33 Re: [lammps-users] calculation of the pressure tensor element pxy Axel Kohlmeyer
19:36 Re: [lammps-users] calculation of the pressure tensor element pxy 城野亮太
16:50 [lammps-users] LAMMPS MPI issue? Smith, Harper E.
13:51 Re: [lammps-users] pizza.py Axel Kohlmeyer
13:29 [lammps-users] pizza.py omid gh
09:05 Re: [lammps-users] calculation of the pressure tensor element pxy Sebastian Hütter
08:02 [lammps-users] using lattice custom to occupy specific interstitial sites Morrissey, Liam S.
07:24 Re: [lammps-users] fix the graphene position Victor Nazarychev
06:55 Re: [lammps-users] fix the graphene position Axel Kohlmeyer
06:51 Re: [lammps-users] Lammps with GPU installation Axel Kohlmeyer
06:50 [lammps-users] fix the graphene position Victor Nazarychev
06:43 Re: [lammps-users] calculation of the pressure tensor element pxy Axel Kohlmeyer
06:32 Re: [lammps-users] calculation of the pressure tensor element pxy 城野亮太
06:28 Re: [lammps-users] hydrostatic compression ashish singh
06:26 [lammps-users] ?????? problem with the CPU utilization lqy
06:20 Re: [lammps-users] problem with the CPU utilization Axel Kohlmeyer
06:15 [lammps-users] problem with the CPU utilization lqy
06:00 [lammps-users] Lammps with GPU installation Stalin S
05:38 Re: [lammps-users] hydrostatic compression Axel Kohlmeyer
05:33 [lammps-users] hydrostatic compression ashish singh
05:27 Re: [lammps-users] Creation of slab for the calculation of interfacial tension Axel Kohlmeyer
05:07 Re: [lammps-users] cna/atom filter to sort out a particular atom within LAMMPS Axel Kohlmeyer
05:06 [lammps-users] Creation of slab for the calculation of interfacial tension Tan H
04:53 Re: [lammps-users] calculation of the pressure tensor element pxy Axel Kohlmeyer
03:45 [lammps-users] cna/atom filter to sort out a particular atom within LAMMPS Selesta Oxem
03:24 [lammps-users] calculation of the pressure tensor element pxy 城野亮太
01:48 Re: [lammps-users] Problems related to fix rigid command 123753
01:22 Re: [lammps-users] Problems related to fix rigid command Axel Kohlmeyer
01:13 Re: [lammps-users] the file directory of Error Axel Kohlmeyer

September 08, 2020
22:37 Re: [lammps-users] Finding Neighbors within a radius X Christian Kelley
21:06 Re: [lammps-users] Problems related to fix rigid command 123753
20:51 [lammps-users] the file directory of Error 吴标
20:51 Re: [lammps-users] passing energy from python driver to lammps using fix external pf/callback Sandeep Reddy
20:46 Re: [lammps-users] passing energy from python driver to lammps using fix external pf/callback Axel Kohlmeyer
20:41 [lammps-users] passing energy from python driver to lammps using fix external pf/callback Sandeep Reddy
20:35 Re: [lammps-users] Problems related to fix rigid command Axel Kohlmeyer
20:25 [lammps-users] Problems related to fix rigid command 123753
20:23 Re: [lammps-users] Fix pour granules with diameter from a distribution Axel Kohlmeyer
20:06 [lammps-users] Fix pour granules with diameter from a distribution Jiangzhi Chen
15:17 Re: [lammps-users] Hydrostatic pressure Axel Kohlmeyer
15:06 [lammps-users] Hydrostatic pressure ashish singh
11:32 Re: [lammps-users] interaction Axel Kohlmeyer
11:07 [lammps-users] interaction kai nan
10:24 Re: [lammps-users] fix deform - Out of range atoms (PPPM) Axel Kohlmeyer
09:17 Re: [lammps-users] fix deform - Out of range atoms (PPPM) MD Simulation
07:27 Re: [lammps-users] fix deform - Out of range atoms (PPPM) Axel Kohlmeyer
07:02 Re: [lammps-users] fix deform - Out of range atoms (PPPM) MD Simulation
06:05 Re: [lammps-users] Potential energy of multiple groups Axel Kohlmeyer
05:59 Re: [lammps-users] Potential energy of multiple groups Vishnu Wakof
05:29 Re: [lammps-users] Potential energy of multiple groups Axel Kohlmeyer
05:20 Re: [lammps-users] Dumping total charge of molecule Axel Kohlmeyer
05:16 Re: [lammps-users] Compatibility LAMMPS - LIGGGTHS Axel Kohlmeyer
05:06 [lammps-users] Potential energy of multiple groups Vishnu Wakof
04:19 [lammps-users] Compatibility LAMMPS - LIGGGTHS Oier Arcelus
04:08 [lammps-users] Dumping total charge of molecule Rupayan Das
00:01 [lammps-users] Lammps example code in examples\USER\misc\drip cannot work Dan Jiadong

September 07, 2020
17:34 [lammps-users] Problems and Questions about atom_style sphere Chang Liu
15:35 Re: [lammps-users] Using multiple nodes with Lammps paul buscemi
14:09 Re: [lammps-users] fix deform - Out of range atoms (PPPM) Will Pisani
13:19 Re: [lammps-users] Using multiple nodes with Lammps Axel Kohlmeyer
12:48 [lammps-users] input example of many-body monatomic water model mW in LAMMPS Hongxia Hao
10:25 [lammps-users] fix deform - Out of range atoms (PPPM) MD Simulation
09:49 [lammps-users] Using multiple nodes with Lammps paul buscemi

September 06, 2020
14:46 Re: [lammps-users] installation gpu architecture compute_30 error Axel Kohlmeyer
14:33 Re: [lammps-users] installation gpu architecture compute_30 error Axel Kohlmeyer
14:06 Re: [lammps-users] installation gpu architecture compute_30 error paul buscemi

September 05, 2020
19:38 Re: [lammps-users] installation gpu architecture compute_30 error Axel Kohlmeyer
18:34 [lammps-users] installation gpu architecture compute_30 error paul buscemi
10:12 [lammps-users] Research Associate / Assistant at CSIR - NML Dr. SUNIL KUMAR

September 04, 2020
19:40 Re: [lammps-users] Using lj/class2/coul/long with non periodic boundary condition Axel Kohlmeyer
19:31 [lammps-users] Using lj/class2/coul/long with non periodic boundary condition abhiram br
09:01 Re: [lammps-users] fix bond/create - more than one atype MD Simulation
08:59 Re: [lammps-users] fix bond/create - more than one atype Axel Kohlmeyer
08:44 [lammps-users] fix bond/create - more than one atype MD Simulation
06:26 Re: [lammps-users] REAXFF-data-bond\angle\dihedrals\impropers Axel Kohlmeyer
05:00 [lammps-users] REAXFF-data-bond\angle\dihedrals\impropers 吴标

September 03, 2020
16:47 Re: [lammps-users] Finding Neighbors within a radius X Axel Kohlmeyer
16:35 Re: [lammps-users] Finding Neighbors within a radius X Christian Kelley
15:54 Re: [lammps-users] Finding Neighbors within a radius X Axel Kohlmeyer
15:22 Re: [lammps-users] Modifying heat flux calculations Axel Kohlmeyer
15:17 Re: [lammps-users] Modifying heat flux calculations Subhadeep De
15:16 [lammps-users] Finding Neighbors within a radius X Christian Kelley
14:51 Re: [lammps-users] Modifying heat flux calculations Axel Kohlmeyer
14:07 [lammps-users] Modifying heat flux calculations Subhadeep De
11:03 Re: [lammps-users] Obtain a displacement field in k-space. Axel Kohlmeyer
10:44 Re: [lammps-users] Obtain a displacement field in k-space. Miru Lee

September 02, 2020
16:43 [lammps-users] Problem with GCMC deleting Host Structure Richard S Hong
07:53 [lammps-users] How to simulate compressing a triclinic layer strcture under 10MPa pressure ??????
05:34 [lammps-users] 回复: problem with fix shake lqy
04:14 Re: [lammps-users] problem with fix shake Axel Kohlmeyer
04:05 Re: [lammps-users] problem with fix shake Axel Kohlmeyer
01:34 [lammps-users] problem with fix shake lqy

September 01, 2020
15:53 [lammps-users] MPI Initialization error while coupling LAMMPS and VASP Vrindaa Somjit
15:29 Re: [lammps-users] ERROR : New bond exceeded special list size in fix bond/create Axel Kohlmeyer
15:17 Re: [lammps-users] Total timestep doesn't match the settings of bigbig weicaojay
13:17 Re: [lammps-users] ERROR : New bond exceeded special list size in fix bond/create Bradley D. Keister
13:12 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
12:59 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
12:44 Re: [lammps-users] Total timestep doesn't match the settings of bigbig Axel Kohlmeyer
12:40 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
12:38 [lammps-users] Total timestep doesn't match the settings of bigbig weicaojay
12:11 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
11:50 Re: [lammps-users] ERROR : New bond exceeded special list size in fix bond/create Axel Kohlmeyer
11:21 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
11:14 Re: [lammps-users] ERROR : New bond exceeded special list size in fix bond/create Bradley D. Keister
10:01 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
09:53 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
09:48 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
09:31 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
09:20 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
09:14 Re: [lammps-users] Running LAMMPs on PSC Axel Kohlmeyer
09:06 Re: [lammps-users] Trouble understanding the box dimensions from a dump file Axel Kohlmeyer
08:48 [lammps-users] Running LAMMPs on PSC Cameron Sterrett
08:29 [lammps-users] Trouble understanding the box dimensions from a dump file Antoine Rincent
07:54 Re: [lammps-users] Lost atoms: original 6864 current 6782 (../thermo.cpp:438) Axel Kohlmeyer
07:51 [lammps-users] Lost atoms: original 6864 current 6782 (../thermo.cpp:438) guanguan
04:10 Re: [lammps-users] Finding a fix for a wall Syed Shuja Zaidi (P19PH007)
04:06 Re: [lammps-users] Finding a fix for a wall Axel Kohlmeyer
03:00 [lammps-users] Finding a fix for a wall Syed Shuja Zaidi (P19PH007)

August 31, 2020
23:06 Re: [lammps-users] MPI Executable for Windows Rjaymz DelaCruz
23:05 Re: [lammps-users] MPI Executable for Windows Axel Kohlmeyer
21:44 Re: [lammps-users] MPI Executable for Windows Rjaymz DelaCruz
21:35 Re: [lammps-users] MPI Executable for Windows Axel Kohlmeyer
21:03 Re: [lammps-users] MPI Executable for Windows Rjaymz DelaCruz
21:01 Re: [lammps-users] MPI Executable for Windows Axel Kohlmeyer
20:53 Re: [lammps-users] MPI Executable for Windows Rjaymz DelaCruz
19:09 Re: [lammps-users] ERROR : New bond exceeded special list size in fix bond/create Axel Kohlmeyer
19:05 Re: [lammps-users] Carbon Strain Test Axel Kohlmeyer
18:45 [lammps-users] Carbon Strain Test Rjaymz DelaCruz
15:47 Re: [lammps-users] MoS2 slab melts unexpectedly Dinushka Herath
15:17 [lammps-users] ERROR : New bond exceeded special list size in fix bond/create Bradley D. Keister
14:52 Re: [lammps-users] Additional per-atom variables Axel Kohlmeyer
14:31 Re: [lammps-users] Additional per-atom variables Axel Kohlmeyer
14:17 [lammps-users] Additional per-atom variables Joe Cooke
13:11 Re: [lammps-users] MoS2 slab melts unexpectedly Axel Kohlmeyer
12:20 Re: [lammps-users] MoS2 slab melts unexpectedly Dinushka Herath
11:47 Re: [lammps-users] computing local densities Axel Kohlmeyer
11:24 Re: [lammps-users] computing local densities Bradley D. Keister
04:09 Re: [lammps-users] The mechanism of sbmask and atom->mask Axel Kohlmeyer
03:49 [lammps-users] The mechanism of sbmask and atom->mask 李吉辰
03:40 Re: [lammps-users] Boundary conditions/REAXFF Axel Kohlmeyer
03:35 Re: [lammps-users] velocity command Axel Kohlmeyer

August 30, 2020
23:43 [lammps-users] velocity command 吴标
23:35 [lammps-users] Boundary conditions/REAXFF 吴标
17:00 Re: [lammps-users] About pair_write error Axel Kohlmeyer
14:45 Re: [lammps-users] About pair_write error Yinong Zhao
12:42 Re: [lammps-users] About pair_write error Axel Kohlmeyer
11:54 [lammps-users] About pair_write error Yinong Zhao
10:51 Re: [lammps-users] Communication cutoff 1.4225 is shorter than a bond length based estimate of 1.755. This may lead to errors. (../comm.cpp:685) Axel Kohlmeyer
10:44 Re: [lammps-users] minimize command Toon Tavas
10:41 Re: [lammps-users] Pair_style table pppm Axel Kohlmeyer
09:02 [lammps-users] Communication cutoff 1.4225 is shorter than a bond length based estimate of 1.755. This may lead to errors. (../comm.cpp:685) ??????
08:12 [lammps-users] Pair_style table pppm Grey Geng
03:24 Re: [lammps-users] minimize command Syed Shuja Zaidi (P19PH007)

August 29, 2020
22:50 Re: [lammps-users] minimize command Toon Tavas
22:27 Re: [lammps-users] minimize command Syed Shuja Zaidi (P19PH007)
22:17 Re: [lammps-users] minimize command Syed Shuja Zaidi (P19PH007)
21:26 Re: [lammps-users] minimize command Toon Tavas
20:50 Re: [lammps-users] minimize command Ray Shan
19:31 [lammps-users] minimize command Toon Tavas
16:04 Re: [lammps-users] MoS2 slab melts unexpectedly Axel Kohlmeyer
15:54 Re: [lammps-users] MoS2 slab melts unexpectedly Axel Kohlmeyer
15:43 Re: [lammps-users] MoS2 slab melts unexpectedly Dinushka Herath
15:26 Re: [lammps-users] MoS2 slab melts unexpectedly Axel Kohlmeyer
10:56 [lammps-users] MoS2 slab melts unexpectedly Herath, Dinushka
10:53 [lammps-users] MoS2 slab melts unexpectedly Dinushka Herath

August 28, 2020
14:12 Re: [lammps-users] Rerun LAMMPS using python driven script Axel Kohlmeyer
13:17 [lammps-users] Rerun LAMMPS using python driven script Xiaoyu Wang
09:21 [lammps-users] Postdoc Position in Atomistic Simulations of Thermally Activated Processes Ma, Duancheng
04:54 Re: [lammps-users] (no subject) Axel Kohlmeyer
04:45 Re: [lammps-users] Equilibration Axel Kohlmeyer

August 27, 2020
23:58 [lammps-users] Equilibration Rupayan Das
19:06 [lammps-users] (no subject) Rjaymz DelaCruz
17:18 Re: [lammps-users] Velocity resetting every N steps Axel Kohlmeyer
16:35 Re: [lammps-users] Velocity resetting every N steps Grey Geng
14:28 Re: [lammps-users] Velocity resetting every N steps Axel Kohlmeyer
13:31 [lammps-users] Velocity resetting every N steps Grey Geng
11:06 Re: [lammps-users] Running a water simulation using the molecule command [beginner] Axel Kohlmeyer
10:32 [lammps-users] Running a water simulation using the molecule command [beginner] Baret Amaury
01:23 Re: [lammps-users] Graphene sheet average area Axel Kohlmeyer
00:54 [lammps-users] Graphene sheet average area Harkishan Dua

August 26, 2020
20:45 Re: [lammps-users] How to realize pressure control with non-periodic boundary Axel Kohlmeyer
20:39 [lammps-users] How to realize pressure control with non-periodic boundary guanguan
19:08 Re: [lammps-users] Error raise while compiling GPU PKG Axel Kohlmeyer
17:57 [lammps-users] Error raise while compiling GPU PKG 李吉辰
15:55 [lammps-users] Postdoc opening doing machine learning and atomistic simulations of grain boundaries Eric Homer
14:42 Re: [lammps-users] How to reduce the kspace timings Axel Kohlmeyer
14:23 Re: [lammps-users] How to reduce the kspace timings Earnest Ch
14:19 Re: [lammps-users] [EXTERNAL] Re: KOKKOS-CUDA runtime error DUAN, XIAOFENG F CTR USAF AFMC AFRL/RCM
13:55 Re: [lammps-users] (no subject) Syed Shuja Zaidi (P19PH007)
13:41 Re: [lammps-users] (no subject) Axel Kohlmeyer
13:08 Re: [lammps-users] Mass set Axel Kohlmeyer
12:44 Re: [lammps-users] [EXTERNAL] Re: KOKKOS-CUDA runtime error Moore, Stan
12:37 [lammps-users] Mass set kai nan
12:36 Re: [lammps-users] [EXTERNAL] Re: KOKKOS-CUDA runtime error Moore, Stan
11:28 Re: [lammps-users] (no subject) Syed Shuja Zaidi (P19PH007)
11:21 Re: [lammps-users] (no subject) Syed Shuja Zaidi (P19PH007)
11:14 Re: [lammps-users] (no subject) Axel Kohlmeyer
10:51 Re: [lammps-users] unwrapped coordinate Axel Kohlmeyer
10:39 [lammps-users] unwrapped coordinate shamimul ahsan
10:18 Re: [lammps-users] Calculation of thermal conductivity of Polymer Ankur Chaurasia
10:16 Re: [lammps-users] Calculation of thermal conductivity of Polymer Axel Kohlmeyer
10:10 Re: [lammps-users] Calculation of thermal conductivity of Polymer Ankur Chaurasia
09:47 [lammps-users] (no subject) Syed Shuja Zaidi (P19PH007)
09:15 Re: [lammps-users] Calculation of thermal conductivity of Polymer Axel Kohlmeyer
07:49 Re: [lammps-users] Calculation of thermal conductivity of Polymer Ankur Chaurasia
06:24 Re: [lammps-users] Calculation of thermal conductivity of Polymer Axel Kohlmeyer
05:52 [lammps-users] Calculation of thermal conductivity of Polymer Ankur Chaurasia
05:48 Re: [lammps-users] Measuring temperature change caused by Microwave absorption Axel Kohlmeyer
05:45 Re: [lammps-users] Measuring temperature change caused by Microwave absorption Axel Kohlmeyer
05:23 Re: [lammps-users] Measuring temperature change caused by Microwave absorption Tahsin Ashraf Khan
05:10 Re: [lammps-users] Measuring temperature change caused by Microwave absorption Axel Kohlmeyer
03:31 Re: [lammps-users] Measuring temperature change caused by Microwave absorption Tahsin Ashraf Khan
02:18 [lammps-users] Fw: PhD Position in Atomistic Simulations of Crystal Defects Ma, Duancheng
00:31 Re: [lammps-users] Bond atom missing in image check (../domain.cpp:765) Axel Kohlmeyer

August 25, 2020
21:20 [lammps-users] Bond atom missing in image check (../domain.cpp:765) guanguan
15:39 Re: [lammps-users] LAMMPS: Average energy vs time output Syed Shuja Zaidi (P19PH007)
15:37 Re: [lammps-users] LAMMPS: Average energy vs time output Syed Shuja Zaidi (P19PH007)
14:01 Re: [lammps-users] LAMMPS: Average energy vs time output Axel Kohlmeyer
13:53 Re: [lammps-users] Specifying Location in in.langevin example Axel Kohlmeyer
13:41 Re: [lammps-users] Specifying Location in in.langevin example Michael Eberhardt
12:18 [lammps-users] LAMMPS: Average energy vs time output Cameron Sterrett
08:14 Re: [lammps-users] How to achieve stress-strain response at low strain-rate (quasi-static uni-axial tensile test ) Chowdhury, Sanjib
07:59 Re: [lammps-users] Calculate net x force component for all atoms or group Ankit Chauhan
04:01 Re: [lammps-users] Obtain a displacement field in k-space. Axel Kohlmeyer
03:34 Re: [lammps-users] Obtain a displacement field in k-space. Miru Lee
01:21 Re: [lammps-users] Specifying Location in in.langevin example Axel Kohlmeyer

August 24, 2020
23:24 [lammps-users] Specifying Location in in.langevin example Michael Eberhardt
18:01 Re: [lammps-users] Atom_style issue? Axel Kohlmeyer
17:58 [lammps-users] Atom_style issue? Mayank Gupta
15:00 Re: [lammps-users] KOKKOS-CUDA runtime error Axel Kohlmeyer
14:21 [lammps-users] KOKKOS-CUDA runtime error DUAN, XIAOFENG F CTR USAF AFMC AFRL/RCM
14:14 Re: [lammps-users] segmentation fault and building regions Axel Kohlmeyer
14:04 Re: [lammps-users] segmentation fault and building regions Bradley D. Keister
13:40 Re: [lammps-users] segmentation fault and building regions Axel Kohlmeyer
13:21 [lammps-users] segmentation fault and building regions Bradley D . Keister
12:03 Re: [lammps-users] Obtain a displacement field in k-space. Axel Kohlmeyer
11:31 [lammps-users] Obtain a displacement field in k-space. Miru Lee
07:41 Re: [lammps-users] Calcualtion of velocity profile in lammps Pengyu Huang
07:37 Re: [lammps-users] Setting number density of point particles Hirakjyoti Sarma
07:36 Re: [lammps-users] Setting number density of point particles Axel Kohlmeyer
07:34 Re: [lammps-users] fix ave/chunk Axel Kohlmeyer
07:32 [lammps-users] Setting number density of point particles Hirakjyoti Sarma
07:29 Re: [lammps-users] Calculate net x force component for all atoms or group Axel Kohlmeyer
00:38 [lammps-users] fix ave/chunk zhanganying

August 23, 2020
23:17 Re: [lammps-users] Calculate net x force component for all atoms or group Ankit Chauhan
18:17 Re: [lammps-users] Rigid polyhedral unit Axel Kohlmeyer
17:52 Re: [lammps-users] Rigid polyhedral unit Mayank Gupta
13:44 Re: [lammps-users] How to use MAEAM potential in lammps? Axel Kohlmeyer
13:36 Re: [lammps-users] How to use MAEAM potential in lammps? Axel Kohlmeyer
12:23 [lammps-users] How to use MAEAM potential in lammps? Iasir, Abu Rafi Mohammad (MU-Student)
10:34 Re: [lammps-users] Calculate net x force component for all atoms or group Axel Kohlmeyer
10:17 Re: [lammps-users] Calculate net x force component for all atoms or group Ankit Chauhan
09:12 Re: [lammps-users] Calculate net x force component for all atoms or group Axel Kohlmeyer
08:20 Re: [lammps-users] Calculate net x force component for all atoms or group Syed Shuja Zaidi (P19PH007)
08:06 Re: [lammps-users] Calculate net x force component for all atoms or group Ankit Chauhan
07:10 Re: [lammps-users] Calculate net x force component for all atoms or group Axel Kohlmeyer
06:41 [lammps-users] Calculate net x force component for all atoms or group Ankit Chauhan
03:50 Re: [lammps-users] Rigid polyhedral unit Axel Kohlmeyer
00:08 [lammps-users] Rigid polyhedral unit Mayank Gupta

August 22, 2020
18:20 Re: [lammps-users] Illegal compute chunk/atom command while computing thermal conductivity Axel Kohlmeyer
18:03 [lammps-users] Illegal compute chunk/atom command while computing thermal conductivity George Ray
13:31 Re: [lammps-users] Conditional Statment Axel Kohlmeyer
09:49 Re: [lammps-users] Conditional Statment Khaled Mohamed
09:43 Re: [lammps-users] Conditional Statment Axel Kohlmeyer
09:41 Re: [lammps-users] Conditional Statment Axel Kohlmeyer
09:37 Re: [lammps-users] Conditional Statment Prathamesh Deshpande
08:09 [lammps-users] Conditional Statment Khaled Mohamed
02:34 Re: [lammps-users] using Fix move twice in one script Axel Kohlmeyer
01:09 [lammps-users] using Fix move twice in one script Neda Mousavi

August 21, 2020
12:00 Re: [lammps-users] Mass problem Axel Kohlmeyer
11:21 [lammps-users] Mass problem kai nan
10:22 [lammps-users] Re :Re: How to Make calculation of ionic conductivity with lammps kadjesteve7@...24...
08:36 Re: [lammps-users] DPD for crosslinked polymer networks? Axel Kohlmeyer
08:28 Re: [lammps-users] How to Make calculation of ionic conductivity with lammps Axel Kohlmeyer
07:40 [lammps-users] How to Make calculation of ionic conductivity with lammps kadjesteve7@...24...
07:26 [lammps-users] DPD for crosslinked polymer networks? Adam, Brian
07:20 Re: [lammps-users] Lost atoms Steve Plimpton
07:12 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Steve Plimpton
07:06 Re: [lammps-users] Calcualtion of velocity profile in lammps Steve Plimpton
06:54 Re: [lammps-users] A question about modeling Pt/Co alloy Steve Plimpton
06:49 Re: [lammps-users] Thermal Conductivity of Diamond Calculation Steve Plimpton

August 20, 2020
14:07 Re: [lammps-users] Fix deform settings not consistent with restart Axel Kohlmeyer
13:49 [lammps-users] Fix deform settings not consistent with restart Сергей Клявинек
06:42 Re: [lammps-users] Using OPLS on Nitrocellulose with LAMMPS Axel Kohlmeyer
06:15 [lammps-users] Using OPLS on Nitrocellulose with LAMMPS Gibbon C . B .

August 19, 2020
20:53 [lammps-users] 回复: Can "fix" command implement in molecule id style? JIANG, PolyU XIAO [Student]
13:18 Re: [lammps-users] Can "fix" command implement in molecule id style? Axel Kohlmeyer
10:28 [lammps-users] Open positions for mesoscale bio-modeling in ERC-funded lab in Italy Francesco Pasqualini
08:07 [lammps-users] 回复: Can "fix" command implement in molecule id style? JIANG, PolyU XIAO [Student]
07:45 Re: [lammps-users] Can "fix" command implement in molecule id style? Axel Kohlmeyer
07:37 Re: [lammps-users] gcmc Lost atoms running on multi nodes Axel Kohlmeyer
07:30 Re: [lammps-users] How to reduce the kspace timings Axel Kohlmeyer
07:00 Re: [lammps-users] Particle deposition unsuccessful Axel Kohlmeyer
05:19 [lammps-users] Particle deposition unsuccessful Abdullah Arafat
05:11 Re: [lammps-users] lost atoms and particles not depositing properly Abdullah Arafat
04:28 [lammps-users] How to reduce the kspace timings Earnest Ch
03:58 [lammps-users] 回复: Can "fix" command implement in molecule id style? JIANG, PolyU XIAO [Student]
03:43 [lammps-users] Lost atoms Abdullah Arafat
02:39 [lammps-users] gcmc Lost atoms running on multi nodes ??????

August 18, 2020
22:41 Re: [lammps-users] How to build a serial and no optimization version to debugger? Axel Kohlmeyer
22:00 [lammps-users] How to build a serial and no optimization version to debugger? 李吉辰
21:57 Re: [lammps-users] How to group a perticular type of atom in a region Ankur Chaurasia
14:40 Re: [lammps-users] Step function Axel Kohlmeyer
14:28 Re: [lammps-users] USER-INTEL underperforming on Cascade Lake Jonathan D. Halverson
14:23 [lammps-users] Step function Hamed Nobarani
11:47 Re: [lammps-users] How to group a perticular type of atom in a region Axel Kohlmeyer
11:27 [lammps-users] How to group a perticular type of atom in a region Ankur Chaurasia
09:08 Re: [lammps-users] Fw:How to define an ellipsoidal region in LAMMPS simulations? Axel Kohlmeyer
08:36 [lammps-users] Fw:How to define an ellipsoidal region in LAMMPS simulations? Liu Shuai
07:12 Re: [lammps-users] Choosing neighbor skin width Axel Kohlmeyer
07:06 Re: [lammps-users] Choosing neighbor skin width Mayank
07:05 Re: [lammps-users] Choosing neighbor skin width Mayank
06:32 [lammps-users] storage and loss modulus Raghvendra P. Singh
06:09 Re: [lammps-users] Choosing neighbor skin width Axel Kohlmeyer
05:39 [lammps-users] Choosing neighbor skin width Mayank
05:30 Re: [lammps-users] lost atoms and particles not depositing properly Axel Kohlmeyer
05:05 Re: [lammps-users] Can "fix" command implement in molecule id style? Axel Kohlmeyer
03:58 [lammps-users] lost atoms and particles not depositing properly Abdullah Arafat
03:14 [lammps-users] Can "fix" command implement in molecule id style? JIANG, PolyU XIAO [Student]
03:05 [lammps-users] Can "fix" command implement in molecule id style? JIANG, PolyU XIAO [Student]

August 17, 2020
22:28 Re: [lammps-users] compatibility of force fields (CVFF+amber) Axel Kohlmeyer
22:27 Re: [lammps-users] Fix between pair computations? Anne B
22:21 Re: [lammps-users] Fix between pair computations? Axel Kohlmeyer
22:06 Re: [lammps-users] Fix between pair computations? Axel Kohlmeyer
22:03 Re: [lammps-users] Fix between pair computations? Anne B
21:57 Re: [lammps-users] Fix between pair computations? Anne B
21:42 Re: [lammps-users] Fix between pair computations? Axel Kohlmeyer
21:30 [lammps-users] compatibility of force fields (CVFF+amber) 刘鹏
20:57 Re: [lammps-users] Fix between pair computations? Anne B
18:52 Re: [lammps-users] Ocl-get-devices found the GPU, but still unablt to initilization the device Axel Kohlmeyer
18:11 [lammps-users] Ocl-get-devices found the GPU, but still unablt to initilization the device 黄旭炜
16:42 Re: [lammps-users] fix bond/react for cabon nanotube Jacob Gissinger
15:36 Re: [lammps-users] fix bond/react for cabon nanotube Prathamesh Deshpande
13:28 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Axel Kohlmeyer
13:19 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Jordan Campbell
07:25 Re: [lammps-users] Fix between pair computations? Axel Kohlmeyer
07:23 Re: [lammps-users] An illegal memory access was encountered when running with Kokkos in GPU Ray Shan
07:15 Re: [lammps-users] box/relax in long-range Coulomb systems Axel Kohlmeyer
06:57 Re: [lammps-users] Python library interface Axel Kohlmeyer
06:55 Re: [lammps-users] An illegal memory access was encountered when running with Kokkos in GPU Axel Kohlmeyer
06:52 Re: [lammps-users] Installation of OMP package Axel Kohlmeyer
05:30 Re: [lammps-users] Fwd: Hydro-static Test Roman Gröger
04:21 [lammps-users] Fwd: Hydro-static Test ashish singh
04:11 [lammps-users] An illegal memory access was encountered when running with Kokkos in GPU 刘志伟
03:37 [lammps-users] fix bond/react for cabon nanotube ??????
02:52 [lammps-users] Using OPLS on Nitrocellulose with LAMMPS Gibbon C . B .
02:51 [lammps-users] Python library interface majid johari
01:09 Re: [lammps-users] Colour coding depending on the radial distance Hirakjyoti Sarma
00:41 Re: [lammps-users] Colour coding depending on the radial distance JWG
00:37 Re: [lammps-users] box/relax in long-range Coulomb systems Roman Gröger

August 16, 2020
23:39 [lammps-users] Installation of OMP package Chia-nien Tsai
23:39 [lammps-users] Colour coding depending on the radial distance Hirakjyoti Sarma
22:24 Re: [lammps-users] Fix between pair computations? Anne B
22:23 [lammps-users] fix bond/react for cabon nanotube ??????
14:33 Re: [lammps-users] Breaking Wave Simulation Axel Kohlmeyer
14:31 Re: [lammps-users] expressing lattice parameter as a function of temperature. Axel Kohlmeyer
14:27 Re: [lammps-users] box/relax in long-range Coulomb systems Axel Kohlmeyer
11:49 [lammps-users] box/relax in long-range Coulomb systems Roman Gröger
03:29 [lammps-users] expressing lattice parameter as a function of temperature. Hrushikesh Kulkarni
02:19 [lammps-users] Breaking Wave Simulation kok chen than

August 15, 2020
18:52 Re: [lammps-users] long-range coulombic energy Axel Kohlmeyer
18:42 Re: [lammps-users] long-range coulombic energy Jo
16:25 Re: [lammps-users] long-range coulombic energy Axel Kohlmeyer
16:09 [lammps-users] long-range coulombic energy Jo
15:21 Re: [lammps-users] (no subject) Y. Wang
10:11 Re: [lammps-users] unwrap data file Axel Kohlmeyer
10:04 Re: [lammps-users] unwrap data file Victor Nazarychev
09:48 Re: [lammps-users] unwrap data file Axel Kohlmeyer
09:38 Re: [lammps-users] unwrap data file Victor Nazarychev
08:59 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Jordan Campbell
08:52 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Axel Kohlmeyer
08:50 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Jordan Campbell
08:23 Re: [lammps-users] Regarding Diffusion Coefficients With Lammps Axel Kohlmeyer
08:10 Re: [lammps-users] unwrap data file Axel Kohlmeyer
07:44 [lammps-users] Regarding Diffusion Coefficients With Lammps Jordan Campbell
04:19 [lammps-users] unwrap data file Victor Nazarychev

August 14, 2020
10:46 [lammps-users] Calcualtion of velocity profile in lammps Pengyu Huang
07:50 Re: [lammps-users] Solvent Temperature abd Pressure Axel Kohlmeyer
06:53 [lammps-users] Solvent Temperature abd Pressure hamid babaiean

August 13, 2020
19:51 [lammps-users] Binding energy Navjot Kaur
18:00 Re: [lammps-users] computing local densities Axel Kohlmeyer
17:10 Re: [lammps-users] computing local densities Bradley D. Keister
14:58 Re: [lammps-users] using NPT with fixed slabs Toon Tavas
14:36 Re: [lammps-users] using NPT with fixed slabs Atefeh Tarokh
14:33 Re: [lammps-users] using NPT with fixed slabs Toon Tavas
14:14 [lammps-users] using NPT with fixed slabs Atefeh Tarokh
12:52 Re: [lammps-users] lost atoms error when using 'fix reax/c/species ' command Axel Kohlmeyer
11:29 [lammps-users] lost atoms error when using 'fix reax/c/species ' command Chen, Wenlong
08:59 Re: [lammps-users] computing local densities Axel Kohlmeyer
08:54 [lammps-users] computing local densities Bradley D. Keister
08:37 Re: [lammps-users] Generating the input file Axel Kohlmeyer
08:34 [lammps-users] Generating the input file Rupayan Das
07:41 Re: [lammps-users] Wrong temperature value when simulating rigid linear molecules in conjunction with pair_style zero Axel Kohlmeyer
07:32 Re: [lammps-users] Wrong temperature value when simulating rigid linear molecules in conjunction with pair_style zero Valerio Sorichetti
07:06 Re: [lammps-users] regarding desired volume fraction of LJ particles in simulation box Axel Kohlmeyer
06:58 Re: [lammps-users] (no subject) Axel Kohlmeyer
05:31 Re: [lammps-users] regarding desired volume fraction of LJ particles in simulation box Raghvendra P. Singh
05:07 Re: [lammps-users] Wrong temperature value when simulating rigid linear molecules in conjunction with pair_style zero Valerio Sorichetti
01:43 [lammps-users] How to set the properties of the metal layer zhanganying
00:07 [lammps-users] (no subject) Y. Wang

August 12, 2020
19:57 Re: [lammps-users] superheated water vapor molecules Axel Kohlmeyer
19:28 [lammps-users] superheated water vapor molecules 18817075150
19:17 Re: [lammps-users] How to calculate total energy per atom? Axel Kohlmeyer
18:44 [lammps-users] How to calculate total energy per atom? 공과대학 원자력공학과
12:48 Re: [lammps-users] Calculating property per timestep using current temperature Axel Kohlmeyer
12:31 Re: [lammps-users] Calculating property per timestep using current temperature Hirakjyoti Sarma
12:30 Re: [lammps-users] Calculating property per timestep using current temperature Hirakjyoti Sarma
12:24 Re: [lammps-users] Calculating property per timestep using current temperature Axel Kohlmeyer
11:53 [lammps-users] Calculating property per timestep using current temperature Hirakjyoti Sarma
10:36 Re: [lammps-users] USER-INTEL underperforming on Cascade Lake Axel Kohlmeyer
10:29 Re: [lammps-users] Wrong temperature value when simulating rigid linear molecules in conjunction with pair_style zero Axel Kohlmeyer
08:19 Re: [lammps-users] Potential Recommendation or Fix One? Axel Kohlmeyer
08:11 Re: [lammps-users] Unusual printing error Axel Kohlmeyer
08:07 Re: [lammps-users] Acceleration package for the meam/c potential Axel Kohlmeyer
08:02 Re: [lammps-users] bond_write command for angles and dihedrals (angle_write) Axel Kohlmeyer
07:48 Re: [lammps-users] regarding desired volume fraction of LJ particles in simulation box Axel Kohlmeyer
07:01 Re: [lammps-users] Potential Recommendation or Fix One? jack quinn
07:00 [lammps-users] Potential Recommendation or Fix One? jack quinn
06:46 [lammps-users] regarding desired volume fraction of LJ particles in simulation box Raghvendra P. Singh
04:37 [lammps-users] Wrong temperature value when simulating rigid linear molecules in conjunction with pair_style zero Valerio Sorichetti
04:36 [lammps-users] 回复: About the PMF calculation ZHANG zhang
03:50 [lammps-users] bond_write command for angles and dihedrals (angle_write) Pablo Palomino
02:51 Re: [lammps-users] Unusual printing error Syed Shuja Zaidi (P19PH007)
01:52 [lammps-users] Acceleration package for the meam/c potential Z*********

August 11, 2020
23:36 [lammps-users] Unusual printing error Jagroop Kaur
15:50 Re: [lammps-users] USER-INTEL underperforming on Cascade Lake Brown, Michael W
08:14 Re: [lammps-users] pair_style table and use of RSQ Valerio Sorichetti
03:39 Re: [lammps-users] Cannot compute PPPM when using Björn Hallbeck

August 10, 2020
13:07 [lammps-users] A question about modeling Pt/Co alloy Atefeh Tarokh
13:04 Re: [lammps-users] Fix between pair computations? Anne B
13:01 Re: [lammps-users] Fix between pair computations? Axel Kohlmeyer
12:55 Re: [lammps-users] Fix between pair computations? Anne B
12:48 Re: [lammps-users] Fix between pair computations? Anne B
12:27 Re: [lammps-users] Fix between pair computations? Axel Kohlmeyer
12:19 [lammps-users] Fix between pair computations? Anne B
11:53 Re: [lammps-users] Periodic boundaries and shake atoms missing Axel Kohlmeyer
11:46 Re: [lammps-users] spring constant in fix smd cfor mode Axel Kohlmeyer
11:37 [lammps-users] spring constant in fix smd cfor mode Behrooz Ferdowsi
11:14 Re: [lammps-users] Lost Atoms with fix wall/reflect Michael Chen
11:01 Re: [lammps-users] Lost Atoms with fix wall/reflect Axel Kohlmeyer
10:47 Re: [lammps-users] Lost Atoms with fix wall/reflect Michael Chen
09:51 [lammps-users] Thermal Conductivity of Diamond Calculation Ernesto Barraza
09:39 Re: [lammps-users] Periodic boundaries and shake atoms missing Piskulich, Ezekiel Ashe
09:21 Re: [lammps-users] Lost Atoms with fix wall/reflect Axel Kohlmeyer
09:12 Re: [lammps-users] pair_style table and use of RSQ Axel Kohlmeyer
09:01 Re: [lammps-users] pair_style table and use of RSQ Axel Kohlmeyer
05:20 [lammps-users] pair_style table and use of RSQ Valerio Sorichetti
02:28 Re: [lammps-users] "Rigid body atoms missing" at very large steps Qihan Ma

August 09, 2020
21:54 [lammps-users] Pair_Brownian: dynamic viscosity inceasing cause huge increase of temperature Hongning Ren
15:17 Re: [lammps-users] Potential energy difference with different force fields Axel Kohlmeyer
14:05 [lammps-users] Potential energy difference with different force fields Ehsan Shahini
11:55 Re: [lammps-users] "Rigid body atoms missing" at very large steps Axel Kohlmeyer
09:36 Re: [lammps-users] "Rigid body atoms missing" at very large steps Qihan Ma
09:11 Re: [lammps-users] Primary knock-on atom velocity Axel Kohlmeyer
08:49 [lammps-users] Primary knock-on atom velocity Debojyoti Nath
04:34 Re: [lammps-users] Energy, Pressure and Temperature reaching high values in few timestep Axel Kohlmeyer
04:04 Re: [lammps-users] Lost Atoms with fix wall/reflect Michael Chen
00:01 [lammps-users] Energy, Pressure and Temperature reaching high values in few timestep abhiram br

August 08, 2020
13:54 Re: [lammps-users] [EXTERNAL] Cohesive energy and Solubility parameter Karteek K. Bejagam
13:00 [lammps-users] Lost Atoms with fix wall/reflect Michael Chen
04:31 [lammps-users] "Rigid body atoms missing" at very large steps Qihan Ma

August 07, 2020
12:20 Re: [lammps-users] [EXTERNAL] Cohesive energy and Solubility parameter Thompson, Aidan
09:25 Re: [lammps-users] USER-INTEL underperforming on Cascade Lake Steve Plimpton
08:02 Re: [lammps-users] Cannot compute PPPM when using Axel Kohlmeyer
07:12 Re: [lammps-users] correct settings for T vs rho LJ equation of state Pierre de Buyl
06:46 [lammps-users] Cannot compute PPPM when using Björn Hallbeck

August 06, 2020
22:38 [lammps-users] USER-INTEL underperforming on Cascade Lake Jonathan D. Halverson
21:06 Re: [lammps-users] How to achieve stress-strain response at low strain-rate (quasi-static uni-axial tensile test ) Robert Hoy
16:36 Re: [lammps-users] Periodic boundaries and shake atoms missing ericabird
11:43 [lammps-users] How to achieve stress-strain response at low strain-rate (quasi-static uni-axial tensile test ) Arunjyoti sinha roy
10:49 Re: [lammps-users] How to achieve stress-strain response at low strain-rate (quasi-static uni-axial tensile test ) Chowdhury, Sanjib
10:19 Re: [lammps-users] Periodic boundaries and shake atoms missing Piskulich, Ezekiel Ashe
08:50 Re: [lammps-users] About the PMF calculation Giacomo Fiorin
08:37 [lammps-users] 回复: About the PMF calculation ZHANG zhang
08:13 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
07:28 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
07:16 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
07:02 Re: [lammps-users] Error with pair_coeff * * AlO.eam.alloy Axel Kohlmeyer
06:51 [lammps-users] Error with pair_coeff * * AlO.eam.alloy Víctor Juarros Cebrian

August 05, 2020
16:30 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
16:18 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
16:14 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
16:06 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
16:04 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
15:59 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
15:50 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
15:42 Re: [lammps-users] Particles going outside of the simulation box Axel Kohlmeyer
13:35 Re: [lammps-users] About the PMF calculation Giacomo Fiorin
10:15 [lammps-users] About the PMF calculation ZHANG zhang
10:04 Re: [lammps-users] Particles going outside of the simulation box Hirakjyoti Sarma
09:39 Re: [lammps-users] ghost particles and potential energy calculation Ευάγγελος Βογιατζής
08:32 [lammps-users] Question about fix langevin with fix nve JWG
08:22 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
07:50 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
07:45 Re: [lammps-users] ghost particles and potential energy calculation Axel Kohlmeyer
06:59 Re: [lammps-users] correct settings for T vs rho LJ equation of state Bradley D. Keister
04:11 [lammps-users] ghost particles and potential energy calculation swyang0501
03:53 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
01:16 Re: [lammps-users] Compiling options change output of dreiding example Schwarz Dr., Paul (FTI)

August 04, 2020
21:14 [lammps-users] Cohesive energy and Solubility parameter Karteek K. Bejagam
17:42 Re: [lammps-users] Compiling options change output of dreiding example Brown, Michael W
17:28 Re: [lammps-users] correct settings for T vs rho LJ equation of state Axel Kohlmeyer
17:10 [lammps-users] Periodic boundaries and shake atoms missing ericabird
13:51 [lammps-users] correct settings for T vs rho LJ equation of state Bradley D. Keister
13:36 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
13:05 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
12:50 Re: [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
12:42 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
10:37 Re: [lammps-users] Combining two simulation boxes with periodic boundary Axel Kohlmeyer
10:05 Re: [lammps-users] Compiling options change output of dreiding example Schwarz Dr., Paul (FTI)
09:56 [lammps-users] Combining two simulation boxes with periodic boundary Michael Chen
08:50 Re: [lammps-users] Compiling options change output of dreiding example Axel Kohlmeyer
08:31 Re: [lammps-users] Solid-State NEB Method Axel Kohlmeyer
08:22 [lammps-users] Compiling options change output of dreiding example Schwarz Dr., Paul (FTI)
08:08 Re: [lammps-users] Fwd: Lammps function regarding Axel Kohlmeyer
06:59 [lammps-users] Solid-State NEB Method 李力
06:25 [lammps-users] Fwd: Lammps function regarding RAHUL SURESH
05:03 Re: [lammps-users] pair_style lj/long/dipole/long Axel Kohlmeyer
02:54 [lammps-users] pair_style lj/long/dipole/long Maureen Nietiadi

August 03, 2020
17:37 Re: [lammps-users] Question about omega Axel Kohlmeyer
17:22 Re: [lammps-users] Question about omega Wade
13:22 Re: [lammps-users] ERROR: Pair style does not support compute group/group Axel Kohlmeyer
12:53 [lammps-users] ERROR: Pair style does not support compute group/group hamid babaiean
10:59 Re: [lammps-users] Modelling Rigid Cylinders Axel Kohlmeyer
10:04 Re: [lammps-users] Modelling Rigid Cylinders Khaled Mohamed
09:50 Re: [lammps-users] Modelling Rigid Cylinders Axel Kohlmeyer
09:25 Re: [lammps-users] Modelling Rigid Cylinders Axel Kohlmeyer
09:10 Re: [lammps-users] Question about omega Axel Kohlmeyer
08:44 [lammps-users] Question about omega Wade
08:16 Re: [lammps-users] Modelling Rigid Cylinders Khaled Mohamed
07:17 Re: [lammps-users] How to Read multiple data files JWG
06:44 Re: [lammps-users] How to Read multiple data files Axel Kohlmeyer
06:11 [lammps-users] How to Read multiple data files JWG
01:11 Re: [lammps-users] system not stable P rufer

August 01, 2020
23:12 Re: [lammps-users] Bilayer Boron Nitride Axel Kohlmeyer
23:05 Re: [lammps-users] Bilayer Boron Nitride Lokanath Patra
17:52 Re: [lammps-users] Modelling Rigid Cylinders Axel Kohlmeyer
17:01 [lammps-users] Modelling Rigid Cylinders Khaled Mohamed
10:15 Re: [lammps-users] [EXTERNAL] issues with calculating diffusion coefficient when jumps Thompson, Aidan
09:18 Re: [lammps-users] Particles on a spherical surface Steve Plimpton
02:03 Re: [lammps-users] Bilayer Boron Nitride Axel Kohlmeyer
00:53 [lammps-users] Particles on a spherical surface Mrinal Arandhara

July 31, 2020
23:03 [lammps-users] Bilayer Boron Nitride Lokanath Patra
20:07 Re: [lammps-users] [EXTERNAL] issues with calculating diffusion coefficient when jumps Morrissey, Liam S.
17:32 Re: [lammps-users] [EXTERNAL] issues with calculating diffusion coefficient when jumps Thompson, Aidan
17:07 Re: [lammps-users] [EXTERNAL] issues with calculating diffusion coefficient when jumps Thompson, Aidan
16:12 [lammps-users] issues with calculating diffusion coefficient when jumps Morrissey, Liam S.
11:00 Re: [lammps-users] Particles going outside of the simulation box Hirakjyoti Sarma
10:54 Re: [lammps-users] Particles going outside of the simulation box Axel Kohlmeyer
10:48 Re: [lammps-users] Particles going outside of the simulation box Hirakjyoti Sarma
10:38 Re: [lammps-users] Particles going outside of the simulation box Axel Kohlmeyer
10:21 [lammps-users] Particles going outside of the simulation box Hirakjyoti Sarma
08:57 Re: [lammps-users] WARNING: Communication cutoff 4.6 is shorter than a bond length based estimate Axel Kohlmeyer
08:23 Re: [lammps-users] Spherical charged particles of finite radius Hirakjyoti Sarma
07:48 Re: [lammps-users] WARNING: Communication cutoff 4.6 is shorter than a bond length based estimate Axel Kohlmeyer
06:44 [lammps-users] WARNING: Communication cutoff 4.6 is shorter than a bond length based estimate Paul Appshaw
06:29 Re: [lammps-users] system not stable Axel Kohlmeyer
05:17 Re: [lammps-users] Pulling graphene Axel Kohlmeyer
05:05 Re: [lammps-users] Spherical charged particles of finite radius Axel Kohlmeyer
02:53 [lammps-users] Pulling graphene Ankit Chauhan
02:45 [lammps-users] system not stable P rufer
00:46 Re: [lammps-users] Spherical charged particles of finite radius Hirakjyoti Sarma

July 30, 2020
23:29 Re: [lammps-users] Spherical charged particles of finite radius Axel Kohlmeyer
23:21 [lammps-users] Spherical charged particles of finite radius Hirakjyoti Sarma
18:45 Re: [lammps-users] Killed 9 problem Axel Kohlmeyer
18:29 Re: [lammps-users] Creating grain boundaries in Lammps for ZnO wurtzite Axel Kohlmeyer
17:10 Re: [lammps-users] Killed 9 problem Grey Geng
16:07 [lammps-users] Fwd: Creating grain boundaries in Lammps for ZnO wurtzite Gustavo M. Fortes
16:00 Re: [lammps-users] [EXTERNAL] Re: Unable to find reax parameter Jones, Keith
12:36 Re: [lammps-users] Unable to find reax parameter Aktulga, H. Metin
12:09 Re: [lammps-users] Problem running file with GPU Ali M
10:39 Re: [lammps-users] Problem running file with GPU Axel Kohlmeyer
10:29 Re: [lammps-users] Problem running file with GPU Ali M
10:07 Re: [lammps-users] Problem running file with GPU Axel Kohlmeyer
08:45 [lammps-users] Problem running file with GPU Ali M
08:15 Re: [lammps-users] Exit code 7 error on long simulations Axel Kohlmeyer
07:10 Re: [lammps-users] Killed 9 problem Axel Kohlmeyer
07:08 Re: [lammps-users] Killed 9 problem Ευάγγελος Βογιατζής
06:58 Re: [lammps-users] Exit code 7 error on long simulations Paul Appshaw
06:53 [lammps-users] Killed 9 problem Grey Geng
06:45 Re: [lammps-users] Delete atom in pair_style hybrid peri/lps lj/cut Axel Kohlmeyer
06:20 Re: [lammps-users] Exit code 7 error on long simulations Axel Kohlmeyer
05:31 [lammps-users] Exit code 7 error on long simulations Paul Appshaw

July 29, 2020
23:59 [lammps-users] R: Delete atom in pair_style hybrid peri/lps lj/cut DXS928@...6699...
19:38 Re: [lammps-users] Pressure relaxation during minimization Axel Kohlmeyer
19:25 Re: [lammps-users] building LAMMPS with GPU support Bradley D . Keister
18:09 Re: [lammps-users] How to use if command for atom variable JWG
15:44 [lammps-users] Pressure relaxation during minimization Raphael Knura
15:31 Re: [lammps-users] Help using dump image for 2d system? Steve Plimpton
15:26 Re: [lammps-users] Delete atom in pair_style hybrid peri/lps lj/cut Steve Plimpton
15:23 Re: [lammps-users] A Problem with fix evaporate command Steve Plimpton
13:21 Re: [lammps-users] How to use if command for atom variable Axel Kohlmeyer
13:11 [lammps-users] Help using dump image for 2d system? Amy Graves
13:07 Re: [lammps-users] cluster/atom Axel Kohlmeyer
12:55 Re: [lammps-users] cluster/atom sanchari bhatt
12:53 Re: [lammps-users] Fix Rigid Superdiffusive Behavior Axel Kohlmeyer
10:53 Re: [lammps-users] building LAMMPS with GPU support Axel Kohlmeyer
10:16 Re: [lammps-users] Fix Rigid Superdiffusive Behavior Piskulich, Ezekiel Ashe
09:51 Re: [lammps-users] building LAMMPS with GPU support Bradley D. Keister
09:33 Re: [lammps-users] How to use if command for atom variable JWG
09:07 Re: [lammps-users] Potential energy computations in lammps Axel Kohlmeyer
08:51 Re: [lammps-users] phonon Axel Kohlmeyer
08:40 Re: [lammps-users] Delete atom in pair_style hybrid peri/lps lj/cut Axel Kohlmeyer
08:34 Re: [lammps-users] How to use if command for atom variable Axel Kohlmeyer
07:48 [lammps-users] phonon majid johari
06:40 [lammps-users] Potential energy computations in lammps Adam, Brian
04:35 [lammps-users] Delete atom in pair_style hybrid peri/lps lj/cut DXS928@...6699...
03:03 Re: [lammps-users] How to use if command for atom variable JWG
02:33 Re: [lammps-users] How to use if command for atom variable Axel Kohlmeyer
00:28 [lammps-users] How to use if command for atom variable JWG

July 28, 2020
22:50 Re: [lammps-users] Pair_write for test and debug propose Axel Kohlmeyer
20:25 Re: [lammps-users] Pair_write for test and debug propose Grey Geng
16:55 [lammps-users] A Problem with fix evaporate command Atefeh Tarokh
16:53 Re: [lammps-users] Pair_write for test and debug propose Axel Kohlmeyer
16:35 [lammps-users] Pair_write for test and debug propose Grey Geng
09:41 [lammps-users] MEAM 2NN potential for Si Pascal Brault
09:41 Re: [lammps-users] different SIA formation energy for same input script hossain khan
08:41 Re: [lammps-users] Remove Atom(s) or Particle(s) after certain time Ahmed Hemeda
06:32 Re: [lammps-users] Sudden displacement for first step Ankit Chauhan
06:15 Re: [lammps-users] Sudden displacement for first step Axel Kohlmeyer
06:08 Re: [lammps-users] Questions about KSPACE Axel Kohlmeyer
05:53 Re: [lammps-users] Sudden displacement for first step Ankit Chauhan
05:06 Re: [lammps-users] Questions about KSPACE Alexander Petkov
04:49 Re: [lammps-users] Questions about KSPACE Axel Kohlmeyer
03:51 Re: [lammps-users] Questions about KSPACE Alexander Petkov
02:31 [lammps-users] read-dump command Asadollahzadeh

July 27, 2020
22:15 Re: [lammps-users] Sudden displacement for first step Ankit Chauhan
21:19 Re: [lammps-users] different SIA formation energy for same input script Axel Kohlmeyer
21:07 Re: [lammps-users] Remove Atom(s) or Particle(s) after certain time Axel Kohlmeyer
13:16 [lammps-users] Remove Atom(s) or Particle(s) after certain time Ahmed Hemeda
13:04 [lammps-users] different SIA formation energy for same input script hossain khan
05:22 Re: [lammps-users] Sudden displacement for first step Axel Kohlmeyer
04:31 Re: [lammps-users] Sudden displacement for first step Ankit Chauhan
04:28 Re: [lammps-users] ReaxFF EC molecule disintegration Axel Kohlmeyer
03:33 Re: [lammps-users] FEP on existing trajectory Agilio Padua
03:19 [lammps-users] ReaxFF EC molecule disintegration Hashan Peiris

July 26, 2020
19:45 Re: [lammps-users] Sudden displacement for first step Axel Kohlmeyer
18:37 Re: [lammps-users] Non-existent ReaxFF type Axel Kohlmeyer
18:01 [lammps-users] Non-existent ReaxFF type rizky.ruliandini71
07:16 [lammps-users] Sudden displacement for first step Ankit Chauhan
05:59 [lammps-users] Query about NEMD temperature profile Mayank Gupta

July 25, 2020
18:08 Re: [lammps-users] building LAMMPS with GPU support Axel Kohlmeyer
17:22 Re: [lammps-users] building LAMMPS with GPU support Bradley D. Keister
15:10 Re: [lammps-users] building LAMMPS with GPU support Axel Kohlmeyer
14:38 [lammps-users] building LAMMPS with GPU support Bradley D. Keister
13:43 Re: [lammps-users] Compute for Finding Nearby Atoms Christian Kelley
11:56 Re: [lammps-users] Regrading error in fix ttm Axel Kohlmeyer
10:13 [lammps-users] Regrading error in fix ttm Debojyoti Nath
10:06 Re: [lammps-users] Error with fix ttm Axel Kohlmeyer
01:24 [lammps-users] Error with fix ttm Debojyoti Nath

July 24, 2020
21:55 Re: [lammps-users] Compute for Finding Nearby Atoms Axel Kohlmeyer
21:37 Re: [lammps-users] Computing solute-solvent interaction Shrabanti Bhattacharya
20:33 [lammps-users] Compute for Finding Nearby Atoms Christian Kelley
15:43 [lammps-users] FEP on existing trajectory Mayank
14:19 Re: [lammps-users] Uniaxial tension Steve Plimpton
14:15 Re: [lammps-users] Unable to find reax parameter Steve Plimpton
14:13 Re: [lammps-users] Question about quaternion calculation Steve Plimpton
10:45 Re: [lammps-users] Pair_style question Visal Kavinda
10:41 Re: [lammps-users] cannot build the example/COUPLE/simple Axel Kohlmeyer
10:39 Re: [lammps-users] Pair_style question Axel Kohlmeyer
10:37 Re: [lammps-users] cannot build the example/COUPLE/simple BO ZHANG
10:08 Re: [lammps-users] Pair_style question Visal Kavinda
09:51 Re: [lammps-users] Pair_style question Axel Kohlmeyer
09:36 Re: [lammps-users] Computing solute-solvent interaction Axel Kohlmeyer
09:32 [lammps-users] Computing solute-solvent interaction Shrabanti Bhattacharya
09:32 Re: [lammps-users] fix print at beginning of run MD Simulation
09:31 Re: [lammps-users] fix print at beginning of run Axel Kohlmeyer
09:25 Re: [lammps-users] fix print at beginning of run MD Simulation
09:23 Re: [lammps-users] fix print at beginning of run Axel Kohlmeyer
09:16 [lammps-users] fix print at beginning of run MD Simulation
08:48 [lammps-users] Pair_style question Visal Kavinda
07:50 [lammps-users] Uniaxial tension Ankit Roy
04:28 [lammps-users] Query about NEMD temperature profile Mayank Gupta

July 23, 2020
21:54 Re: [lammps-users] cannot build the example/COUPLE/simple Axel Kohlmeyer
20:33 [lammps-users] cannot build the example/COUPLE/simple BO ZHANG
12:23 [lammps-users] Unable to find reax parameter Jones, Keith
09:47 Re: [lammps-users] Question about quaternion calculation Andrew Jewett
09:46 Re: [lammps-users] Core-Shell model Axel Kohlmeyer
09:40 [lammps-users] Question about quaternion calculation Tuhin Samanta
08:18 Re: [lammps-users] Is that feasible to divide a simulation into two stages and each one uses a different potential? Wenqiang Liu
08:04 Re: [lammps-users] Is that feasible to divide a simulation into two stages and each one uses a different potential? Wenqiang Liu
07:02 [lammps-users] Core-Shell model Aris Dimou
05:48 Re: [lammps-users] prd vs tad vs temper Axel Kohlmeyer
03:30 [lammps-users] prd vs tad vs temper MD Simulation
02:29 Re: [lammps-users] meam/c and tersoff 陳弘儒
00:06 Re: [lammps-users] Is that feasible to divide a simulation into two stages and each one uses a different potential? Axel Kohlmeyer

July 22, 2020
22:44 Re: [lammps-users] Is that feasible to divide a simulation into two stages and each one uses a different potential? Andrew Jewett
22:26 Re: [lammps-users] Compute orientorder/atom command prints some weird values Debdas Dhabal
22:18 Re: [lammps-users] Compute orientorder/atom command prints some weird values Axel Kohlmeyer
22:13 Re: [lammps-users] Compute orientorder/atom command prints some weird values Debdas Dhabal
21:15 Re: [lammps-users] Can LAMMPS auto-generate alloy interactions from multiple MEAM files? Axel Kohlmeyer
21:01 Re: [lammps-users] Compute orientorder/atom command prints some weird values Axel Kohlmeyer
20:41 [lammps-users] Is that feasible to divide a simulation into two stages and each one uses a different potential? Wenqiang Liu
19:00 [lammps-users] Compute orientorder/atom command prints some weird values Debdas Dhabal
18:15 [lammps-users] Can LAMMPS auto-generate alloy interactions from multiple MEAM files? Darius Morgan Clinton
17:05 Re: [lammps-users] Stress Calculation for 2D peridynamics model Steve Plimpton
11:45 Re: [lammps-users] Computing strain energy of crosslinked polymer networks Axel Kohlmeyer
11:38 Re: [lammps-users] Stuck before fix npt start 李吉辰
11:32 [lammps-users] NIST Workshop on Atomistic Simulations for Industrial Needs (Virtual) Hale, Lucas M. (Fed)
10:42 Re: [lammps-users] Stuck before fix npt start Axel Kohlmeyer
09:56 Re: [lammps-users] Inquiry about the Interface modeling in Lammps Axel Kohlmeyer
09:37 [lammps-users] Stuck before fix npt start 李吉辰
09:33 [lammps-users] Inquiry about the Interface modeling in Lammps ali.barooni
08:51 [lammps-users] Computing strain energy of crosslinked polymer networks Adam, Brian
07:15 Re: [lammps-users] meam/c and tersoff Axel Kohlmeyer
07:01 [lammps-users] meam/c and tersoff 陳弘儒
02:15 [lammps-users] R: Stress Calculation for 2D peridynamics model DXS928@...6699...

July 21, 2020
21:58 Re: [lammps-users] PBC problem with atoms coordinates Irina Tuszynska
18:33 Re: [lammps-users] generating a perfect edge dislocation Diaz,Adrian
17:57 Re: [lammps-users] generating a perfect edge dislocation Ankit Roy
16:18 Re: [lammps-users] How to keep a certain molecule types in specific region? Atefeh Tarokh
15:21 [lammps-users] How to keep a certain molecule types in specific region? Atefeh Tarokh
15:09 [lammps-users] How to keep a certain molecule types in specific region? Atefeh Tarokh
13:25 Re: [lammps-users] Implementing OPLS improper for alcene molecules Andrew Jewett
11:01 Re: [lammps-users] TIP4P not running in parallel computing for ice box with a vacuum region Axel Kohlmeyer
09:51 Re: [lammps-users] Temperature increasing when unixial strain Steve Plimpton
09:49 Re: [lammps-users] Implementing OPLS improper for alcene molecules Steve Plimpton
09:48 Re: [lammps-users] TIP4P not running in parallel computing for ice box with a vacuum region Qiangqiang Sun
09:47 Re: [lammps-users] Question about tersoff pair_coeff Steve Plimpton
09:46 Re: [lammps-users] Stress Calculation for 2D peridynamics model Steve Plimpton
09:25 [lammps-users] Problem depositing Germanium atoms with Tersoff's potential: Scattering and lost of atoms luis martin encinar
09:20 [lammps-users] Problem depositing Germanium atoms with Tersoff's potential: Scattering and lost of atoms LUIS MARTIN ENCINAR
07:35 Re: [lammps-users] TIP4P not running in parallel computing for ice box with a vacuum region Axel Kohlmeyer
06:44 [lammps-users] TIP4P not running in parallel computing for ice box with a vacuum region Qiangqiang Sun
06:05 [lammps-users] Temperature increasing in NPT thermpostat ??????
05:53 [lammps-users] Temperature increasing when unixial strain ??????
05:50 [lammps-users] Temperature increasing when unixial strain ??????
04:45 [lammps-users] Implementing OPLS improper for alcene molecules Ludovic Jami
04:29 [lammps-users] 回复: about RDF and density ZHANG zhang
03:25 Re: [lammps-users] Question about tersoff pair_coeff Alexander Petkov

July 20, 2020
18:48 Re: [lammps-users] Problems using hybrid potential for GAFF and reaxFF Axel Kohlmeyer
17:00 Re: [lammps-users] Problems using hybrid potential for GAFF and reaxFF Hongxia Hao
13:15 Re: [lammps-users] Problems using hybrid potential for GAFF and reaxFF Axel Kohlmeyer
12:29 [lammps-users] Problems using hybrid potential for GAFF and reaxFF Hongxia Hao
10:33 [lammps-users] Stress Calculation for 2D peridynamics model DXS928@...6699...
09:34 Re: [lammps-users] Measuring specific forces during Brownian dynamics simulation Axel Kohlmeyer
09:02 Re: [lammps-users] Measuring specific forces during Brownian dynamics simulation Adam, Brian
08:21 Re: [lammps-users] Question about tersoff pair_coeff Steve Plimpton
08:18 Re: [lammps-users] Question about tersoff pair_coeff Axel Kohlmeyer
08:17 Re: [lammps-users] Measuring specific forces during Brownian dynamics simulation Steve Plimpton
08:12 Re: [lammps-users] generating a perfect edge dislocation Steve Plimpton
05:52 Re: [lammps-users] Questions about KSPACE Axel Kohlmeyer
05:42 Re: [lammps-users] hybrid/overlay potential with GPU Axel Kohlmeyer
05:20 Re: [lammps-users] hybrid/overlay potential with GPU Peter Parker
05:19 [lammps-users] Question about tersoff pair_coeff Alexander Petkov
05:00 [lammps-users] Questions about KSPACE Alexander Petkov
04:54 Re: [lammps-users] about RDF and density Axel Kohlmeyer
04:26 Re: [lammps-users] ERROR: Bonds defined but no bond types Axel Kohlmeyer
00:51 Re: [lammps-users] ERROR: Bonds defined but no bond types shuting wang

July 19, 2020
23:19 [lammps-users] 回复: about RDF and density ZHANG zhang
15:50 [lammps-users] generating a perfect edge dislocation Ankit Roy
12:57 Re: [lammps-users] ERROR: Bonds defined but no bond types Axel Kohlmeyer
11:46 [lammps-users] ERROR: Bonds defined but no bond types shuting wang
00:00 Re: [lammps-users] about RDF and density Axel Kohlmeyer

July 18, 2020
23:38 [lammps-users] 回复: about RDF and density ZHANG zhang
22:43 Re: [lammps-users] Difference in computed quantities evaluated from flux file Axel Kohlmeyer
22:34 Re: [lammps-users] about RDF and density Axel Kohlmeyer
22:26 [lammps-users] about RDF and density ZHANG zhang
22:18 [lammps-users] Difference in computed quantities evaluated from flux file Mayank Gupta
19:00 Re: [lammps-users] Creating grain boundaries in Lammps for ZnO wurtzite Axel Kohlmeyer
18:00 Re: [lammps-users] Creating grain boundaries in Lammps for ZnO wurtzite Gustavo M. Fortes
14:51 Re: [lammps-users] Problems about combining fix bond/react and fix gcmc Jacob Gissinger
09:51 Re: [lammps-users] Creating grain boundaries in Lammps for ZnO wurtzite Axel Kohlmeyer
09:38 Re: [lammps-users] Problem compiling LAMMPS with Intel compilers on macOS Catalina Axel Kohlmeyer
09:25 Re: [lammps-users] A question about OPLSAA+TIP4P Axel Kohlmeyer
07:07 [lammps-users] A question about OPLSAA+TIP4P 李吉辰
04:31 Re: [lammps-users] Measuring specific forces during Brownian dynamics simulation Steve Plimpton
04:21 Re: [lammps-users] Creating Atoms Steve Plimpton

July 17, 2020
23:10 Re: [lammps-users] Problem compiling LAMMPS with Intel compilers on macOS Catalina Calvin Anderson
23:09 Re: [lammps-users] Problem compiling LAMMPS with Intel compilers on macOS Catalina Calvin Anderson
19:26 Re: [lammps-users] Problem compiling LAMMPS with Intel compilers on macOS Catalina Axel Kohlmeyer
19:10 [lammps-users] Creating grain boundaries in Lammps for ZnO wurtzite Gustavo M. Fortes
18:52 [lammps-users] Problem compiling LAMMPS with Intel compilers on macOS Catalina Calvin Anderson
15:44 [lammps-users] Measuring specific forces during Brownian dynamics simulation Adam, Brian
12:09 Re: [lammps-users] High potential energy in modeling graphene sheets Axel Kohlmeyer
11:32 Re: [lammps-users] High potential energy in modeling graphene sheets Atefeh Tarokh
11:25 Re: [lammps-users] High potential energy in modeling graphene sheets Axel Kohlmeyer
11:21 [lammps-users] High potential energy in modeling graphene sheets Atefeh Tarokh
09:43 Re: [lammps-users] Generate a LAMMPS data file with bonds, angles, and dihedrals crossing the unit cell borders Giacomo Fiorin
09:28 Re: [lammps-users] Generate a LAMMPS data file with bonds, angles, and dihedrals crossing the unit cell borders Axel Kohlmeyer
09:20 Re: [lammps-users] moving wall acting like as pistone, Move all the particles of moving wall equally Axel Kohlmeyer
07:02 Re: [lammps-users] hybrid/overlay potential with GPU Axel Kohlmeyer
05:29 [lammps-users] Generate a LAMMPS data file with bonds, angles, and dihedrals crossing the unit cell borders Torstein Fjermestad
03:55 [lammps-users] moving wall acting like as pistone, Move all the particles of moving wall equally Milad Aryanpour
03:40 Re: [lammps-users] hybrid/overlay potential with GPU Peter Parker
02:45 [lammps-users] Creating Atoms Reza Namakian

July 16, 2020
17:08 Re: [lammps-users] Compute msd of one type of element Axel Kohlmeyer
17:06 Re: [lammps-users] Compute msd of one type of element Zizhen Zhou
17:02 Re: [lammps-users] Compute msd of one type of element Axel Kohlmeyer
16:59 Re: [lammps-users] Compute msd of one type of element Zizhen Zhou
16:43 Re: [lammps-users] Compute msd of one type of element Axel Kohlmeyer
16:38 [lammps-users] Compute msd of one type of element Zizhen Zhou
13:56 Re: [lammps-users] Fix Rigid Superdiffusive Behavior Axel Kohlmeyer
13:26 [lammps-users] Fix Rigid Superdiffusive Behavior Piskulich, Ezekiel Ashe
12:37 Re: [lammps-users] Anisotropic pairwise potential Axel Kohlmeyer
12:31 Re: [lammps-users] Anisotropic pairwise potential Axel Kohlmeyer
12:24 [lammps-users] Anisotropic pairwise potential Łukasz baran
09:48 Re: [lammps-users] I need a pdb file of a sheet of graphene with a least one hydrojen atom as functionalizer hamed afzali
09:47 Re: [lammps-users] I need a pdb file of a sheet of graphene with a least one hydrojen atom as functionalizer Axel Kohlmeyer
09:35 Re: [lammps-users] hybrid/overlay potential with GPU Axel Kohlmeyer
09:10 [lammps-users] I need a pdb file of a sheet of graphene with a least one hydrojen atom as functionalizer hamed afzali
06:02 [lammps-users] LAMMPS.ir Lammps.ir Group
05:57 [lammps-users] PhD position job offer Sebastien Groh
05:16 [lammps-users] hybrid/overlay potential with GPU Peter Parker

July 15, 2020
12:04 Re: [lammps-users] [EXTERNAL] Re: compute orientorder/atom Syed Shuja Zaidi (P19PH007)
11:54 Re: [lammps-users] [EXTERNAL] Re: compute orientorder/atom Thompson, Aidan
10:13 Re: [lammps-users] PBC problem with atoms coordinates Axel Kohlmeyer
09:45 Re: [lammps-users] How to heat up or cool down a region from 300 K to a different value with a temperature gradient Steve Plimpton
09:45 Re: [lammps-users] 回复: The memory allocation problem Syed Shuja Zaidi (P19PH007)
09:23 [lammps-users] PBC problem with atoms coordinates Irina Tuszynska
09:20 Re: [lammps-users] problem about the example of DPD in examples/USER/dpd/dpdrx-shardlow Axel Kohlmeyer
09:19 Re: [lammps-users] 回复: The memory allocation problem Axel Kohlmeyer
08:22 [lammps-users] problem about the example of DPD in examples/USER/dpd/dpdrx-shardlow llv
08:09 [lammps-users] ?????? The memory allocation problem ??????
06:49 Re: [lammps-users] lost atoms in lammps Axel Kohlmeyer
06:13 Re: [lammps-users] lost atoms in lammps isra muscati
06:00 Re: [lammps-users] lost atoms in lammps Axel Kohlmeyer
04:25 Re: [lammps-users] compute orientorder/atom Fu Xueqiong
04:18 Re: [lammps-users] compute orientorder/atom Syed Shuja Zaidi (P19PH007)
03:52 Re: [lammps-users] lost atoms in lammps isra muscati
02:06 [lammps-users] compute orientorder/atom Fu Xueqiong

July 14, 2020
22:14 Re: [lammps-users] The memory allocation problem Axel Kohlmeyer
21:36 Re: [lammps-users] How to heat up or cool down a region from 300 K to a different value with a temperature gradient JWG
21:33 [lammps-users] The memory allocation problem ??????
21:21 Re: [lammps-users] How to heat up or cool down a region from 300 K to a different value with a temperature gradient Axel Kohlmeyer
20:52 [lammps-users] How to heat up or cool down a region from 300 K to a different value with a temperature gradient JWG
20:46 Re: [lammps-users] Temperature of ellipsoidal fluid growing in NVE ensemble despite significant NVT equilibration Axel Kohlmeyer
19:30 [lammps-users] Temperature of ellipsoidal fluid growing in NVE ensemble despite significant NVT equilibration Shuyuan Wang
16:46 Re: [lammps-users] Fix-rigid different group of grains Axel Kohlmeyer
15:00 [lammps-users] Fix-rigid different group of grains Giuseppe Petrillo
10:52 [lammps-users] Postdoctoral opening @ New Mexico Tech - DFT and Atomistic Modelling of alloy solidification Deep Choudhuri
09:16 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Moore, Stan
07:47 Re: [lammps-users] error of airebo Axel Kohlmeyer
07:46 Re: [lammps-users] cluster/atom sanchari bhatt
07:45 Re: [lammps-users] cluster/atom Axel Kohlmeyer
07:35 Re: [lammps-users] error of airebo 15584345983
07:31 Re: [lammps-users] error of airebo Axel Kohlmeyer
07:20 Re: [lammps-users] error of airebo 15584345983
06:55 Re: [lammps-users] cluster/atom Axel Kohlmeyer
06:50 Re: [lammps-users] cluster/atom sanchari bhatt
06:30 Re: [lammps-users] cluster/atom Axel Kohlmeyer
06:25 [lammps-users] cluster/atom sanchari bhatt
06:22 Re: [lammps-users] error of airebo Axel Kohlmeyer
05:53 [lammps-users] error of airebo 15584345983
05:20 Re: [lammps-users] quiry regarding cluster/atom Axel Kohlmeyer
05:01 Re: [lammps-users] lost atoms in lammps Axel Kohlmeyer
04:44 [lammps-users] lost atoms in lammps isra muscati
04:09 [lammps-users] quiry regarding cluster/atom sanchari bhatt

July 13, 2020
18:35 Re: [lammps-users] compute coord/atom group Question Axel Kohlmeyer
18:28 Re: [lammps-users] compute coord/atom group Question Syed Shuja Zaidi (P19PH007)
18:27 Re: [lammps-users] compute coord/atom group Question Syed Shuja Zaidi (P19PH007)
18:18 Re: [lammps-users] Simulating a Solid-Liquid interface with read_data William Green
17:44 Re: [lammps-users] compute coord/atom group Question Axel Kohlmeyer
17:40 [lammps-users] compute coord/atom group Question Christian Kelley
16:03 Re: [lammps-users] Simulating a Solid-Liquid interface with read_data Axel Kohlmeyer
15:17 Re: [lammps-users] Simulating a Solid-Liquid interface with read_data William Green
13:00 Re: [lammps-users] Help needed displaying correct atom locations Axel Kohlmeyer
12:46 Re: [lammps-users] calculation of total interaction energy between two group of atoms with respect to distance Axel Kohlmeyer
12:12 [lammps-users] Help needed displaying correct atom locations Sanchari Sen
11:43 Re: [lammps-users] calculation of total interaction energy between two group of atoms with respect to distance shamimul ahsan
10:56 Re: [lammps-users] calculation of total interaction energy between two group of atoms with respect to distance Axel Kohlmeyer
10:01 [lammps-users] calculation of total interaction energy between two group of atoms with respect to distance shamimul ahsan
09:52 [lammps-users] Postdoctoral opening @ New Mexico Tech - DFT and Atomistic Modelling of alloy solidification Deep Choudhuri
09:49 [lammps-users] Postdoctoral opening @ New Mexico Tech - DFT and Atomistic Modelling of alloy solidification Deep Choudhuri
09:10 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Moore, Stan
08:42 Re: [lammps-users] [EXTERNAL] Compiler error for kokkos_omp Moore, Stan
07:47 Re: [lammps-users] phonon calculation with fix phonon command Axel Kohlmeyer
06:34 [lammps-users] phonon calculation with fix phonon command majid johari
06:32 Re: [lammps-users] Simulating a Solid-Liquid interface with read_data Axel Kohlmeyer
06:16 Re: [lammps-users] Simulating a Solid-Liquid interface with read_data William Green
05:33 Re: [lammps-users] Simulating a Solid-Liquid interface with read_data Axel Kohlmeyer
04:24 [lammps-users] Simulating a Solid-Liquid interface with read_data William Green

July 12, 2020
14:05 Re: [lammps-users] Lammps for 2D simulation Steve Plimpton
14:01 Re: [lammps-users] Output atoms' neighbors by a user-assigned cutoff Steve Plimpton
04:03 Re: [lammps-users] Is it possible to isolate the Pauli Repulsion and London Dispersion terms in the simple Lennard Jones potential? Axel Kohlmeyer
03:50 Re: [lammps-users] point dipoles connected by bonds Axel Kohlmeyer
03:40 Re: [lammps-users] point dipoles connected by bonds Łukasz baran
03:22 Re: [lammps-users] point dipoles connected by bonds Axel Kohlmeyer
03:10 [lammps-users] point dipoles connected by bonds Łukasz baran

July 11, 2020
19:56 [lammps-users] Is it possible to isolate the Pauli Repulsion and London Dispersion terms in the simple Lennard Jones potential? ericabird
17:54 Re: [lammps-users] Lammps for 2D simulation JWG
17:01 Re: [lammps-users] lj/cut Giving Bond Atoms Missing at Proc 0 Error in A Polymer Model Christian Kelley
14:42 Re: [lammps-users] Lammps for 2D simulation Axel Kohlmeyer
14:30 Re: [lammps-users] lj/cut Giving Bond Atoms Missing at Proc 0 Error in A Polymer Model Axel Kohlmeyer
13:04 [lammps-users] lj/cut Giving Bond Atoms Missing at Proc 0 Error in A Polymer Model Christian Kelley
02:55 [lammps-users] Lammps for 2D simulation JWG

July 10, 2020
20:09 Re: [lammps-users] lammps external files Axel Kohlmeyer
20:01 Re: [lammps-users] lammps external files Axel Kohlmeyer
19:43 Re: [lammps-users] lammps external files Gardner, Karl
19:26 Re: [lammps-users] Output atoms' neighbors by a user-assigned cutoff Axel Kohlmeyer
19:21 Re: [lammps-users] lammps external files Axel Kohlmeyer
19:12 Re: [lammps-users] Output atoms' neighbors by a user-assigned cutoff Axel Kohlmeyer
19:08 Re: [lammps-users] lammps external files Gardner, Karl
18:58 Re: [lammps-users] About the Elastic Constants estimation script Axel Kohlmeyer
18:52 Re: [lammps-users] lammps external files Axel Kohlmeyer
18:29 [lammps-users] lammps external files Gardner, Karl
16:57 [lammps-users] About the Elastic Constants estimation script Khaled Mohamed
16:12 [lammps-users] Output atoms' neighbors by a user-assigned cutoff xuke
15:20 Re: [lammps-users] dump xyz file with energy and forces Syed Shuja Zaidi (P19PH007)
15:15 Re: [lammps-users] dump xyz file with energy and forces Axel Kohlmeyer
15:02 Re: [lammps-users] dump xyz file with energy and forces Axel Kohlmeyer
14:50 [lammps-users] dump xyz file with energy and forces Mayank
13:38 Re: [lammps-users] dump command Steve Plimpton
10:02 Re: [lammps-users] nothing is printed in the dump file. Axel Kohlmeyer
09:49 Re: [lammps-users] [Ext] AMBER force field dihedral in LAMMPS Axel Kohlmeyer
09:29 Re: [lammps-users] [Ext] AMBER force field dihedral in LAMMPS Xiaoyu Wang
09:07 Re: [lammps-users] [Ext] AMBER force field dihedral in LAMMPS Axel Kohlmeyer
09:02 Re: [lammps-users] [Ext] AMBER force field dihedral in LAMMPS Xiaoyu Wang
05:53 Re: [lammps-users] angle distribution function (adf) Axel Kohlmeyer
05:36 Re: [lammps-users] angle distribution function (adf) CHABBA Hanae
05:12 Re: [lammps-users] angle distribution function (adf) Axel Kohlmeyer
05:02 Re: [lammps-users] nothing is printed in the dump file. Axel Kohlmeyer
05:01 [lammps-users] angle distribution function (adf) CHABBA Hanae
04:58 Re: [lammps-users] reset_ids segfaulting Axel Kohlmeyer
04:19 [lammps-users] reset_ids segfaulting Verestek, Wolfgang
00:36 [lammps-users] nothing is printed in the dump file. Devargya Chakraborty

July 09, 2020
18:42 Re: [lammps-users] AMBER force field dihedral in LAMMPS Axel Kohlmeyer
18:41 Re: [lammps-users] Simulation halts at low temperature in NPT William Green
18:02 [lammps-users] AMBER force field dihedral in LAMMPS Xiaoyu Wang
15:16 Re: [lammps-users] Overlap check in energy_full() in fix_gcmc Axel Kohlmeyer
15:01 Re: [lammps-users] Overlap check in energy_full() in fix_gcmc Vrindaa Somjit
12:49 Re: [lammps-users] Reading material on potential energy isra muscati
12:18 Re: [lammps-users] fix ave/atom issues: deciphering "dump custom and fix not at compatible times" Axel Kohlmeyer
12:14 Re: [lammps-users] Reading material on potential energy Chowdhury, Sanjib
11:55 Re: [lammps-users] fix ave/atom issues: deciphering "dump custom and fix not at compatible times" Syamal Praneeth Chilakalapudi
11:38 [lammps-users] Reading material on potential energy isra muscati
10:30 [lammps-users] SW potential file for CdS Dr. SUNIL KUMAR
10:16 Re: [lammps-users] Overlap check in energy_full() in fix_gcmc Axel Kohlmeyer
10:12 Re: [lammps-users] fix ave/atom issues: deciphering "dump custom and fix not at compatible times" Axel Kohlmeyer
09:03 [lammps-users] Overlap check in energy_full() in fix_gcmc Vrindaa Somjit
08:47 [lammps-users] fix ave/atom issues: deciphering "dump custom and fix not at compatible times" Syamal Praneeth Chilakalapudi
07:38 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Axel Kohlmeyer
04:59 Re: [lammps-users] Compiler error for kokkos_omp Axel Kohlmeyer
02:36 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Grégoire Defoort

July 08, 2020
23:45 [lammps-users] Compiler error for kokkos_omp Kevin Zhang
21:52 Re: [lammps-users] Internal compiler error for kokkos_omp Axel Kohlmeyer
21:32 [lammps-users] Internal compiler error for kokkos_omp Kevin Zhang
16:11 Re: [lammps-users] Simulation halts at low temperature in NPT William Green
15:25 Re: [lammps-users] Is there a clean way to combine two simulations' atoms in a third simulation? Antoine Rincent
15:16 Re: [lammps-users] Is there a clean way to combine two simulations' atoms in a third simulation? Axel Kohlmeyer
15:00 Re: [lammps-users] Is there a clean way to combine two simulations' atoms in a third simulation? Piskulich, Ezekiel Ashe
14:47 [lammps-users] Is there a clean way to combine two simulations' atoms in a third simulation? Antoine Rincent
08:23 Re: [lammps-users] Simulation halts at low temperature in NPT Sebastian Hütter
07:48 [lammps-users] dump command Toon Tavas
07:06 Re: [lammps-users] Stress per atom due to wall Syed Shuja Zaidi (P19PH007)
06:19 Re: [lammps-users] Stress per atom due to wall Axel Kohlmeyer
06:04 Re: [lammps-users] Stress per atom due to wall Jagroop Kaur
05:56 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Axel Kohlmeyer
05:32 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Grégoire Defoort
05:16 Re: [lammps-users] Stress per atom due to wall Axel Kohlmeyer
05:08 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Axel Kohlmeyer
02:21 [lammps-users] Stress per atom due to wall Jagroop Kaur

July 07, 2020
21:40 Re: [lammps-users] Issue with bond atoms missing at proc 0 at step Axel Kohlmeyer
20:43 Re: [lammps-users] fene command resulting in a lot of printing Christian Kelley
20:35 Re: [lammps-users] fene command resulting in a lot of printing Axel Kohlmeyer
20:22 [lammps-users] Issue with bond atoms missing at proc 0 at step Christian Kelley
20:11 [lammps-users] fene command resulting in a lot of printing Christian Kelley
16:02 Re: [lammps-users] Simulation halts at low temperature in NPT Axel Kohlmeyer
15:37 Re: [lammps-users] Simulation halts at low temperature in NPT William Green
15:36 Re: [lammps-users] [EXTERNAL] Re: GPU Package Issues Moore, Stan
15:35 Re: [lammps-users] [EXTERNAL] Re: GPU Package Issues Moore, Stan
15:30 Re: [lammps-users] [EXTERNAL] Re: Segmentation fault while using KOKKOS Moore, Stan
10:07 Re: [lammps-users] GPU Package Issues Axel Kohlmeyer
09:18 [lammps-users] GPU Package Issues Adam, Brian
08:07 Re: [lammps-users] Bugs in Coul/soft/long potential? Axel Kohlmeyer
07:28 [lammps-users] Bugs in Coul/soft/long potential? Yang Hong
05:40 [lammps-users] Code of nanotube Usef Jafaraghaei
02:20 Re: [lammps-users] respa Victor Nazarychev

July 06, 2020
20:32 [lammps-users] 回复: evdwl ecoul ZHANG zhang
19:47 [lammps-users] ?????? Temperature fall to zero in gcmc ??????
11:41 Re: [lammps-users] evdwl ecoul Axel Kohlmeyer
10:50 [lammps-users] evdwl ecoul ZHANG zhang
10:14 Re: [lammps-users] Simulation halts at low temperature in NPT Axel Kohlmeyer
09:51 [lammps-users] Simulation halts at low temperature in NPT William Green
07:44 Re: [lammps-users] Segmentation fault while using KOKKOS Axel Kohlmeyer
07:32 Re: [lammps-users] Orient Command and Establishment of Periodic Structure Axel Kohlmeyer
07:32 [lammps-users] Segmentation fault while using KOKKOS Grégoire Defoort
05:25 Re: [lammps-users] fix rigid for C-C bond Axel Kohlmeyer
05:07 Re: [lammps-users] fix rigid for C-C bond Tatyana Kuznetsova
04:44 [lammps-users] Orient Command and Establishment of Periodic Structure 李力

July 05, 2020
22:40 Re: [lammps-users] Region Asadollahzadeh
22:40 Re: [lammps-users] Filling a box full of voids Asadollahzadeh
21:38 Re: [lammps-users] Filling a box full of voids Steve Plimpton
21:33 Re: [lammps-users] Region Steve Plimpton
21:01 Re: [lammps-users] Interfacial thermal resistance Ankit Chauhan
20:53 Re: [lammps-users] Interfacial thermal resistance Axel Kohlmeyer
20:44 Re: [lammps-users] Interfacial thermal resistance Ankit Chauhan
20:33 Re: [lammps-users] MSST related doubts Axel Kohlmeyer
19:24 [lammps-users] MSST related doubts ????
17:48 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? Andrew Jewett
16:07 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? Axel Kohlmeyer
16:02 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? sandipan c
14:42 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? Axel Kohlmeyer
13:06 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? Axel Kohlmeyer
12:58 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? sandipan c
11:02 [lammps-users] Filling a box full of voids Asadollahzadeh
10:22 Re: [lammps-users] respa Axel Kohlmeyer
09:52 Re: [lammps-users] How to prevent the shape of ellipsoids from changing? Axel Kohlmeyer
09:39 Re: [lammps-users] Hyper local Jehiel Nteme
08:27 [lammps-users] How to prevent the shape of ellipsoids from changing? sandipan c
07:03 Re: [lammps-users] respa Victor Nazarychev
06:36 Re: [lammps-users] respa Axel Kohlmeyer
06:06 Re: [lammps-users] Interfacial thermal resistance Axel Kohlmeyer
06:03 Re: [lammps-users] Interfacial thermal resistance Ankit Chauhan
04:49 [lammps-users] respa Victor Nazarychev
04:25 Re: [lammps-users] Interfacial thermal resistance Axel Kohlmeyer
02:20 [lammps-users] Interfacial thermal resistance Ankit Chauhan
00:44 [lammps-users] Region Asadollahzadeh

July 04, 2020
21:34 Re: [lammps-users] soft potential Axel Kohlmeyer
21:31 [lammps-users] soft potential 吴敏波
17:49 Re: [lammps-users] Hyper local Steve Plimpton
12:02 Re: [lammps-users] gyration/shape/chunk returns nan Vanessa Oklejas
09:27 Re: [lammps-users] I want to replace a new kind of atoms Asadollahzadeh
09:06 Re: [lammps-users] I want to replace a new kind of atoms Chamara Somarathna
08:46 [lammps-users] I want to replace a new kind of atoms Asadollahzadeh
06:34 Re: [lammps-users] Hyper local Axel Kohlmeyer
05:08 Re: [lammps-users] EHEX Victor Nazarychev
04:59 Re: [lammps-users] fix rigid for C-C bond Victor Nazarychev
04:16 [lammps-users] Hyper local Jehiel Nteme
03:58 Re: [lammps-users] proper usage of hybrid usage for reaxFF and GAFF force field Axel Kohlmeyer
03:13 Re: [lammps-users] fix rigid for C-C bond Axel Kohlmeyer
03:01 [lammps-users] fix rigid for C-C bond Victor Nazarychev
01:22 Re: [lammps-users] Segmentation Fault on FEP example Axel Kohlmeyer
00:11 [lammps-users] Regarding the stacking fault energy M. MAHESHWARI

July 03, 2020
23:42 Re: [lammps-users] Segmentation Fault on FEP example faribafardisi
23:38 [lammps-users] Replace the liquid phase by a crystalline phase Asadollahzadeh
22:47 Re: [lammps-users] Different temperature for a box of alloys Asadollahzadeh
22:39 Re: [lammps-users] proper usage of hybrid usage for reaxFF and GAFF force field Hongxia Hao
22:10 Re: [lammps-users] angle angle coeff unit omid gh
20:15 Re: [lammps-users] pressure variation with and without restart Steve Plimpton
20:13 Re: [lammps-users] gyration/shape/chunk returns nan Axel Kohlmeyer
19:04 Re: [lammps-users] proper usage of hybrid usage for reaxFF and GAFF force field Axel Kohlmeyer
18:56 [lammps-users] proper usage of hybrid usage for reaxFF and GAFF force field Hongxia Hao
18:22 Re: [lammps-users] units in centro/atom command Steve Plimpton
18:11 Re: [lammps-users] compute inner pressure and elastic membrane force Steve Plimpton
18:09 Re: [lammps-users] controlling incidence angle in fix deposit and tracking sputter angles Steve Plimpton
18:05 Re: [lammps-users] Meaning of k-space vectors in ewald summation? Steve Plimpton
18:01 Re: [lammps-users] Adding Velocities From Python via fix python/invoke Steve Plimpton
17:05 Re: [lammps-users] Charmm Steve Plimpton
17:03 Re: [lammps-users] Granular ensembles Steve Plimpton
16:35 Re: [lammps-users] angle angle coeff unit Steve Plimpton
13:54 Re: [lammps-users] coul/cut and coul/long gives the same force/energy for like charge and opposite charge interactions William Green
11:59 Re: [lammps-users] coul/cut and coul/long gives the same force/energy for like charge and opposite charge interactions Axel Kohlmeyer
11:56 Re: [lammps-users] NaNs in dump; Langevin GJF flags compatible with finite-sized angular momentum thermostatting options? Steve Plimpton
11:37 Re: [lammps-users] Different temperature for a box of alloys Steve Plimpton
11:32 Re: [lammps-users] Compute global kinetic energy components Steve Plimpton
11:27 [lammps-users] coul/cut and coul/long gives the same force/energy for like charge and opposite charge interactions William Green
11:24 Re: [lammps-users] Heat flux calculation for a multi component system Steve Plimpton
10:28 [lammps-users] gyration/shape/chunk returns nan Vanessa Oklejas
09:46 Re: [lammps-users] Book or review paper on structural analysis Lingnan Lin
09:44 Re: [lammps-users] Segmentation Fault on FEP example Axel Kohlmeyer
09:33 Re: [lammps-users] Book or review paper on structural analysis Axel Kohlmeyer
09:27 [lammps-users] Book or review paper on structural analysis Lingnan Lin
09:01 [lammps-users] Segmentation Fault on FEP example faribafardisi
08:34 Re: [lammps-users] compute entropy/atom Steve Plimpton
08:32 Re: [lammps-users] Question about compute global/atom Steve Plimpton
08:27 Re: [lammps-users] Are the first assigned pair_style and pair_coeff totally overwritten by the second assigned ones in the same input script? Steve Plimpton
08:25 Re: [lammps-users] RDF_caculation for specific atom Steve Plimpton
08:14 Re: [lammps-users] Error while undergoing uni-axial tensile deformation of a network of chains Steve Plimpton
08:00 Re: [lammps-users] write restart or write data file Steve Plimpton
07:55 Re: [lammps-users] slope(f_msd) in DIFFUSE Steve Plimpton
07:41 Re: [lammps-users] [EXTERNAL] Regarding pair_style hybrid and KOKKOS Grégoire Defoort
07:32 Re: [lammps-users] no file generating while running rerun simulation Axel Kohlmeyer
07:27 Re: [lammps-users] don't update dipoles in a rigid body Axel Kohlmeyer
07:24 Re: [lammps-users] ERROR: Illegal pair_style command (src/MANYBODY/pair_eam.cpp:361) Axel Kohlmeyer
07:10 Re: [lammps-users] [EXTERNAL] Regarding pair_style hybrid and KOKKOS Axel Kohlmeyer
06:59 [lammps-users] ERROR: Illegal pair_style command (src/MANYBODY/pair_eam.cpp:361) chandra shekhar maurya
00:51 Re: [lammps-users] [EXTERNAL] Regarding pair_style hybrid and KOKKOS Grégoire Defoort

July 02, 2020
23:52 [lammps-users] don't update dipoles in a rigid body Yanggang
23:49 [lammps-users] no file generating while running rerun simulation Devargya Chakraborty
15:30 Re: [lammps-users] EHEX Diaz,Adrian
15:27 Re: [lammps-users] [EXTERNAL] Calculation of Chemical Potential for alloys in Lammps Thompson, Aidan
15:21 Re: [lammps-users] MSD decreased Steve Plimpton
15:19 Re: [lammps-users] Granular system with temperature Steve Plimpton
15:16 Re: [lammps-users] Prescribing temperature profile in a system using langevin thermostat Steve Plimpton
15:09 Re: [lammps-users] Temperature fall to zero in gcmc Steve Plimpton
15:08 Re: [lammps-users] EHEX Steve Plimpton
14:59 Re: [lammps-users] Overdamped Langevin (Brownian) dynamics with rigid bodies Steve Plimpton
14:53 Re: [lammps-users] no reading potential file and skip from Steve Plimpton
14:49 Re: [lammps-users] slope(f_msd) in DIFFUSE Axel Kohlmeyer
14:40 Re: [lammps-users] Potential map Steve Plimpton
14:37 Re: [lammps-users] about fix temp/partial Steve Plimpton
14:30 Re: [lammps-users] slope(f_msd) in DIFFUSE Steve Plimpton
14:13 Re: [lammps-users] Mixing Special Bond Types Axel Kohlmeyer
14:11 Re: [lammps-users] [EXTERNAL] Re: Kokkos Lammps on GPU machine - negative scaling from 1 to 2 nodes Moore, Stan
14:03 Re: [lammps-users] [EXTERNAL] Re: Regarding pair_style hybrid and KOKKOS Moore, Stan
13:12 Re: [lammps-users] ERROR: Unrecognized pair style 'eam/alloy' is part of the MANYBODY package which is not enabled in this LAMMPS binary. (src/force.cpp:285) Syed Shuja Zaidi (P19PH007)
12:26 [lammps-users] Mixing Special Bond Types Wardzala, Jacob J
11:29 Re: [lammps-users] ERROR: Unrecognized pair style 'eam/alloy' is part of the MANYBODY package which is not enabled in this LAMMPS binary. (src/force.cpp:285) Axel Kohlmeyer
10:14 [lammps-users] ERROR: Unrecognized pair style 'eam/alloy' is part of the MANYBODY package which is not enabled in this LAMMPS binary. (src/force.cpp:285) chandra shekhar maurya
10:07 Re: [lammps-users] neighbors of neighbors Ganga Purja Pun
10:05 Re: [lammps-users] rRESPA for uranyl ion in aqueous solution confined inside zeolite NaY Axel Kohlmeyer
09:46 Re: [lammps-users] Regarding pair_style hybrid and KOKKOS Axel Kohlmeyer
09:42 Re: [lammps-users] Regarding pair_style hybrid and KOKKOS Grégoire Defoort
09:42 [lammps-users] Post-doc opening Thompson, Aidan
09:39 [lammps-users] rRESPA for uranyl ion in aqueous solution confined inside zeolite NaY shamimul ahsan
09:25 Re: [lammps-users] Regarding pair_style hybrid and KOKKOS Axel Kohlmeyer
09:16 [lammps-users] Regarding pair_style hybrid and KOKKOS Grégoire Defoort
09:03 Re: [lammps-users] neighbors of neighbors Steve Plimpton
04:18 Re: [lammps-users] zbl potential for Argon Axel Kohlmeyer
03:37 Re: [lammps-users] Slight inconsistencies Hasan Celik
03:21 Re: [lammps-users] Slight inconsistencies Syed Shuja Zaidi (P19PH007)
02:49 [lammps-users] zbl potential for Argon mohammad zarshenas

July 01, 2020
22:51 Re: [lammps-users] Slight inconsistencies Axel Kohlmeyer
22:26 [lammps-users] Slight inconsistencies Justice Iroegbu
12:15 Re: [lammps-users] MPICH2 only run one MPI Syed Shuja Zaidi (P19PH007)
10:54 Re: [lammps-users] Tensile test on Al 7075 alloy Will Pisani
07:31 [lammps-users] Weird diffusion coefficient Hoogerheide, M.J.
04:20 Re: [lammps-users] missing forcefield parameters for PCFF using msi2lmp tool Axel Kohlmeyer
03:34 [lammps-users] Tensile test on Al 7075 alloy isra muscati
02:09 Re: [lammps-users] MPICH2 only run one MPI jack lin 林宗賢
00:19 [lammps-users] missing forcefield parameters for PCFF using msi2lmp tool Ankit Chauhan

June 30, 2020
21:25 Re: [lammps-users] MPICH2 only run one MPI Axel Kohlmeyer
21:19 Re: [lammps-users] MPICH2 only run one MPI Syed Shuja Zaidi (P19PH007)
20:16 Re: [lammps-users] Current temperature too close to zero, consider using ptemp setting Axel Kohlmeyer
19:22 [lammps-users] Current temperature too close to zero, consider using ptemp setting Karsu Ipek Kilic
14:56 Re: [lammps-users] Creating 0 atoms Axel Kohlmeyer
14:52 Re: [lammps-users] Creating 0 atoms Eric Taylor
14:30 Re: [lammps-users] Creating 0 atoms Axel Kohlmeyer
14:19 [lammps-users] Creating 0 atoms Eric Taylor
14:15 Re: [lammps-users] neighbors of neighbors Axel Kohlmeyer
11:20 [lammps-users] neighbors of neighbors Ganga Purja Pun
09:53 Re: [lammps-users] full list of neighbors of neighbors Axel Kohlmeyer
09:43 [lammps-users] full list of neighbors of neighbors Ganga Purja Pun
07:23 Re: [lammps-users] about equilibrium by nve friction Axel Kohlmeyer
06:36 [lammps-users] about equilibrium by nve friction 陳弘儒
05:43 Re: [lammps-users] read data from dump file Axel Kohlmeyer
05:36 Re: [lammps-users] 答复: 答复: Incorrect args for pair coefficients of lj/cut Axel Kohlmeyer
03:22 [lammps-users] 答复: 答复: Incorrect args for pair coefficients of lj/cut Shuang Han
00:52 [lammps-users] read data from dump file Fu Xueqiong

June 29, 2020
19:36 Re: [lammps-users] MPICH2 only run one MPI Axel Kohlmeyer
19:00 [lammps-users] MPICH2 only run one MPI jack lin 林宗賢
12:20 [lammps-users] Adding polarization and using Moltemplate Rafal Dziedzic
05:22 Re: [lammps-users] Density profile and interaction energy calculation Axel Kohlmeyer
05:20 Re: [lammps-users] 答复: Incorrect args for pair coefficients of lj/cut Axel Kohlmeyer
05:18 Re: [lammps-users] 答复: Incorrect args for pair coefficients of lj/cut Axel Kohlmeyer
05:02 [lammps-users] Density profile and interaction energy calculation Devargya Chakraborty
00:51 [lammps-users] 答复: Incorrect args for pair coefficients of lj/cut Shuang Han

June 28, 2020
22:09 Re: [lammps-users] Incorrect args for pair coefficients of lj/cut Axel Kohlmeyer
21:09 Re: [lammps-users] Positive potential energy - HELP needed Shafat Mubin
19:18 Re: [lammps-users] Positive potential energy - HELP needed Axel Kohlmeyer
19:11 Re: [lammps-users] Radial distribution function (RDF) for pairs having same atom types Axel Kohlmeyer
18:49 [lammps-users] Radial distribution function (RDF) for pairs having same atom types Bui, Vu
18:24 Re: [lammps-users] Positive potential energy - HELP needed Bui, Vu
17:15 [lammps-users] Incorrect args for pair coefficients of lj/cut Shuang Han
14:08 Re: [lammps-users] Positive potential energy - HELP needed Axel Kohlmeyer
13:51 Re: [lammps-users] Positive potential energy - HELP needed Axel Kohlmeyer
13:13 Re: [lammps-users] Positive potential energy - HELP needed Bui, Vu
11:18 Re: [lammps-users] Permittivity of free space and the Permeability of free space in the real unit Axel Kohlmeyer
11:04 Re: [lammps-users] Positive potential energy - HELP needed Axel Kohlmeyer
10:49 [lammps-users] Permittivity of free space and the Permeability of free space in the real unit mohammad rezaei
10:45 Re: [lammps-users] Positive potential energy - HELP needed Axel Kohlmeyer
10:38 Re: [lammps-users] Potential for sio2 and water. Chamara Somarathna
10:29 [lammps-users] Positive potential energy - HELP needed Bui, Vu
10:22 Re: [lammps-users] Potential for sio2 and water. Axel Kohlmeyer
10:07 Re: [lammps-users] LAMMPS-calculation of stiffness coefficients Giacomo Fiorin
05:47 [lammps-users] Potential for sio2 and water. Devargya Chakraborty
04:56 [lammps-users] LAMMPS-calculation of stiffness coefficients Jiaqi ZHU
01:11 [lammps-users] Replace the liquid phase by a crystalline phase Asadollahzadeh

June 27, 2020
08:28 Re: [lammps-users] ERROR: Pair table cutoffs must all be equal to use with KSpace Axel Kohlmeyer
06:52 [lammps-users] ERROR: Pair table cutoffs must all be equal to use with KSpace 吴敏波

June 26, 2020
18:28 Re: [lammps-users] thermo_style prints zero values Axel Kohlmeyer
18:02 Re: [lammps-users] thermo_style prints zero values Syed Shuja Zaidi (P19PH007)
12:28 Re: [lammps-users] fix ave/correlate mechanism of work Axel Kohlmeyer
12:03 Re: [lammps-users] fix ave/correlate mechanism of work Сергей Клявинек
11:36 Re: [lammps-users] fix ave/correlate mechanism of work Axel Kohlmeyer
11:28 Re: [lammps-users] fix ave/correlate mechanism of work Сергей Клявинек
10:29 Re: [lammps-users] fix ave/correlate mechanism of work Axel Kohlmeyer
10:26 Re: [lammps-users] Error potential file requiring blank units Axel Kohlmeyer
10:25 Re: [lammps-users] fix ave/correlate mechanism of work Сергей Клявинек
10:07 [lammps-users] Error potential file requiring blank units Antoine Rincent
09:54 Re: [lammps-users] fix ave/correlate mechanism of work Axel Kohlmeyer
09:50 Re: [lammps-users] fix ave/correlate mechanism of work Сергей Клявинек
09:35 Re: [lammps-users] Segmentation fault (core dumped) Axel Kohlmeyer
09:27 Re: [lammps-users] fix ave/correlate mechanism of work Axel Kohlmeyer
09:27 Re: [lammps-users] Segmentation fault (core dumped) Irina Tuszynska
09:01 [lammps-users] thermo_style prints zero values Hirakjyoti Sarma
08:37 [lammps-users] fix ave/correlate mechanism of work Сергей Клявинек

June 25, 2020
12:14 Re: [lammps-users] Building LAMMPS with Intel compiler and Intel MPI Vrindaa Somjit
11:07 Re: [lammps-users] Question on LAMMPS Syed Shuja Zaidi (P19PH007)
11:02 Re: [lammps-users] Question on LAMMPS Axel Kohlmeyer
10:56 Re: [lammps-users] [EXTERNAL] Question on LAMMPS Jones, Keith
10:44 [lammps-users] Question on LAMMPS Justice Iroegbu
07:46 [lammps-users] Postdoc position in nanomaterial simulation Jihong Ma
06:07 [lammps-users] slope(f_msd) in DIFFUSE Hoogerheide, Hanneke
05:56 [lammps-users] PhD Studentship at Imperial College Supported by P&G James Ewen

June 24, 2020
21:00 Re: [lammps-users] a repulsion term Axel Kohlmeyer
20:59 Re: [lammps-users] a repulsion term 吴敏波
15:14 Re: [lammps-users] Building LAMMPS with Intel compiler and Intel MPI Axel Kohlmeyer
15:12 [lammps-users] Tensile test on Al 7075 alloy isra muscati
15:03 Re: [lammps-users] Building LAMMPS with Intel compiler and Intel MPI Vrindaa Somjit
14:59 Re: [lammps-users] Building LAMMPS with Intel compiler and Intel MPI Axel Kohlmeyer
14:44 [lammps-users] Building LAMMPS with Intel compiler and Intel MPI Vrindaa Somjit
13:55 Re: [lammps-users] Computing NIO parameter. Axel Kohlmeyer
13:22 [lammps-users] Computing NIO parameter. Syed Shuja Zaidi (P19PH007)
12:04 Re: [lammps-users] Question about q-TIP4p/f Ali shargh
11:29 Re: [lammps-users] Question about q-TIP4p/f Axel Kohlmeyer
11:27 Re: [lammps-users] Does "Develper guide" out of date? Axel Kohlmeyer
11:05 [lammps-users] Fw: Radial distribution function (RDF) for a pair Bui, Vu
09:57 [lammps-users] Does "Develper guide" out of date? 李吉辰
09:42 [lammps-users] Question about q-TIP4p/f Ali shargh
06:04 Re: [lammps-users] Compute hexorder/atom - troubles Axel Kohlmeyer
06:03 Re: [lammps-users] a repulsion term Axel Kohlmeyer
05:31 [lammps-users] a repulsion term 吴敏波
05:13 Re: [lammps-users] How to enable Fix cnp in lammps (Cygwin platform) Jeams Anderson
01:08 [lammps-users] about fix temp/partial P rufer
00:53 Re: [lammps-users] Relaxing layered materials with LAMMPS Nicolas Leconte

June 23, 2020
22:56 [lammps-users] Radial distribution function (RDF) for a pair Bui, Vu
22:31 [lammps-users] How to enable Fix cnp in lammps (Cygwin platform) Jeams Anderson
10:04 Re: [lammps-users] Compute hexorder/atom - troubles Linda Ravazzano
08:39 Re: [lammps-users] Compute hexorder/atom - troubles Linda Ravazzano
08:19 Re: [lammps-users] Compute hexorder/atom - troubles Axel Kohlmeyer
05:03 Re: [lammps-users] Compute hexorder/atom - troubles Axel Kohlmeyer
04:38 Re: [lammps-users] Compute hexorder/atom - troubles Linda Ravazzano
04:01 Re: [lammps-users] run time increasing omid gh
03:53 Re: [lammps-users] run time increasing Axel Kohlmeyer
03:12 Re: [lammps-users] run time increasing omid gh
02:52 Re: [lammps-users] run time increasing Axel Kohlmeyer
02:18 Re: [lammps-users] run time increasing omid gh

June 22, 2020
21:43 Re: [lammps-users] Relaxing layered materials with LAMMPS Nicolas Leconte
21:17 Re: [lammps-users] Relaxing layered materials with LAMMPS Charlie Sievers
20:35 [lammps-users] Relaxing layered materials with LAMMPS Nicolas Leconte
10:48 Re: [lammps-users] relativistic equation of motion mohammad rezaei
09:56 Re: [lammps-users] relativistic equation of motion Axel Kohlmeyer
09:44 Re: [lammps-users] relativistic equation of motion mohammad rezaei
08:50 [lammps-users] I: Re: Compute hexorder/atom - troubles Linda Ravazzano
08:14 Re: [lammps-users] Potential map Axel Kohlmeyer
08:12 Re: [lammps-users] Interatomic Potentials for Beta Gallium Oxide Axel Kohlmeyer
08:09 Re: [lammps-users] run time increasing Axel Kohlmeyer
08:03 Re: [lammps-users] Compute hexorder/atom - troubles Axel Kohlmeyer
07:55 Re: [lammps-users] relativistic equation of motion Axel Kohlmeyer
04:13 [lammps-users] relativistic equation of motion mohammad rezaei
02:52 [lammps-users] Compute hexorder/atom - troubles Linda Ravazzano
01:34 Re: [lammps-users] dump one frame after several minimization Syed Shuja Zaidi (P19PH007)
01:17 Re: [lammps-users] dump one frame after several minimization Fu Xueqiong
00:20 Re: [lammps-users] dump one frame after several minimization Syed Shuja Zaidi (P19PH007)
00:08 Re: [lammps-users] dump one frame after several minimization Axel Kohlmeyer

June 21, 2020
23:33 Re: [lammps-users] dump one frame after several minimization Syed Shuja Zaidi (P19PH007)
23:29 Re: [lammps-users] run time increasing Syed Shuja Zaidi (P19PH007)
21:47 Re: [lammps-users] run time increasing omid gh
21:39 Re: [lammps-users] run time increasing omid gh
21:11 [lammps-users] dump one frame after several minimization Fu Xueqiong
14:14 Re: [lammps-users] Carbon Fiber Axel Kohlmeyer
14:01 Re: [lammps-users] Using Python to compute forces for LAMMPS Axel Kohlmeyer
09:43 Re: [lammps-users] run time increasing Syed Shuja Zaidi (P19PH007)
08:13 Re: [lammps-users] run time increasing Will Pisani
02:20 [lammps-users] run time increasing omid gh

June 20, 2020
19:42 Re: [lammps-users] tether of fix smd command 蕭羽白
14:54 Re: [lammps-users] tether of fix smd command Axel Kohlmeyer
13:02 Re: [lammps-users] Using Python to compute forces for LAMMPS Charlie Sievers
12:12 Re: [lammps-users] Using Python to compute forces for LAMMPS Giacomo Fiorin
10:26 [lammps-users] tether of fix smd command 蕭羽白
09:38 Re: [lammps-users] Using Python to compute forces for LAMMPS RODRIGUEZ, ALEJANDRO D
09:27 Re: [lammps-users] no reading potential file and skip from 陳弘儒
09:10 Re: [lammps-users] Overdamped Langevin (Brownian) dynamics with rigid bodies Giacomo Fiorin
08:50 Re: [lammps-users] Using Python to compute forces for LAMMPS Axel Kohlmeyer
08:38 Re: [lammps-users] no reading potential file and skip from Axel Kohlmeyer
08:34 Re: [lammps-users] GPU calculation for inhomogeneous systems (Mixed precision) Axel Kohlmeyer
07:05 Re: [lammps-users] Using Python to compute forces for LAMMPS Giacomo Fiorin
02:17 [lammps-users] GPU calculation for inhomogeneous systems (Mixed precision) Chamara Somarathna
00:20 [lammps-users] Interatomic Potentials for Beta Gallium Oxide Onurcan Kaya

June 19, 2020
21:30 [lammps-users] no reading potential file and skip from 陳弘儒
18:40 [lammps-users] Using Python to compute forces for LAMMPS RODRIGUEZ, ALEJANDRO D
12:40 Re: [lammps-users] Varying force in each time step. Axel Kohlmeyer
12:34 Re: [lammps-users] "WARNING: FENE bond too long" when bond length is below the FENE cutoff length Axel Kohlmeyer
11:48 [lammps-users] "WARNING: FENE bond too long" when bond length is below the FENE cutoff length Arman Guerra
11:15 [lammps-users] Varying force in each time step. Sarthok Das
09:37 [lammps-users] EHEX Victor Nazarychev
09:33 [lammps-users] Upcoming Symposia at TMS 2021 Wood, Mitchell
02:11 Re: [lammps-users] Carbon Fiber Sami, Sayeed Nafis
01:58 [lammps-users] Carbon Fiber Sami, Sayeed Nafis
01:40 [lammps-users] Potential map mohammad rezaei

June 18, 2020
21:17 Re: [lammps-users] CaO-water reaction using reaxff Udeshini Manatunga
19:18 [lammps-users] Temperature fall to zero in gcmc ??????
19:01 Re: [lammps-users] Segmentation fault (core dumped) Axel Kohlmeyer
17:28 Re: [lammps-users] Segmentation fault (core dumped) Irina Tuszynska
11:45 Re: [lammps-users] Segmentation fault (core dumped) Axel Kohlmeyer
11:11 [lammps-users] Segmentation fault (core dumped) Irina Tuszynska
07:35 [lammps-users] Temperature fall to zero in gcmc ??????
06:32 [lammps-users] Calculation of Chemical Potential for alloys in Lammps Sandeep Kumar Singh
01:19 Re: [lammps-users] CaO-water reaction using reaxff Chamara Somarathna
00:40 Re: [lammps-users] Prescribing temperature profile in a system using langevin thermostat Subhadeep De

June 17, 2020
23:31 Re: [lammps-users] CaO-water reaction using reaxff Udeshini Manatunga
20:42 Re: [lammps-users] Question about power spectra calculation Ali shargh
19:23 [lammps-users] CaO-water reaction using reaxff Udeshini Manatunga
18:35 Re: [lammps-users] Multiple Thermostats Axel Kohlmeyer
18:34 Re: [lammps-users] Granular system with temperature MD Simulation
18:29 [lammps-users] Multiple Thermostats MD Simulation
13:43 Re: [lammps-users] Kokkos Lammps on GPU machine - negative scaling from 1 to 2 nodes Axel Kohlmeyer
13:36 Re: [lammps-users] MSD decreased Axel Kohlmeyer
13:31 Re: [lammps-users] Question about power spectra calculation Axel Kohlmeyer
13:23 Re: [lammps-users] Prescribing temperature profile in a system using langevin thermostat Axel Kohlmeyer
13:14 Re: [lammps-users] fix qeq/reax on a group of atoms Axel Kohlmeyer
13:14 Re: [lammps-users] [EXTERNAL] Bug? Moore, Stan
13:05 [lammps-users] MSD decreased Kim, Changjae
12:20 Re: [lammps-users] Compute entropy/atom problem with multi-threading Paula Loman-Cortes
12:12 [lammps-users] Question about power spectra calculation Ali shargh
11:44 [lammps-users] fix qeq/reax on a group of atoms 1185201182
11:05 Re: [lammps-users] Compute entropy/atom problem with multi-threading Axel Kohlmeyer
10:16 [lammps-users] Compute entropy/atom problem with multi-threading Paula Loman-Cortes
08:16 [lammps-users] 回复: group/group energy normalization 284237308@...1204...
07:50 [lammps-users] Energy difference at hot/cold region in NEMD simulation 山口 信義
02:03 [lammps-users] Kokkos Lammps on GPU machine - negative scaling from 1 to 2 nodes Torstein Fjermestad
00:24 Re: [lammps-users] Prescribing temperature profile in a system using langevin thermostat Subhadeep De

June 16, 2020
12:12 Re: [lammps-users] carbon nanotube Axel Kohlmeyer
11:42 Re: [lammps-users] How to apply magnetic field in lammps Devargya Chakraborty
11:38 [lammps-users] carbon nanotube 15584345983
11:17 [lammps-users] New LAMMPS patch 15 June 2020 with important bugfixes LAMMPS Developers
10:53 Re: [lammps-users] Energy unit in real unit. Axel Kohlmeyer
10:18 Re: [lammps-users] Prescribing temperature profile in a system using langevin thermostat Axel Kohlmeyer
09:53 [lammps-users] Prescribing temperature profile in a system using langevin thermostat Subhadeep De
08:47 Re: [lammps-users] How to apply magnetic field in lammps Lynn Huilin Ye
08:22 [lammps-users] Energy unit in real unit. 堤 祐太
07:39 [lammps-users] How to apply magnetic field in lammps Devargya Chakraborty

June 15, 2020
16:19 Re: [lammps-users] set different boundary conditions for nanobeam yueqiang zhang
14:45 Re: [lammps-users] [EXTERNAL] print or save last step information Axel Kohlmeyer
14:35 Re: [lammps-users] [EXTERNAL] print or save last step information Jones, Keith
14:01 [lammps-users] print or save last step information Jun Li
08:30 Re: [lammps-users] set different boundary conditions for nanobeam Will Pisani
08:13 Re: [lammps-users] write restart or write data file Will Pisani
06:34 Re: [lammps-users] ERROR: All dihedral coeffs are not set Axel Kohlmeyer
06:27 Re: [lammps-users] Cannot open MEAM potential file Pascal Brault
06:24 Re: [lammps-users] Cannot open MEAM potential file Axel Kohlmeyer
06:22 [lammps-users] ERROR: All dihedral coeffs are not set GT Wang
06:22 [lammps-users] ?????? Building slit pore model using PPP pbc ??????
06:21 Re: [lammps-users] Cannot open MEAM potential file Axel Kohlmeyer
06:20 Re: [lammps-users] Cannot open MEAM potential file Pascal Brault
06:13 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi
06:13 Re: [lammps-users] Cannot open MEAM potential file Axel Kohlmeyer
06:06 Re: [lammps-users] Cannot open MEAM potential file Pascal Brault
05:45 Re: [lammps-users] Cannot open MEAM potential file Sebastian Hütter
05:26 Re: [lammps-users] Cannot open MEAM potential file Axel Kohlmeyer
05:06 [lammps-users] Cannot open MEAM potential file CHABBA Hanae
02:33 Re: [lammps-users] Nudged elastic band simulations with variable unit cells in LAMMPS genri
02:27 Re: [lammps-users] Overdamped Langevin (Brownian) dynamics with rigid bodies Valerio Sorichetti
01:04 Re: [lammps-users] write restart or write data file omid gh
00:30 [lammps-users] write restart or write data file omid gh

June 14, 2020
22:53 Re: [lammps-users] set different boundary conditions for nanobeam yueqiang zhang
22:36 Re: [lammps-users] disorganized output Axel Kohlmeyer
22:30 Re: [lammps-users] BenchMark Study Results Axel Kohlmeyer
21:48 [lammps-users] BenchMark Study Results Vallabh, Ajay
18:13 Re: [lammps-users] disorganized output Axel Kohlmeyer
17:55 Re: [lammps-users] group/group energy normalization Axel Kohlmeyer
17:17 [lammps-users] disorganized output stepsil ode
15:54 [lammps-users] group/group energy normalization 284237308
10:23 Re: [lammps-users] fix bond/react Jacob Gissinger
03:35 Re: [lammps-users] pair_style error problem Axel Kohlmeyer
01:37 [lammps-users] pair_style error problem Md Masuduzzaman
01:29 [lammps-users] fix bond/react Bo Gong
00:40 [lammps-users] pair_style error problem Md Masuduzzaman

June 13, 2020
19:59 [lammps-users] Error while undergoing uni-axial tensile deformation of a network of chains George Ray
13:59 Re: [lammps-users] fix bond/react Jacob Gissinger
13:43 Re: [lammps-users] Nudged elastic band simulations with variable unit cells in LAMMPS Axel Kohlmeyer
13:25 [lammps-users] Nudged elastic band simulations with variable unit cells in LAMMPS genri
12:19 Re: [lammps-users] fix bond/react Will Pisani
11:55 Re: [lammps-users] Equlibration problem: Structure collapsing during NVT calculation Axel Kohlmeyer
09:40 [lammps-users] fix bond/react Bo Gong
06:21 [lammps-users] Equlibration problem: Structure collapsing during NVT calculation Harkishan Dua
05:14 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Axel Kohlmeyer

June 12, 2020
17:39 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Martinez Saez, Enrique
06:00 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi
04:41 Re: [lammps-users] [EXTERNAL] Re: fix balance rcb and kokkos gpu Garip Erdoğan
03:52 [lammps-users] 回复: about compute the specified group Ecoul ZHANG zhang

June 11, 2020
20:49 Re: [lammps-users] about compute the specified group Ecoul Axel Kohlmeyer
20:33 [lammps-users] about compute the specified group Ecoul ZHANG zhang
20:10 [lammps-users] Graduate student position openings : New Mexico Tech Deep Choudhuri
20:02 Re: [lammps-users] Building slit pore model using PPP pbc Axel Kohlmeyer
20:00 Re: [lammps-users] Seeking advice: RDF force field Axel Kohlmeyer
19:57 Re: [lammps-users] NEB simulation for variable cells Axel Kohlmeyer
19:47 Re: [lammps-users] Unable to build with Cmake ( Mac OS 10.14) Axel Kohlmeyer
19:42 Re: [lammps-users] Equilibration Axel Kohlmeyer
15:34 Re: [lammps-users] Equilibration Giacomo Fiorin
14:42 Re: [lammps-users] Error within USER-MISC Axel Kohlmeyer
14:19 Re: [lammps-users] Error within USER-MISC Filip Simeski
14:16 Re: [lammps-users] Error within USER-MISC Axel Kohlmeyer
14:04 Re: [lammps-users] Error within USER-MISC Filip Simeski
13:48 Re: [lammps-users] Error within USER-MISC Axel Kohlmeyer
13:44 Re: [lammps-users] question about pair_coul_long_soft potential Agilio Padua
13:40 Re: [lammps-users] [EXTERNAL] Re: fix balance rcb and kokkos gpu Moore, Stan
13:39 Re: [lammps-users] equilibration with MC Will Pisani
13:23 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Moore, Stan
12:33 Re: [lammps-users] equilibration with MC omid gh
12:20 [lammps-users] Equilibration Arunjyoti sinha roy
12:16 [lammps-users] Error within USER-MISC Filip Simeski
12:14 Re: [lammps-users] fix balance rcb and kokkos gpu Axel Kohlmeyer
12:05 Re: [lammps-users] question about pair_coul_long_soft potential Axel Kohlmeyer
12:00 [lammps-users] equilibration with MC omid gh
11:20 Re: [lammps-users] Request to add question to the mailing list Axel Kohlmeyer
11:16 Re: [lammps-users] Request to add question to the mailing list Will Pisani
10:37 [lammps-users] question about pair_coul_long_soft potential Yang Hong
10:29 Re: [lammps-users] Unable to build with Cmake ( Mac OS 10.14) Giacomo Fiorin
10:13 [lammps-users] Request to add question to the mailing list Shahriar Mufid
08:12 Re: [lammps-users] Unable to build with Cmake ( Mac OS 10.14) Axel Kohlmeyer
08:08 Re: [lammps-users] Unable to build with Cmake ( Mac OS 10.14) Giacomo Fiorin
07:47 [lammps-users] Unable to build with Cmake ( Mac OS 10.14) Hirakjyoti Sarma
05:31 [lammps-users] fix balance rcb and kokkos gpu Garip Erdoğan
04:13 [lammps-users] NEB simulation for variable cells genri

June 10, 2020
23:45 [lammps-users] Unable to build with Cmake ( Mac OS 10.14) Hirakjyoti Sarma
21:48 Re: [lammps-users] Condition during a run Axel Kohlmeyer
21:27 Re: [lammps-users] Condition during a run Axel Kohlmeyer
17:42 Re: [lammps-users] Condition during a run Reza Namakian
17:03 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi
16:19 Re: [lammps-users] Condition during a run Axel Kohlmeyer
16:01 [lammps-users] Condition during a run Reza Namakian
15:30 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Moore, Stan
09:26 Re: [lammps-users] Overdamped Langevin (Brownian) dynamics with rigid bodies Giacomo Fiorin
09:14 Re: [lammps-users] angle atoms missing crash -- comm or pair-cutoff issue? Robert Hoy
04:42 [lammps-users] Seeking advice: RDF force field Moulham Alsuleman
04:31 [lammps-users] Overdamped Langevin (Brownian) dynamics with rigid bodies Valerio Sorichetti
04:15 Re: [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Md Shajedul Hoque Thakur
03:58 Re: [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Axel Kohlmeyer
03:52 Re: [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Md Shajedul Hoque Thakur
03:50 Re: [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Axel Kohlmeyer
03:40 Re: [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Sharad B

June 09, 2020
22:24 Re: [lammps-users] lammps installment Axel Kohlmeyer
22:15 [lammps-users] lammps installment omid gh
22:04 Re: [lammps-users] Detection of Grain Boundary Migration Md Shajedul Hoque Thakur
21:50 Re: [lammps-users] Detection of Grain Boundary Migration Axel Kohlmeyer
21:01 [lammps-users] Detection of Grain Boundary Migration Md Shajedul Hoque Thakur
15:20 Re: [lammps-users] Custom Pair Potential Andrew Xu
14:17 [lammps-users] Slack workspace for LAMMPS development Axel Kohlmeyer
09:41 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi
09:05 [lammps-users] polymer benchmark study Vallabh, Ajay
08:34 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Martinez Saez, Enrique
07:14 Re: [lammps-users] fix bond/create and fix bond/break Bo Gong
07:07 [lammps-users] Building slit pore model using PPP pbc ??????
07:02 Re: [lammps-users] [EXTERNAL] Re: Getting error while reading potential file Ankit Chauhan
05:30 Re: [lammps-users] Help:LAMMPS GPU Axel Kohlmeyer
05:11 Re: [lammps-users] fix bond/create and fix bond/break Axel Kohlmeyer
04:04 Re: [lammps-users] Help:LAMMPS GPU yuh ldr
03:10 [lammps-users] fix bond/create and fix bond/break Bo Gong
00:33 [lammps-users] set different boundary conditions for nanobeam yueqiang zhang

June 08, 2020
20:24 [lammps-users] Trouble with dumping Improper angles during a MD run MASATO KOIZUMI
19:37 Re: [lammps-users] angle atoms missing crash -- comm or pair-cutoff issue? Robert Hoy
18:46 Re: [lammps-users] Custom Pair Potential Axel Kohlmeyer
18:42 Re: [lammps-users] Custom Pair Potential Andrew Xu
18:13 Re: [lammps-users] Regarding RDF calculation Axel Kohlmeyer
18:05 [lammps-users] Regarding RDF calculation Rameswar Bhattacharjee
15:11 Re: [lammps-users] Help:LAMMPS GPU yuh ldr
15:02 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Axel Kohlmeyer
14:52 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Martinez Saez, Enrique
14:47 Re: [lammps-users] Help:LAMMPS GPU Axel Kohlmeyer
14:42 Re: [lammps-users] Help:LAMMPS GPU yuh ldr
14:39 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Axel Kohlmeyer
14:31 Re: [lammps-users] [EXTERNAL] Re: NEB segfault Martinez Saez, Enrique
14:16 Re: [lammps-users] NEB segfault Axel Kohlmeyer
14:03 Re: [lammps-users] Help:LAMMPS GPU Axel Kohlmeyer
13:59 Re: [lammps-users] Help:LAMMPS GPU Juan Andres de la Rosa Abad
13:35 Re: [lammps-users] [EXTERNAL] Re: Getting error while reading potential file Jones, Keith
13:16 [lammps-users] NEB segfault Martinez Saez, Enrique
13:15 [lammps-users] Help:LAMMPS GPU yuh ldr
06:00 [lammps-users] nanotube in fluid electrolyte omid gh
04:57 Re: [lammps-users] Custom Pair Potential Stefan Paquay
00:52 [lammps-users] RDF_caculation for specific atom Moulham Alsuleman

June 07, 2020
20:45 Re: [lammps-users] Segmentation fault (signal 11) Error Axel Kohlmeyer
19:21 [lammps-users] structure relaxation Hamdani soumia
19:18 Re: [lammps-users] Are the first assigned pair_style and pair_coeff totally overwritten by the second assigned ones in the same input script? Wenqiang Liu
16:25 [lammps-users] Question about compute global/atom Ali shargh
12:23 [lammps-users] lammps data generator with cross bonds omid gh
09:19 Re: [lammps-users] Getting error while reading potential file Ankit Chauhan
09:03 Re: [lammps-users] Getting error while reading potential file Axel Kohlmeyer
08:59 Re: [lammps-users] Getting error while reading potential file Ankit Chauhan
07:59 Re: [lammps-users] Getting error while reading potential file Axel Kohlmeyer
06:10 [lammps-users] Getting error while reading potential file Ankit Chauhan

June 06, 2020
19:21 Re: [lammps-users] Custom Pair Potential Axel Kohlmeyer
17:01 Re: [lammps-users] Custom Pair Potential Andrew Xu
13:22 [lammps-users] compute entropy/atom reza namakian
11:33 Re: [lammps-users] Segmentation fault (signal 11) Error Shoumik Saha
09:59 Re: [lammps-users] Segmentation fault (signal 11) Error Axel Kohlmeyer
03:41 Re: [lammps-users] Custom Pair Potential Axel Kohlmeyer
03:12 [lammps-users] Relaxation process in metallic bilayer system Hamdani soumia
01:23 [lammps-users] Custom Pair Potential Andrew Xu

June 05, 2020
21:02 Re: [lammps-users] Segmentation fault (signal 11) Error Shoumik Saha
19:02 Re: [lammps-users] Compute vdw and electrostatic force separately by group/group Axel Kohlmeyer
15:40 [lammps-users] Compute vdw and electrostatic force separately by group/group Kim, Changjae
13:21 Re: [lammps-users] Question about fix vacf Ali shargh
12:59 Re: [lammps-users] Question about fix vacf Axel Kohlmeyer
12:49 Re: [lammps-users] Question about fix vacf Ali shargh
12:28 Re: [lammps-users] Question about fix vacf Axel Kohlmeyer
12:15 Re: [lammps-users] angle atoms missing crash -- comm or pair-cutoff issue? Axel Kohlmeyer
12:02 Re: [lammps-users] Are the first assigned pair_style and pair_coeff totally overwritten by the second assigned ones in the same input script? Axel Kohlmeyer
11:28 [lammps-users] angle atoms missing crash -- comm or pair-cutoff issue? Robert Hoy
10:17 [lammps-users] Question about fix vacf Ali shargh
08:32 [lammps-users] new patch release Steve Plimpton
08:15 Re: [lammps-users] atoms overlapping 吴敏波
06:55 [lammps-users] Are the first assigned pair_style and pair_coeff totally overwritten by the second assigned ones in the same input script? Wenqiang Liu
05:28 Re: [lammps-users] unknown parameter Reactive Axel Kohlmeyer
05:24 Re: [lammps-users] unknown parameter Reactive 陳弘儒

June 04, 2020
18:42 Re: [lammps-users] Loop for input file name Hao Zhu
16:52 Re: [lammps-users] Loop for input file name Axel Kohlmeyer
16:47 Re: [lammps-users] Loop for input file name Will Pisani
15:52 [lammps-users] Loop for input file name Hao Zhu
14:39 Re: [lammps-users] compute group/group Toon Tavas
12:10 Re: [lammps-users] compute group/group Dezhao Huang
12:08 Re: [lammps-users] compute group/group Will Pisani
11:59 [lammps-users] compute group/group Toon Tavas
10:32 Re: [lammps-users] Conversion of MOF data file Axel Kohlmeyer
08:53 [lammps-users] Conversion of MOF data file DHRUVAL SURESH SHAH 17110051
08:53 Re: [lammps-users] Lammps with intel package error meaning Axel Kohlmeyer
08:43 [lammps-users] Lammps with intel package error meaning ADAM BARNETT
08:42 Re: [lammps-users] unknown parameter Reactive Axel Kohlmeyer
07:58 [lammps-users] unknown parameter Reactive 陳弘儒
07:17 [lammps-users] Metal foam relaxation Asadollahzadeh
06:31 Re: [lammps-users] Lmp_serial Axel Kohlmeyer
06:29 Re: [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Axel Kohlmeyer
06:19 Re: [lammps-users] [EXTERNAL] Re: Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Axel Kohlmeyer
05:51 Re: [lammps-users] [EXTERNAL] Re: Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Prithwish Nandi
03:45 [lammps-users] pair_coeff command while using MEAM potential of multi-elemental system Sharad B
01:37 Re: [lammps-users] Free Vibration test on clamped-clamped nickel nanobeam Mahmudul Islam
01:01 [lammps-users] Free Vibration test on clamped-clamped nickel nanobeam yueqiang zhang
00:27 [lammps-users] Lmp_serial Eric Taylor

June 03, 2020
17:58 Re: [lammps-users] Fwd: Thermal shock simulation Abhishek Thakur
16:15 Re: [lammps-users] Structure optimation by bop potential Shin Kiyohara
16:03 Re: [lammps-users] Atom moving velocity regarding "displace_atoms" command Bui, Vu
16:01 Re: [lammps-users] Atom moving velocity regarding "displace_atoms" command Bui, Vu
13:48 Re: [lammps-users] Regarding to uncrossability of particles contain DPD beads without bond Katerina Marino
09:10 Re: [lammps-users] Structure optimation by bop potential Axel Kohlmeyer
07:39 [lammps-users] Structure optimation by bop potential Shin Kiyohara
05:59 [lammps-users] Fwd: Asking for an alternative to fix heat command. Garip Erdoğan
05:26 Re: [lammps-users] Granular system with temperature Axel Kohlmeyer
05:18 Re: [lammps-users] Granular system with temperature Axel Kohlmeyer
05:17 Re: [lammps-users] Incorrect well-depth for lj/cut potential Axel Kohlmeyer
05:07 Re: [lammps-users] Regarding to uncrossability of particles contain DPD beads without bond Axel Kohlmeyer
05:06 Re: [lammps-users] Incorrect well-depth for lj/cut potential Grégoire Defoort
04:44 Re: [lammps-users] Atom moving velocity regarding "displace_atoms" command Axel Kohlmeyer
03:56 [lammps-users] Fwd: Thermal shock simulation Manoj Warrier
01:44 [lammps-users] relax phase omid gh
01:24 [lammps-users] Atom moving velocity regarding "displace_atoms" command Bui, Vu

June 02, 2020
16:08 [lammps-users] Regarding to uncrossability of particles contain DPD beads without bond Katerina Marino
15:02 [lammps-users] Granular system with temperature MD Simulation
12:51 Re: [lammps-users] [EXTERNAL] Bug? Moore, Stan
12:50 Re: [lammps-users] [EXTERNAL] Re: Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Moore, Stan
10:09 Re: [lammps-users] Super cell size and Fix command for calculating density at high pressure Sharad B
08:54 Re: [lammps-users] Super cell size and Fix command for calculating density at high pressure Axel Kohlmeyer
08:23 Re: [lammps-users] Super cell size and Fix command for calculating density at high pressure Sharad B
07:27 Re: [lammps-users] Thermal shock simulation Abhishek Thakur
06:28 Re: [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Wenqiang Liu
06:09 Re: [lammps-users] hydronium ion on the boundary Axel Kohlmeyer
06:00 Re: [lammps-users] Super cell size and Fix command for calculating density at high pressure Axel Kohlmeyer
05:51 Re: [lammps-users] Thermal shock simulation Axel Kohlmeyer
05:47 Re: [lammps-users] Defining a triclinic region in a triclinic simulation box Axel Kohlmeyer
05:36 Re: [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Axel Kohlmeyer
05:28 Re: [lammps-users] Incorrect well-depth for lj/cut potential Pascal Brault
03:59 Re: [lammps-users] Incorrect well-depth for lj/cut potential Germain CLAVIER
03:48 Re: [lammps-users] When more than 32 groups need to be defined, how to find alternatives? Axel Kohlmeyer
03:44 Re: [lammps-users] Incorrect well-depth for lj/cut potential Axel Kohlmeyer
02:22 [lammps-users] Incorrect well-depth for lj/cut potential Grégoire Defoort
01:51 [lammps-users] When more than 32 groups need to be defined, how to find alternatives? Voidshatter
01:27 [lammps-users] Fwd: Fwd: atoms overlapping Chamara Somarathna
01:14 Re: [lammps-users] atoms overlapping Chamara Somarathna
01:07 Re: [lammps-users] atoms overlapping MASATO KOIZUMI
01:00 [lammps-users] Fwd: atoms overlapping Chamara Somarathna
00:46 [lammps-users] atoms overlapping 吴敏波

June 01, 2020
23:02 [lammps-users] Heat flux calculation for a multi component system Chamara Somarathna
21:30 Re: [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Wenqiang Liu
20:34 [lammps-users] Defining a triclinic region in a triclinic simulation box Vrindaa Somjit
20:09 Re: [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Axel Kohlmeyer
19:51 Re: [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Wenqiang Liu
16:51 [lammps-users] Thermal shock simulation Abhishek Thakur
14:01 [lammps-users] Super cell size and Fix command for calculating density at high pressure Sharad B
13:40 [lammps-users] hydronium ion on the boundary Atefeh Tarokh
11:51 Re: [lammps-users] how find phase of material omid gh
08:25 Re: [lammps-users] tensile test for graphene in lammps Will Pisani
06:00 Re: [lammps-users] how find phase of material omid gh
05:13 Re: [lammps-users] how find phase of material omid gh
04:41 Re: [lammps-users] tensile test for graphene in lammps Axel Kohlmeyer
04:34 Re: [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Axel Kohlmeyer
04:02 Re: [lammps-users] Regarding models for alpha and gamma-Al2O3 Axel Kohlmeyer
03:29 [lammps-users] University of California Merced - Postdoc in Computational Materials and Mechanics James Ewen
02:54 Re: [lammps-users] Calculate chemical potential using FEP method Agilio Padua
02:12 [lammps-users] Calculate chemical potential using FEP method ??????
01:54 [lammps-users] Compute global kinetic energy components Alfonso Gijón
01:17 [lammps-users] tensile test for graphene in lammps yueqiang zhang
00:32 [lammps-users] Regarding models for alpha and gamma-Al2O3 Shuang Han

May 31, 2020
23:01 [lammps-users] how find phase of material omid gh
21:34 [lammps-users] How to build the tabulated file for pair_style table if I only know the formula of the force? Wenqiang Liu
20:11 Re: [lammps-users] Average atom potential for random alloys in LAMMPS SANDEEP KUMAR SINGH
20:04 Re: [lammps-users] Calculate chemical potential using fep Axel Kohlmeyer
19:58 Re: [lammps-users] Average atom potential for random alloys in LAMMPS Axel Kohlmeyer
19:46 Re: [lammps-users] Potential for metal oxide-supported nanoalloy Axel Kohlmeyer
19:38 Re: [lammps-users] Problem with NEMD simulation of rigid particles with LJ solvent and FENE chains Axel Kohlmeyer
19:34 Re: [lammps-users] Fix Rigid command doubt Axel Kohlmeyer
19:32 Re: [lammps-users] Problem with fix/wall/gran .... wiggle Axel Kohlmeyer
12:29 Re: [lammps-users] Tracking KE of sputtered atoms - Computationally efficient method? Pascal Brault
11:23 [lammps-users] Problem with fix/wall/gran .... wiggle Alok Tiwari
09:55 Re: [lammps-users] Where can I find atomic charges and atom type informations COMPASS and DREIDING force field Axel Kohlmeyer
09:19 Re: [lammps-users] Where can I find atomic charges and atom type informations COMPASS and DREIDING force field Dorj Bat
07:40 [lammps-users] Tracking KE of sputtered atoms - Computationally efficient method? Morrissey, Liam S.
06:59 Re: [lammps-users] Where can I find atomic charges and atom type informations COMPASS and DREIDING force field Axel Kohlmeyer
06:18 [lammps-users] Where can I find atomic charges and atom type informations COMPASS and DREIDING force field Dorj Bat

May 30, 2020
21:36 Re: [lammps-users] Using Bond, Angle and Dihedral Information in Ellipsoids sandipan c
19:55 [lammps-users] Fix Rigid command doubt Ankit Roy
13:09 [lammps-users] Problem with NEMD simulation of rigid particles with LJ solvent and FENE chains Shoumik Saha
10:08 [lammps-users] Different temperature for a box of alloys Asadollahzadeh
08:31 Re: [lammps-users] Using Bond, Angle and Dihedral Information in Ellipsoids sandipan c
07:55 Re: [lammps-users] Using Bond, Angle and Dihedral Information in Ellipsoids Axel Kohlmeyer
07:48 Re: [lammps-users] Using Bond, Angle and Dihedral Information in Ellipsoids sandipan c
07:01 Re: [lammps-users] Using Bond, Angle and Dihedral Information in Ellipsoids Axel Kohlmeyer
04:34 [lammps-users] postdoc opening in Milano Roberto Guerra
00:30 [lammps-users] Potential for metal oxide-supported nanoalloy Shuang Han

May 29, 2020
23:39 [lammps-users] Calculating Mass Flux in LAMMPS Suman Chakraborty
21:50 Re: [lammps-users] Region prism parameters Axel Kohlmeyer
20:53 [lammps-users] Region prism parameters Achar, Sid
16:59 Re: [lammps-users] Fwd: SPC/E rigid water model Andrew Jewett
12:47 [lammps-users] Using Bond, Angle and Dihedral Information in Ellipsoids sandipan c
10:37 [lammps-users] Average atom potential for random alloys in LAMMPS SANDEEP KUMAR SINGH
10:01 Re: [lammps-users] Regarding pair_style hybrid involving eam/alloy Axel Kohlmeyer
09:58 Re: [lammps-users] Regarding pair_style hybrid involving eam/alloy Ranga Teja
09:34 Re: [lammps-users] Regarding pair_style hybrid involving eam/alloy Axel Kohlmeyer
09:21 [lammps-users] Regarding pair_style hybrid involving eam/alloy Ranga Teja
09:19 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Shrabanti Bhattacharya
08:21 [lammps-users] Calculate chemical potential using fep ??????
07:21 Re: [lammps-users] Regarding 3d indent input script. Ray Shan
06:57 Re: [lammps-users] Regarding 3d indent input script. Ray Shan
05:19 Re: [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Wenqiang Liu

May 28, 2020
15:01 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Shrabanti Bhattacharya
12:55 Re: [lammps-users] Wetting of droplet on substrate surface guanyj16
12:15 Re: [lammps-users] External Code Replacing Total PE Calculation Axel Kohlmeyer
11:55 Re: [lammps-users] External Code Replacing Total PE Calculation Jacob Faibussowitsch
11:49 Re: [lammps-users] Wetting of droplet on substrate surface Ivan Moncayo
11:29 Re: [lammps-users] Wetting of droplet on substrate surface Axel Kohlmeyer
11:03 Re: [lammps-users] Wetting of droplet on substrate surface guanyj16
10:17 Re: [lammps-users] piece-wise pair coul long potential Axel Kohlmeyer
09:15 Re: [lammps-users] piece-wise pair coul long potential Yang Hong
08:22 Re: [lammps-users] External Code Replacing Total PE Calculation Axel Kohlmeyer
08:11 Re: [lammps-users] Wetting of droplet on substract surface Axel Kohlmeyer
07:54 Re: [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Axel Kohlmeyer
07:03 Re: [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Wenqiang Liu
04:51 Re: [lammps-users] bond torsion format for cff93 forcefield omid gh
04:47 [lammps-users] Wetting of droplet on substract surface guanyj16
03:58 Re: [lammps-users] bond torsion format for cff93 forcefield Axel Kohlmeyer
03:48 Re: [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Axel Kohlmeyer
03:14 Re: [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Wenqiang Liu
03:03 [lammps-users] Postdoctoral Position in Molecular Tribology at Swinburne University of Technology (Melbourne, Australia) James Ewen
01:19 [lammps-users] bond torsion format for cff93 forcefield omid gh

May 27, 2020
21:40 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Axel Kohlmeyer
21:26 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Shrabanti Bhattacharya
21:10 Re: [lammps-users] External Code Replacing Total PE Calculation Axel Kohlmeyer
19:02 [lammps-users] External Code Replacing Total PE Calculation Jacob Faibussowitsch
16:23 Re: [lammps-users] Visualisation problem, Hydrogen Hydrogen attachment Axel Kohlmeyer
11:26 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Ευάγγελος Βογιατζής
11:14 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Shrabanti Bhattacharya
10:59 Re: [lammps-users] Regarding extraction of structural parameter from lammps trajectory Ευάγγελος Βογιατζής
10:53 [lammps-users] Regarding extraction of structural parameter from lammps trajectory Shrabanti Bhattacharya
10:25 [lammps-users] Visualisation problem, Hydrogen Hydrogen attachment Moulham Alsuleman
09:39 Re: [lammps-users] WARNING: Ignoring 'compress yes' for molecular system Giacomo Fiorin
08:53 [lammps-users] WARNING: Ignoring 'compress yes' for molecular system guanguan
08:11 Re: [lammps-users] Atoms getting lost Giacomo Fiorin
07:58 Re: [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Axel Kohlmeyer
07:46 [lammps-users] variable style equal can be used with per atom value x[i] but not with fx[i] Wenqiang Liu
06:22 Re: [lammps-users] not zero net charge Axel Kohlmeyer
06:08 Re: [lammps-users] not zero net charge omid gh
03:24 Re: [lammps-users] not zero net charge Axel Kohlmeyer
01:22 [lammps-users] not zero net charge omid gh

May 26, 2020
23:50 [lammps-users] Atoms getting lost Ankit Roy
13:42 Re: [lammps-users] [EXTERNAL] Bug? Prithwish Nandi
12:49 Re: [lammps-users] Issue with local & global atomic IDs Axel Kohlmeyer
11:41 Re: [lammps-users] Question about Colvars in LAMMPS Giacomo Fiorin
11:15 Re: [lammps-users] Issue with local & global atomic IDs Kritikos, Efstratios
10:03 Re: [lammps-users] Installing LAMMPS on macOSX cmake app Pascal Brault
09:57 Re: [lammps-users] piece-wise pair coul long potential Axel Kohlmeyer
09:47 Re: [lammps-users] Network of coarse-grained beads Giacomo Fiorin
09:44 Re: [lammps-users] Installing LAMMPS on macOSX cmake app Axel Kohlmeyer
09:41 Re: [lammps-users] Installing LAMMPS on macOSX cmake app Pascal Brault
09:37 Re: [lammps-users] Installing LAMMPS on macOSX cmake app Axel Kohlmeyer
09:35 Re: [lammps-users] Issue with local & global atomic IDs Axel Kohlmeyer
09:34 [lammps-users] Installing LAMMPS on macOSX cmake app Pascal Brault
09:34 [lammps-users] piece-wise pair coul long potential Yang Hong
08:15 [lammps-users] Issue with local & global atomic IDs Kritikos, Efstratios
07:30 Re: [lammps-users] "-nan"Error Axel Kohlmeyer

May 25, 2020
22:45 [lammps-users] "-nan"Error 吴敏波
17:05 Re: [lammps-users] How to use fix gcmc + fix nvt Alishba John
15:50 [lammps-users] Network of coarse-grained beads George Ray
15:15 Re: [lammps-users] [EXTERNAL] Bug? Axel Kohlmeyer
15:03 Re: [lammps-users] Lost Atoms Error Axel Kohlmeyer
14:49 Re: [lammps-users] Lost Atoms Error Vancouver Johnson
14:20 Re: [lammps-users] Lost Atoms Error Axel Kohlmeyer
14:15 Re: [lammps-users] Lost Atoms Error Vancouver Johnson
10:30 Re: [lammps-users] Lost Atoms Error Axel Kohlmeyer
10:07 [lammps-users] Lost Atoms Error Vancouver Johnson
10:05 Re: [lammps-users] "Bond atom missing in image check" error Axel Kohlmeyer
10:03 Re: [lammps-users] pressure fluctuation during the global optimisation Axel Kohlmeyer
09:51 Re: [lammps-users] "Bond atom missing in image check" error omid gh
09:49 Re: [lammps-users] pressure fluctuation during the global optimisation Dong gi Kang
08:50 Re: [lammps-users] How to use fix gcmc + fix nvt Axel Kohlmeyer
08:37 Re: [lammps-users] [lammps_users] pressure fluctuation during the global optimisation Axel Kohlmeyer
08:27 Re: [lammps-users] "-nan“Error Axel Kohlmeyer
08:19 Re: [lammps-users] "Bond atom missing in image check" error Axel Kohlmeyer
08:14 Re: [lammps-users] (no subject) Axel Kohlmeyer
08:14 Re: [lammps-users] "Bond atom missing in image check" error omid gh
08:06 Re: [lammps-users] "Bond atom missing in image check" error Axel Kohlmeyer
08:01 [lammps-users] [lammps_users] pressure fluctuation during the global optimisation Dong gi Kang
07:35 [lammps-users] "-nan“Error 吴敏波
07:12 [lammps-users] "Bond atom missing in image check" error omid gh
06:49 Re: [lammps-users] Domain Decomposition and Atom->Map Axel Kohlmeyer
05:44 Re: [lammps-users] Domain Decomposition and Atom->Map S M
02:12 [lammps-users] (no subject) Diljith T

May 24, 2020
13:19 Re: [lammps-users] How to use fix gcmc + fix nvt Alishba John
11:15 [lammps-users] Postdoc opportunity at Sandia National Laboratories Wilson, Mark
10:48 Re: [lammps-users] How to used fix gcmc + fix nvt Axel Kohlmeyer
10:41 Re: [lammps-users] Helmholtz free energy 默苍离
10:40 Re: [lammps-users] Cap the magnitude of repulsive interactions for closely approaching atoms Mahmudul Islam
10:35 Re: [lammps-users] Cap the magnitude of repulsive interactions for closely approaching atoms Axel Kohlmeyer
10:23 Re: [lammps-users] Helmholtz free energy Axel Kohlmeyer
05:26 [lammps-users] Helmholtz free energy 默苍离
00:22 [lammps-users] Cap the magnitude of repulsive interactions for closely approaching atoms Mahmudul Islam

May 23, 2020
17:18 Re: [lammps-users] [EXTERNAL] Bug? Thompson, Aidan
16:53 [lammps-users] Bug? Prithwish Nandi
02:08 [lammps-users] (no subject) Alishba John

May 22, 2020
09:10 Re: [lammps-users] Has anyone calculated elastic constants of systems with interfaces Giacomo Fiorin
08:03 Re: [lammps-users] nonconservation of energy with fix ehex and fix nve command in n-heptane/benzene mixture Xiaoyu Chen
07:08 Re: [lammps-users] nonconservation of energy with fix ehex and fix nve command in n-heptane/benzene mixture Peter Wirnsberger
06:30 Re: [lammps-users] How to modify the F calculation method? Axel Kohlmeyer
06:13 [lammps-users] How to modify the F calculation method? 默苍离
05:06 Re: [lammps-users] Fwd: SPC/E rigid water model Axel Kohlmeyer
04:50 [lammps-users] Fwd: SPC/E rigid water model shamimul ahsan

May 21, 2020
20:13 Re: [lammps-users] Rerunning an xtc file Liel Sapir
16:55 Re: [lammps-users] Domain Decomposition and Atom->Map Axel Kohlmeyer
15:58 [lammps-users] Domain Decomposition and Atom->Map S M
12:48 Re: [lammps-users] Rerunning an xtc file Axel Kohlmeyer
11:51 Re: [lammps-users] Rerunning an xtc file Liel Sapir
08:15 [lammps-users] Has anyone calculated elastic constants of systems with interfaces Han Hu
07:49 Re: [lammps-users] dcd file in HPC omid gh
07:43 Re: [lammps-users] dcd file in HPC Axel Kohlmeyer
07:26 Re: [lammps-users] dcd file in HPC omid gh
04:56 Re: [lammps-users] dcd file in HPC Axel Kohlmeyer
03:38 Re: [lammps-users] nonconservation of energy with fix ehex and fix nve command in n-heptane/benzene mixture Xiaoyu Chen
02:41 Re: [lammps-users] nonconservation of energy with fix ehex and fix nve command in n-heptane/benzene mixture Peter Wirnsberger
01:30 [lammps-users] dcd file in HPC omid gh

May 20, 2020
15:31 Re: [lammps-users] Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Prithwish Nandi
06:46 Re: [lammps-users] about two lattice in a same simulation Sio2 and W Axel Kohlmeyer

May 19, 2020
21:39 [lammps-users] about two lattice in a same simulation Sio2 and W 陳弘儒
20:15 [lammps-users] rotational correlation time Lamm Gro
16:22 [lammps-users] How to used fix gcmc + fix nvt Alishba John
15:03 Re: [lammps-users] Time acceleration in Elongation problem Arunjyoti sinha roy
13:44 Re: [lammps-users] Sudden very large increase in temperature Axel Kohlmeyer
10:33 [lammps-users] Sudden very large increase in temperature Abedi, Mostafa
09:06 Re: [lammps-users] calculation pure electric force Axel Kohlmeyer
08:45 [lammps-users] calculation pure electric force mohammad rezaei
08:37 Re: [lammps-users] Time acceleration in Elongation problem Giacomo Fiorin
07:10 [lammps-users] nonconservation of energy with fix ehex and fix nve command in n-heptane/benzene mixture Xiaoyu Chen
02:04 Re: [lammps-users] Sph water_collapse Анна Яценко

May 18, 2020
19:08 Re: [lammps-users] NaNs in dump; Langevin GJF flags compatible with finite-sized angular momentum thermostatting options? Bergen, J.R.
17:46 [lammps-users] A question about GCMC+NVT simulation dlc212
17:38 [lammps-users] Time acceleration in Elongation problem Arunjyoti sinha roy
15:20 Re: [lammps-users] Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Prithwish Nandi
15:00 Re: [lammps-users] (no subject) Axel Kohlmeyer
14:25 [lammps-users] (no subject) runak saedi
09:52 Re: [lammps-users] FW: [EXTERNAL] A question about GCMC simulation Thompson, Aidan
09:25 [lammps-users] FW: [EXTERNAL] A question about GCMC simulation Thompson, Aidan
09:22 Re: [lammps-users] [EXTERNAL] (no subject) Thompson, Aidan
09:15 Re: [lammps-users] [EXTERNAL] Re: Using fix gcmc without molecule insertion Thompson, Aidan
08:42 Re: [lammps-users] Rerunning an xtc file Axel Kohlmeyer
08:42 [lammps-users] (no subject) runak saedi
08:30 Re: [lammps-users] Rerunning an xtc file Liel Sapir
08:15 Re: [lammps-users] Rerunning an xtc file Axel Kohlmeyer
07:15 [lammps-users] Rerunning an xtc file Liel Sapir
06:41 Re: [lammps-users] Sph water_collapse Axel Kohlmeyer
06:37 Re: [lammps-users] Sph water_collapse Axel Kohlmeyer
06:35 Re: [lammps-users] How to limit the number of particles on the polymerization chain? Axel Kohlmeyer

May 17, 2020
22:13 [lammps-users] How to limit the number of particles on the polymerization chain? 默苍离
17:01 Re: [lammps-users] NaNs in dump; Langevin GJF flags compatible with finite-sized angular momentum thermostatting options? Axel Kohlmeyer
16:33 [lammps-users] NASA postdoc opportunities Lawson, John W. (ARC-TI)
16:28 Re: [lammps-users] NaNs in dump; Langevin GJF flags compatible with finite-sized angular momentum thermostatting options? Axel Kohlmeyer
16:15 Re: [lammps-users] Changing spring constant in each time step Axel Kohlmeyer
14:34 [lammps-users] NaNs in dump; Langevin GJF flags compatible with finite-sized angular momentum thermostatting options? Bergen, J.R.
14:22 Re: [lammps-users] Changing spring constant in each time step Sarthok Das
13:09 Re: [lammps-users] Changing spring constant in each time step Axel Kohlmeyer
12:49 [lammps-users] Changing spring constant in each time step Sarthok Das
11:27 Re: [lammps-users] Sph water_collapse Will Pisani
11:09 Re: [lammps-users] msi2lmp didnt take to account hydrogen improper Will Pisani
09:22 Re: [lammps-users] Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Axel Kohlmeyer
09:11 Re: [lammps-users] Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Axel Kohlmeyer
08:27 [lammps-users] Poor performance of Kokkos OpenMP for multi-core CPU (Skylake AVX 512) Prithwish Nandi
05:21 [lammps-users] msi2lmp didnt take to account hydrogen improper omid gh
05:17 Re: [lammps-users] dump with save bonds to show in vmd omid gh
03:50 Re: [lammps-users] dump with save bonds to show in vmd Axel Kohlmeyer

May 16, 2020
23:28 Re: [lammps-users] dump with save bonds to show in vmd omid gh
14:35 [lammps-users] Multiple Postdoc and PhD Open Positions in Polymer Modeling and Machine-Learning at University of Connecticut Ying Li
13:11 [lammps-users] Sph water_collapse Анна Яценко
13:03 Re: [lammps-users] How to define the total energy of the system? Axel Kohlmeyer
12:35 [lammps-users] kinetic energy per atom in rigid molecule loulijat hamid
08:40 Re: [lammps-users] dump with save bonds to show in vmd Axel Kohlmeyer
04:06 [lammps-users] How to define the total energy of the system? 默苍离
00:08 [lammps-users] dump with save bonds to show in vmd omid gh

May 15, 2020
16:47 Re: [lammps-users] Regarding to data.file combining and box dimension growing Axel Kohlmeyer
08:24 Re: [lammps-users] Regarding to data.file combining and box dimension growing Katerina Marino

May 14, 2020
23:06 Re: [lammps-users] improper definition in lammps omid gh
19:48 Re: [lammps-users] USER-INTEL package will generate an error if neighbor style nsq is used Wenqiang Liu
16:42 Re: [lammps-users] improper definition in lammps Andrew Jewett
15:30 Re: [lammps-users] Regarding to data.file combining and box dimension growing Andrew Jewett
12:39 [lammps-users] angle angle coeff unit omid gh
10:17 Re: [lammps-users] USER-INTEL package will generate an error if neighbor style nsq is used Axel Kohlmeyer
09:10 Re: [lammps-users] Regarding to data.file combining and box dimension growing Andrew Jewett
09:09 Re: [lammps-users] Regarding to data.file combining and box dimension growing Andrew Jewett
05:14 Re: [lammps-users] DPD wall crossability Katerina Marino
05:08 Re: [lammps-users] Regarding to data.file combining and box dimension growing Katerina Marino
04:19 [lammps-users] USER-INTEL package will generate an error if neighbor style nsq is used Wenqiang Liu
01:52 Re: [lammps-users] improper definition to lammps Will Pisani
00:43 [lammps-users] msi2lmp improper defining for ethylene carbonate omid gh

May 13, 2020
23:29 Re: [lammps-users] improper definition in lammps omid gh
23:20 Re: [lammps-users] dihedral_opls format Andrew Jewett
22:55 Re: [lammps-users] improper definition to lammps omid gh
19:50 Re: [lammps-users] improper definition to lammps Will Pisani
19:46 Re: [lammps-users] Regarding to data.file combining and box dimension growing Will Pisani
19:34 Re: [lammps-users] dihedral_opls format Shrabanti Bhattacharya
19:13 Re: [lammps-users] DPD wall crossability Will Pisani
19:00 Re: [lammps-users] improper definition to lammps Will Pisani
18:52 Re: [lammps-users] plot scatter of the positions of two type atoms Will Pisani
18:49 Re: [lammps-users] improper definition in lammps Will Pisani
18:31 Re: [lammps-users] Regarding to data.file combining and box dimension growing Andrew Jewett
18:13 Re: [lammps-users] dihedral_opls format Andrew Jewett
16:41 Re: [lammps-users] improper definition in lammps Andrew Jewett
16:20 Re: [lammps-users] Regarding to data.file combining and box dimension growing Axel Kohlmeyer
16:19 [lammps-users] DPD wall crossability Katerina Marino
15:46 [lammps-users] Regarding to data.file combining and box dimension growing Katerina Marino
11:46 [lammps-users] improper definition to lammps omid gh
11:14 Re: [lammps-users] plot scatter of the positions of two type atoms mohammad rezaei
10:29 [lammps-users] improper definition in lammps omid gh
09:41 [lammps-users] improper definition in lammps omid gh
09:18 Re: [lammps-users] plot scatter of the positions of two type atoms Giacomo Fiorin
09:05 [lammps-users] plot scatter of the positions of two type atoms mohammad rezaei
01:20 Re: [lammps-users] dihedral_opls format Germain CLAVIER

May 12, 2020
21:33 Re: [lammps-users] dihedral_opls format Andrew Jewett
20:32 Re: [lammps-users] Get errors when create molecules in a coarse-grained system Axel Kohlmeyer
19:59 [lammps-users] Get errors when create molecules in a coarse-grained system yuehu
18:43 [lammps-users] dihedral_opls format Shrabanti Bhattacharya
07:26 Re: [lammps-users] Setting mass from a normal distribution. Diljith T
06:18 Re: [lammps-users] Setting mass from a normal distribution. Axel Kohlmeyer
06:13 Re: [lammps-users] Modify pressure in fix NPT using per group pressure Axel Kohlmeyer
06:03 Re: [lammps-users] Get errors when create molecules in a coarse-grained system Axel Kohlmeyer
05:59 Re: [lammps-users] Modifying pair_style gran/hooke Axel Kohlmeyer
04:53 Re: [lammps-users] Issue with reax/c/species command global vectors Kritikos, Efstratios
04:27 [lammps-users] Setting mass from a normal distribution. Diljith T
03:11 Re: [lammps-users] Modify pressure in fix NPT using per group pressure jyotishraj thoudam
03:00 [lammps-users] Get errors when create molecules in a coarse-grained system yuehu
00:16 [lammps-users] Modifying pair_style gran/hooke habib rahbari

May 11, 2020
20:01 Re: [lammps-users] Membrane Axel Kohlmeyer
19:48 Re: [lammps-users] Membrane Andrew Jewett
18:54 Re: [lammps-users] Computer parts for simulations Axel Kohlmeyer
18:50 Re: [lammps-users] Membrane shahriar dadras
18:35 Re: [lammps-users] Membrane Axel Kohlmeyer
18:11 Re: [lammps-users] Membrane Andrew Jewett
18:09 Re: [lammps-users] Membrane shahriar dadras
17:59 Re: [lammps-users] Membrane Andrew Jewett
17:56 Re: [lammps-users] Membrane shahriar dadras
17:54 Re: [lammps-users] Membrane Andrew Jewett
17:34 Re: [lammps-users] Membrane shahriar dadras
17:25 Re: [lammps-users] Membrane Andrew Jewett
17:03 Re: [lammps-users] Membrane shahriar dadras
16:44 Re: [lammps-users] Membrane Andrew Jewett
15:05 Re: [lammps-users] Computer parts for simulations Giacomo Fiorin
13:28 [lammps-users] Computer parts for simulations Александра Александровна Ларина
12:42 Re: [lammps-users] Membrane shahriar dadras
11:10 Re: [lammps-users] Membrane shahriar dadras
10:31 Re: [lammps-users] Membrane Andrew Jewett
10:10 Re: [lammps-users] Membrane Axel Kohlmeyer
09:20 Re: [lammps-users] How do I do this? Bahman Ghiassi
08:40 Re: [lammps-users] Rebuild lammps Hao Zhu
08:38 Re: [lammps-users] mix arithmatic omid gh
08:37 Re: [lammps-users] mix arithmatic Axel Kohlmeyer
08:32 [lammps-users] mix arithmatic omid gh
06:56 Re: [lammps-users] Membrane shahriar dadras
05:55 Re: [lammps-users] Rebuild lammps Axel Kohlmeyer
05:47 Re: [lammps-users] Membrane Axel Kohlmeyer
05:41 Re: [lammps-users] ERROR on proc 0: Shake determinant = 0.0 (../fix_shake.cpp:2315) Axel Kohlmeyer
05:29 Re: [lammps-users] Is LAMMPS forum is still active? Axel Kohlmeyer
05:27 Re: [lammps-users] about reaxFF Pascal Brault
04:51 Re: [lammps-users] about reaxFF Axel Kohlmeyer
04:33 Re: [lammps-users] Problem in running Lammps on cluster server Axel Kohlmeyer
03:19 [lammps-users] about reaxFF Pascal Brault
02:50 Re: [lammps-users] Read restartfiles Kalthoff, Benedikt Johannes
02:42 [lammps-users] Problem in running Lammps on cluster server shahin mohamadnejad
01:45 [lammps-users] Is LAMMPS forum is still active? bahman daneshian

May 10, 2020
16:32 Re: [lammps-users] Using fix gcmc without molecule insertion Matias Factorovich
13:35 [lammps-users] ERROR on proc 0: Shake determinant = 0.0 (../fix_shake.cpp:2315) Merdan Batyrow
12:27 Re: [lammps-users] Rebuild lammps Hao Zhu
12:21 Re: [lammps-users] Rebuild lammps Anders Hafreager
10:58 [lammps-users] Membrane Laminate Ink
08:25 Re: [lammps-users] Tersoff and lj/cut/coul/long cross interactions Chamara Somarathna
07:48 Re: [lammps-users] Tersoff and lj/cut/coul/long cross interactions Axel Kohlmeyer
07:26 [lammps-users] Tersoff and lj/cut/coul/long cross interactions Chamara Somarathna

May 09, 2020
21:40 Re: [lammps-users] Rebuild lammps Will Pisani
20:33 [lammps-users] Rebuild lammps Hao Zhu
18:49 Re: [lammps-users] Creating a prism region Axel Kohlmeyer
18:02 [lammps-users] Creating a prism region Mahdi Bagheripoor
15:09 Re: [lammps-users] ERROR: Unknown pair style (../force.cpp:190) Axel Kohlmeyer
13:19 [lammps-users] ERROR: Unknown pair style (../force.cpp:190) Odedeyi, Peter, (Mr) (s215391292)
10:47 Re: [lammps-users] Read restartfiles Axel Kohlmeyer
10:27 Re: [lammps-users] Read restartfiles Kalthoff, Benedikt Johannes
08:32 Re: [lammps-users] integrated heat flux diverging Noam Bernstein
07:25 Re: [lammps-users] Using fix gcmc without molecule insertion Axel Kohlmeyer
07:07 Re: [lammps-users] How do I do this? Steve Plimpton
07:04 Re: [lammps-users] Using fix gcmc without molecule insertion Gaurab Sarkar
06:59 Re: [lammps-users] Hyper_dynamics and box_change Steve Plimpton

May 08, 2020
20:16 Re: [lammps-users] Using fix gcmc without molecule insertion Axel Kohlmeyer
18:08 [lammps-users] Using fix gcmc without molecule insertion Gaurab Sarkar
13:54 Re: [lammps-users] ERROR: " Expected floating point parameter instead of '−0.2106' in input script or data file" Axel Kohlmeyer
13:11 [lammps-users] ERROR: " Expected floating point parameter instead of '−0.2106' in input script or data file" J Pundarikaksha Kavipurapu
11:49 Re: [lammps-users] Read restartfiles Axel Kohlmeyer
10:19 Re: [lammps-users] Pair_style meam/c Sebastian Hütter
10:01 [lammps-users] Postdoc opening doing machine learning and atomistic simulations of grain boundaries Eric Homer
09:53 Re: [lammps-users] Read restartfiles Kalthoff, Benedikt Johannes
09:10 Re: [lammps-users] Pair_style meam/c Sandeep Kumar Singh
09:04 [lammps-users] Using fix gcmc without molecule insertion Gaurab Sarkar
08:54 Re: [lammps-users] How do I do this? Axel Kohlmeyer
08:43 [lammps-users] Pair_style meam/c bahman daneshian
07:38 Re: [lammps-users] How do I do this? Bahman Ghiassi
07:01 Re: [lammps-users] How do I do this? Axel Kohlmeyer
06:28 Re: [lammps-users] Read restartfiles Axel Kohlmeyer
05:57 [lammps-users] Read restartfiles Kalthoff, Benedikt Johannes
05:10 [lammps-users] How do I do this? Bahman Ghiassi
01:28 Re: [lammps-users] angle harmonic with large angles Roberto Guerra

May 07, 2020
12:50 Re: [lammps-users] angle harmonic with large angles Andrew Jewett
12:24 Re: [lammps-users] angle harmonic with large angles Axel Kohlmeyer
12:13 Re: [lammps-users] About nvt system explosion Axel Kohlmeyer
10:46 Re: [lammps-users] pair_style hybrid/overlay with reax/c and lj/cut/coul/long Will Pisani
10:14 Re: [lammps-users] About nvt system explosion Will Pisani
10:09 Re: [lammps-users] angle harmonic with large angles Roberto Guerra
09:45 [lammps-users] About nvt system explosion 陳弘儒
08:50 [lammps-users] Non-numeric pressure-simulation unstable guanguan
06:08 Re: [lammps-users] write restart out-of-memory Haidong Fan_SCU
05:28 Re: [lammps-users] Atoms won't move even though fixes are defined Vancouver Johnson
04:36 [lammps-users] angle harmonic with large angles Roberto Guerra
04:17 Re: [lammps-users] write restart out-of-memory Axel Kohlmeyer
03:36 [lammps-users] write restart out-of-memory Haidong Fan_SCU
01:28 [lammps-users] pair_modify in hbond/dreiding/lj Mina Sedighi
01:07 Re: [lammps-users] pair_style hybrid/overlay with reax/c and lj/cut/coul/long Mina Sedighi

May 06, 2020
13:54 Re: [lammps-users] Compute used in variable between runs is not current Axel Kohlmeyer
13:47 Re: [lammps-users] Compute used in variable between runs is not current Vishnu V. Krishnan
13:33 Re: [lammps-users] Compute used in variable between runs is not current Axel Kohlmeyer
13:25 Re: [lammps-users] Compute used in variable between runs is not current Vishnu V. Krishnan
12:12 Re: [lammps-users] Compute used in variable between runs is not current Axel Kohlmeyer
12:03 [lammps-users] Compute used in variable between runs is not current Vishnu V. Krishnan
10:54 Re: [lammps-users] pair_style hybrid/overlay with reax/c and lj/cut/coul/long Axel Kohlmeyer
10:45 Re: [lammps-users] pair_style hybrid/overlay with reax/c and lj/cut/coul/long Mina Sedighi
08:24 Re: [lammps-users] Atoms won't move even though fixes are defined Piskulich, Ezekiel Ashe
07:38 Re: [lammps-users] pair_style hybrid/overlay with reax/c and lj/cut/coul/long Axel Kohlmeyer
07:27 Re: [lammps-users] Atoms won't move even though fixes are defined Axel Kohlmeyer
06:11 [lammps-users] Atoms won't move even though fixes are defined Vancouver Johnson
02:29 [lammps-users] pair_style hybrid/overlay with reax/c and lj/cut/coul/long Mina Sedighi

May 05, 2020
23:11 Re: [lammps-users] pizza issue togl K. M. Rifat Faysal
16:18 Re: [lammps-users] pizza issue togl K. M. Rifat Faysal
16:10 Re: [lammps-users] pizza issue togl Will Pisani
15:30 Re: [lammps-users] pizza issue togl Axel Kohlmeyer
15:25 Re: [lammps-users] pizza issue togl K. M. Rifat Faysal
10:44 Re: [lammps-users] pizza issue togl Axel Kohlmeyer
09:47 [lammps-users] Hyper_dynamics and box_change Li, Huyan (li2h9)
07:07 [lammps-users] pizza issue togl K. M. Rifat Faysal
07:01 Re: [lammps-users] About pair coeff set Axel Kohlmeyer
06:53 [lammps-users] About pair coeff set 陳弘儒
06:44 Re: [lammps-users] integrated heat flux diverging Axel Kohlmeyer
06:20 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Axel Kohlmeyer

May 04, 2020
15:07 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Vrindaa Somjit
13:27 Re: [lammps-users] Question about fix AtC Ali shargh
13:13 Re: [lammps-users] Question about fix AtC Axel Kohlmeyer
13:10 Re: [lammps-users] Modify pressure in fix NPT using per group pressure Axel Kohlmeyer
13:06 [lammps-users] Question about fix AtC Ali shargh
10:45 Re: [lammps-users] Building LAMMPS with USER-INTEL for Knights Landing (Xeon Phi) Axel Kohlmeyer
10:25 [lammps-users] Building LAMMPS with USER-INTEL for Knights Landing (Xeon Phi) Lars Veldscholte
09:37 Re: [lammps-users] core-shell model problem Raghvender .
09:13 [lammps-users] integrated heat flux diverging Noam Bernstein
09:10 Re: [lammps-users] "Bond atoms 4549 4550 missing on proc 0 at step 42 Axel Kohlmeyer
08:30 [lammps-users] "Bond atoms 4549 4550 missing on proc 0 at step 42 Theresa
08:24 [lammps-users] Bond atoms 4549 4550 missing on proc 0 at step 42 Theresa
05:30 [lammps-users] Modify pressure in fix NPT using per group pressure jyotishraj thoudam
05:29 [lammps-users] PhD in Molecular Tribology: Computation and Experiment James Ewen

May 03, 2020
22:40 Re: [lammps-users] core-shell model problem Axel Kohlmeyer
22:35 Re: [lammps-users] meam/ all pair coeffs are not set Axel Kohlmeyer
19:12 [lammps-users] meam/ all pair coeffs are not set nrs800
11:22 [lammps-users] core-shell model problem Raghvender .

May 02, 2020
18:06 Re: [lammps-users] Granular ensembles Axel Kohlmeyer
17:54 Re: [lammps-users] [LAMMPS] - Assign charge between atoms Emerson Parazzi Lyra
17:39 Re: [lammps-users] Granular ensembles Ana Moreno
17:28 Re: [lammps-users] count number of atom by variable region Axel Kohlmeyer
17:25 Re: [lammps-users] [LAMMPS] - Assign charge between atoms Axel Kohlmeyer
16:30 Re: [lammps-users] Granular ensembles Axel Kohlmeyer
16:19 Re: [lammps-users] [LAMMPS] - Assign charge between atoms Axel Kohlmeyer
16:13 [lammps-users] count number of atom by variable region mohammad rezaei
15:24 [lammps-users] Granular ensembles Ana Moreno
12:59 Re: [lammps-users] Charmm Laminate Ink
11:56 [lammps-users] [LAMMPS] - Assign charge between atoms Emerson Parazzi Lyra
08:21 Re: [lammps-users] Linker error on AMD GPU Haidong Fan_SCU
04:39 Re: [lammps-users] 【rangefinder.x】shows an Error : free(): invalid pointer Aborted (core dumped) Axel Kohlmeyer
04:37 Re: [lammps-users] UPDATE Linker error on AMD GPU Axel Kohlmeyer
04:34 Re: [lammps-users] Linker error on AMD GPU Axel Kohlmeyer
04:11 [lammps-users] 【rangefinder.x】shows an Error : free(): invalid pointer Aborted (core dumped) Wang Dongze
01:47 [lammps-users] UPDATE Linker error on AMD GPU Haidong Fan_SCU
00:15 [lammps-users] Linker error on AMD GPU Haidong Fan_SCU

May 01, 2020
21:33 Re: [lammps-users] fix for damped dynamics ? Axel Kohlmeyer
16:22 Re: [lammps-users] Recomputing a whole trajectory with a different potential Caro Miguel
16:18 Re: [lammps-users] Recomputing a whole trajectory with a different potential Axel Kohlmeyer
14:59 [lammps-users] Recomputing a whole trajectory with a different potential Caro Miguel
06:56 Re: [lammps-users] Lost atom error during optimisation Axel Kohlmeyer
05:54 [lammps-users] Lost atom error during optimisation Dong gi Kang
04:27 [lammps-users] Charmm Laminate Ink
04:23 [lammps-users] Charmm Laminate Ink
02:42 [lammps-users] fix for damped dynamics ? Olivier Politano

April 30, 2020
20:56 Re: [lammps-users] Bonds defined but no bond types Axel Kohlmeyer
20:24 [lammps-users] Bonds defined but no bond types Theresa
18:55 Re: [lammps-users] MPI error with create_atoms? Axel Kohlmeyer
17:11 [lammps-users] MPI error with create_atoms? Filip Simeski
14:59 Re: [lammps-users] Compute chunk com with wrapped coordinates? Axel Kohlmeyer
01:49 [lammps-users] Compute chunk com with wrapped coordinates? Jianlan Ye

April 29, 2020
17:48 [lammps-users] Charmm2lammps shahriar dadras
11:43 Re: [lammps-users] [EXTERNAL] Re: Atomic stress distribution Ali shargh
11:05 Re: [lammps-users] [EXTERNAL] Re: Atomic stress distribution Thompson, Aidan
10:43 Re: [lammps-users] Atomic stress distribution Giacomo Fiorin
10:23 [lammps-users] NVE ensemble Temp instability in tersoff SiO2 Chamara Somarathna
02:02 [lammps-users] deform or change_box modify atomic coordinates also with remap none Roberto Guerra

April 28, 2020
17:26 Re: [lammps-users] [EXTERNAL] Restart file shahriar dadras
16:53 Re: [lammps-users] [EXTERNAL] Restart file Jones, Keith
15:58 [lammps-users] Restart file shahriar dadras
14:31 Re: [lammps-users] Questions on Compiling LAMMPS Axel Kohlmeyer
13:54 Re: [lammps-users] Questions on Compiling LAMMPS Ernesto Barraza
10:35 Re: [lammps-users] Questions on Compiling LAMMPS Axel Kohlmeyer
10:19 Re: [lammps-users] Questions on Compiling LAMMPS Axel Kohlmeyer
10:10 Re: [lammps-users] Questions on Compiling LAMMPS Ernesto Barraza
09:33 [lammps-users] Questions on Compiling LAMMPS Ernesto Barraza
04:40 Re: [lammps-users] Creating Bonds Anish Sukumar
03:06 Re: [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Axel Kohlmeyer
01:51 Re: [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Roberto Guerra

April 27, 2020
13:52 [lammps-users] Atomic stress distribution Ali shargh
11:09 Re: [lammps-users] Entropy Calculation in Lammps Sandeep Kumar Singh
10:55 Re: [lammps-users] Entropy Calculation in Lammps Axel Kohlmeyer
10:45 Re: [lammps-users] Entropy Calculation in Lammps Will Pisani
10:45 Re: [lammps-users] Entropy Calculation in Lammps Sandeep Kumar Singh
10:41 Re: [lammps-users] Entropy Calculation in Lammps Axel Kohlmeyer
10:34 Re: [lammps-users] Entropy Calculation in Lammps Sandeep Kumar Singh
10:16 Re: [lammps-users] Entropy Calculation in Lammps Will Pisani
10:09 Re: [lammps-users] Entropy Calculation in Lammps Sandeep Kumar Singh
09:49 Re: [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Axel Kohlmeyer
09:41 Re: [lammps-users] fix rigid Axel Kohlmeyer
09:40 Re: [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Roberto Guerra
09:39 Re: [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Roberto Guerra
09:34 Re: [lammps-users] Creating Bonds Axel Kohlmeyer
09:33 Re: [lammps-users] Entropy Calculation in Lammps Will Pisani
09:28 Re: [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Axel Kohlmeyer
09:27 Re: [lammps-users] Creating Bonds Will Pisani
06:51 [lammps-users] com evaluated by com_chunks and by fix_rigid are not the same Roberto Guerra
06:01 Re: [lammps-users] fix rigid loulijat hamid
03:30 [lammps-users] fix rigid Theresa
03:22 [lammps-users] Entropy Calculation in Lammps Sandeep Kumar Singh

April 26, 2020
23:22 [lammps-users] Creating Bonds Anish Sukumar
07:46 Re: [lammps-users] cff93 forcefield short of parameters omid gh
05:09 Re: [lammps-users] cff93 forcefield short of parameters Axel Kohlmeyer
04:39 [lammps-users] cff93 forcefield short of parameters omid gh
00:56 Re: [lammps-users] cff93 forcefield in lammps Will Pisani
00:33 Re: [lammps-users] Unknown compute style entropy/atom Sandeep Kumar Singh

April 25, 2020
23:45 [lammps-users] Hyperdynamics ness smart
23:33 [lammps-users] cff93 forcefield in lammps omid gh
01:17 Re: [lammps-users] Fwd: Adupa Vasista
01:05 Re: [lammps-users] Fwd: Nicolas Leconte

April 24, 2020
21:36 Re: [lammps-users] Fwd: Axel Kohlmeyer
21:19 Re: [lammps-users] Fwd: Adupa Vasista
19:18 Re: [lammps-users] Fwd: Axel Kohlmeyer
14:08 [lammps-users] Fwd: Adupa Vasista
09:55 Re: [lammps-users] How to achieve pressure difference in DPD? Giacomo Fiorin
09:06 [lammps-users] How to achieve pressure difference in DPD? 默苍离

April 23, 2020
22:39 Re: [lammps-users] dihedral function format omid gh
17:32 Re: [lammps-users] ERROR: Numeric index is out of bounds::LAMMPS (16 Mar 2018) Shrabanti Bhattacharya
16:33 Re: [lammps-users] dihedral function format Andrew Jewett
16:25 Re: [lammps-users] Fix smd Axel Kohlmeyer
16:12 Re: [lammps-users] Fix smd shahriar dadras
15:26 Re: [lammps-users] Seeking advise in modelling an inclusion inside Ni Axel Kohlmeyer
15:21 Re: [lammps-users] Seeking advise in modelling an inclusion inside Ni Tung Yan Liu
15:11 Re: [lammps-users] Fix smd Axel Kohlmeyer
12:49 Re: [lammps-users] Fix smd shahriar dadras
12:34 Re: [lammps-users] Fix smd Axel Kohlmeyer
12:33 Re: [lammps-users] Fix smd Giacomo Fiorin
12:32 Re: [lammps-users] conservation of energy: checking time step in irradiation simulation Morrissey, Liam S.
12:17 Re: [lammps-users] conservation of energy: checking time step in irradiation simulation Thomas Leps
11:48 [lammps-users] Fix smd Laminate Ink
11:01 [lammps-users] conservation of energy: checking time step in irradiation simulation Morrissey, Liam S.
08:48 Re: [lammps-users] ERROR: Numeric index is out of bounds::LAMMPS (16 Mar 2018) Axel Kohlmeyer
08:30 [lammps-users] ERROR: Numeric index is out of bounds::LAMMPS (16 Mar 2018) Shrabanti Bhattacharya
06:09 Re: [lammps-users] BN parameters for ReaxxFF vivek nani
05:47 Re: [lammps-users] BN parameters for ReaxxFF vivek nani
05:46 Re: [lammps-users] BN parameters for ReaxxFF Axel Kohlmeyer
05:36 Re: [lammps-users] BN parameters for ReaxxFF vivek nani
05:18 Re: [lammps-users] BN parameters for ReaxxFF Axel Kohlmeyer
02:49 Re: [lammps-users] Temperature from vx, vy, vz profiles (ave/chunk) F Hssn
01:21 [lammps-users] BN parameters for ReaxxFF vivek nani

April 22, 2020
15:10 [lammps-users] Temperature from vx, vy, vz profiles (ave/chunk) F Hssn
13:14 Re: [lammps-users] dihedral function format omid gh
12:57 Re: [lammps-users] dihedral function format Axel Kohlmeyer
12:26 Re: [lammps-users] dihedral function format omid gh
11:54 Re: [lammps-users] dihedral function format Axel Kohlmeyer
11:38 [lammps-users] dihedral function format omid gh
10:16 Re: [lammps-users] about usage of centroid/stress/atom Axel Kohlmeyer
09:54 Re: [lammps-users] about usage of centroid/stress/atom Victor Nazarychev
06:11 Re: [lammps-users] variable style and fix heat Axel Kohlmeyer
04:11 [lammps-users] variable style and fix heat Xie J.W.
03:44 Re: [lammps-users] Combining 'fix bond/react' and 'if' Verestek, Wolfgang

April 21, 2020
21:19 Re: [lammps-users] (no subject) Adupa Vasista
17:24 Re: [lammps-users] Combining 'fix bond/react' and 'if' Jacob Gissinger
14:17 Re: [lammps-users] (no subject) Axel Kohlmeyer
14:14 Re: [lammps-users] (no subject) Gideon Lyngdoh
13:52 [lammps-users] Adding Velocities From Python via fix python/invoke Yilmaz, Dundar
12:53 [lammps-users] (no subject) Adupa Vasista
11:08 [lammps-users] Adding Velocities from Python Script Yilmaz, Dundar
10:32 Re: [lammps-users] about usage of centroid/stress/atom Axel Kohlmeyer
10:01 [lammps-users] about usage of centroid/stress/atom Victor Nazarychev
06:09 Re: [lammps-users] random structure optimization stops after 3rd step Axel Kohlmeyer
06:06 Re: [lammps-users] random structure optimization stops after 3rd step Giacomo Fiorin
05:50 [lammps-users] random structure optimization stops after 3rd step Science is the solution
04:59 Re: [lammps-users] RPM(reflecting particle membrane) Axel Kohlmeyer
04:42 [lammps-users] RPM(reflecting particle membrane) peiyuzhang
04:12 [lammps-users] (no subject) sedigheh mousanezhad
02:40 Re: [lammps-users] modify random_park Movaffaq Kateb
01:34 Re: [lammps-users] Combining 'fix bond/react' and 'if' Verestek, Wolfgang
00:28 Re: [lammps-users] Combining 'fix bond/react' and 'if' command in LAMMPS Andrew Jewett

April 20, 2020
17:27 Re: [lammps-users] LAMMPS BLAS Benchmark Axel Kohlmeyer
16:29 [lammps-users] Meaning of k-space vectors in ewald summation? Anne B
16:28 Re: [lammps-users] modify random_park Axel Kohlmeyer
16:18 Re: [lammps-users] Combining 'fix bond/react' and 'if' command in LAMMPS Jacob Gissinger
15:42 [lammps-users] modify random_park Movaffaq Kateb
14:42 Re: [lammps-users] Combining 'fix bond/react' and 'if' command in LAMMPS Axel Kohlmeyer
13:00 [lammps-users] Combining 'fix bond/react' and 'if' command in LAMMPS Adam, Brian
12:27 [lammps-users] controlling incidence angle in fix deposit and tracking sputter angles Carly Johnson
10:23 Re: [lammps-users] ERROR on proc 0: All pair coeffs are not set Axel Kohlmeyer
10:09 [lammps-users] ERROR on proc 0: All pair coeffs are not set 18817075150
09:12 [lammps-users] LAMMPS BLAS Benchmark Harry Waugh
07:38 Re: [lammps-users] minimize Axel Kohlmeyer
07:37 Re: [lammps-users] Fix SMD Axel Kohlmeyer
07:34 [lammps-users] minimize guanguan
07:04 Re: [lammps-users] Fix SMD Axel Kohlmeyer
06:54 [lammps-users] Fix SMD Mahdi Tavakol
06:39 [lammps-users] Fix SMD Mahdi Tavakol
06:13 Re: [lammps-users] ERROR: Expected integer parameter in input script or data file Axel Kohlmeyer
06:09 [lammps-users] ERROR: Expected integer parameter in input script or data file 18817075150
06:06 [lammps-users] ERROR: Expected integer parameter in input script or data file 18817075150

April 19, 2020
21:14 Re: [lammps-users] Funny output from temp/profile with SHAKE Axel Kohlmeyer
20:51 [lammps-users] Funny output from temp/profile with SHAKE Shern Tee
04:08 Re: [lammps-users] best book for statistical mechanics Germain CLAVIER

April 18, 2020
22:26 Re: [lammps-users] best book for statistical mechanics omid gh
15:37 [lammps-users] compute inner pressure and elastic membrane force ankit agrawal
13:15 Re: [lammps-users] best book for statistical mechanics Axel Kohlmeyer
12:12 Re: [lammps-users] Questions on fix qeq/point code structure Anne B
11:53 Re: [lammps-users] Questions on fix qeq/point code structure Axel Kohlmeyer
11:51 [lammps-users] How to define customized pair potential function Arunjyoti sinha roy
11:46 [lammps-users] Questions on fix qeq/point code structure Anne B
11:45 Re: [lammps-users] Writing time-averaged per-chunk data (spread per-atom) to a dump-file Axel Kohlmeyer
11:38 [lammps-users] best book for statistical mechanics omid gh
11:09 Re: [lammps-users] How to define customized pair potential function Axel Kohlmeyer
10:54 Re: [lammps-users] tensile deformation on Al 7075 santhosh mathesan
10:39 Re: [lammps-users] about simulation combine after different process do Axel Kohlmeyer
05:59 [lammps-users] tensile deformation on Al 7075 isra muscati

April 17, 2020
21:27 [lammps-users] about simulation combine after different process do 陳弘儒
14:30 [lammps-users] Writing time-averaged per-chunk data (spread per-atom) to a dump-file Никольский Всеволод Павлович
10:28 Re: [lammps-users] gcmc of the flow of water Axel Kohlmeyer
09:14 [lammps-users] gcmc of the flow of water 18817075150
05:02 Re: [lammps-users] compute orientorder/atom cutoff Axel Kohlmeyer
02:38 [lammps-users] compute orientorder/atom cutoff Abdullah Alateeqi
01:33 Re: [lammps-users] cff93 omid gh

April 16, 2020
17:43 Re: [lammps-users] Seeking advise in modelling an inclusion inside Ni Axel Kohlmeyer
15:40 [lammps-users] Seeking advise in modelling an inclusion inside Ni Tung Yan Liu
14:58 Re: [lammps-users] Plotting embedding and pair interaction energies for MEAM Axel Kohlmeyer
11:59 Re: [lammps-users] [EXTERNAL] Re: Question about global and peratom stress parameters Thompson, Aidan
11:52 Re: [lammps-users] Question about global and peratom stress parameters Ali shargh
11:50 [lammps-users] Plotting embedding and pair interaction energies for MEAM Praveenkumar Hiremath
11:42 Re: [lammps-users] Question about global and peratom stress parameters Axel Kohlmeyer
11:31 Re: [lammps-users] Question about global and peratom stress parameters Ali shargh
11:04 Re: [lammps-users] Question about global and peratom stress parameters Axel Kohlmeyer
10:59 Re: [lammps-users] Is it possible to build a custom force field Axel Kohlmeyer
10:57 Re: [lammps-users] Question about global and peratom stress parameters Ali shargh
10:56 Re: [lammps-users] Question about global and peratom stress parameters Axel Kohlmeyer
10:51 Re: [lammps-users] cff93 Axel Kohlmeyer
10:10 [lammps-users] cff93 omid gh
10:06 [lammps-users] Question about global and peratom stress parameters Ali shargh
07:36 [lammps-users] Is it possible to build a custom force field J Pundarikaksha Kavipurapu
05:37 Re: [lammps-users] What would be best water model to simulate moist N2? Axel Kohlmeyer
05:10 [lammps-users] What would be best water model to simulate moist N2? Bhanuday Sharma

April 15, 2020
17:45 [lammps-users] Reminder: new patch release 15 April 2020 needs updates to custom makefiles Axel Kohlmeyer
12:41 Re: [lammps-users] No Permanent Deformation Axel Kohlmeyer
11:57 Re: [lammps-users] Aluminum/Nickel/Oxygen force field Ray Shan
11:15 [lammps-users] No Permanent Deformation Chionye Okwuashi
08:05 Re: [lammps-users] Water H epsilon must be 0.0 for pair style lj/cut/tip4p/long Axel Kohlmeyer
07:57 [lammps-users] Water H epsilon must be 0.0 for pair style lj/cut/tip4p/long guanguan
07:03 Re: [lammps-users] Aluminum/Nickel/Oxygen force field Axel Kohlmeyer
06:42 Re: [lammps-users] NVE integration for remaining atoms in a simulation with region-specific thermostat Axel Kohlmeyer
06:35 Re: [lammps-users] fix rigid Axel Kohlmeyer
06:35 [lammps-users] Aluminum/Nickel/Oxygen force field Ensieh Yousefi
06:21 Re: [lammps-users] fix rigid sh dj
06:17 Re: [lammps-users] fix rigid Axel Kohlmeyer
06:12 [lammps-users] fix rigid sh dj
06:01 [lammps-users] NVE integration for remaining atoms in a simulation with region-specific thermostat F Hssn
04:49 Re: [lammps-users] about usage of centroid/stress/atom Axel Kohlmeyer
04:44 Re: [lammps-users] Ice not melting - TIP4P/Ice Sorensen, Tor
04:41 [lammps-users] about usage of centroid/stress/atom 王云鹏
04:34 Re: [lammps-users] Ice not melting - TIP4P/Ice Axel Kohlmeyer
04:06 Re: [lammps-users] Ice not melting - TIP4P/Ice Sorensen, Tor
03:29 Re: [lammps-users] Ice not melting - TIP4P/Ice Axel Kohlmeyer
02:42 [lammps-users] Ice not melting - TIP4P/Ice Sorensen, Tor
01:31 [lammps-users] units in centro/atom command Ευάγγελος Βογιατζής

April 14, 2020
15:23 Re: [lammps-users] temperature in NVT Jun Li
15:20 Re: [lammps-users] temperature in NVT Chowdhury, Sanjib
15:15 Re: [lammps-users] temperature in NVT Jun Li
15:13 Re: [lammps-users] temperature in NVT Chowdhury, Sanjib
15:02 [lammps-users] temperature in NVT Jun Li
12:05 Re: [lammps-users] Regarding using a partially rigid molecule: LAMMPS (7 Aug 2019) Axel Kohlmeyer
12:01 Re: [lammps-users] Regarding using a partially rigid molecule: LAMMPS (7 Aug 2019) Rameswar Bhattacharjee
11:53 Re: [lammps-users] Regarding using a partially rigid molecule: LAMMPS (7 Aug 2019) Axel Kohlmeyer
10:57 [lammps-users] Regarding using a partially rigid molecule: LAMMPS (7 Aug 2019) Rameswar Bhattacharjee
04:15 Re: [lammps-users] fix nvt/rigid Axel Kohlmeyer
02:25 Re: [lammps-users] fix nvt/rigid shahriar dadras

April 13, 2020
17:14 Re: [lammps-users] fix nvt/rigid Axel Kohlmeyer
17:03 [lammps-users] fix nvt/rigid shahriar dadras
16:24 Re: [lammps-users] fix rigid/nvt Axel Kohlmeyer
15:55 [lammps-users] fix rigid/nvt shahriar dadras
14:50 Re: [lammps-users] Particle strengthening simulation error Axel Kohlmeyer
14:37 [lammps-users] Particle strengthening simulation error Ankit Roy
13:57 Re: [lammps-users] Invoking force_clear() from a fix? Axel Kohlmeyer
13:25 Re: [lammps-users] Invoking force_clear() from a fix? Anne B
13:03 Re: [lammps-users] Invoking force_clear() from a fix? Axel Kohlmeyer
12:57 Re: [lammps-users] Amorphous SiO2 Unstable system Chowdhury, Sanjib
12:30 Re: [lammps-users] Invoking force_clear() from a fix? Anne B
11:34 Re: [lammps-users] Invoking force_clear() from a fix? Axel Kohlmeyer
11:32 Re: [lammps-users] Invoking force_clear() from a fix? Diaz,Adrian
11:19 Re: [lammps-users] Invoking force_clear() from a fix? Anne B
09:27 Re: [lammps-users] Use fix indent to bend a beam Axel Kohlmeyer
07:00 [lammps-users] Amorphous SiO2 Unstable system Chamara Somarathna
05:19 [lammps-users] plot the potential fields for each coordinate mohammad rezaei
02:35 [lammps-users] Use fix indent to bend a beam luohubin@...9088...
00:06 Re: [lammps-users] water8000 omid gh

April 12, 2020
23:41 [lammps-users] water8000 guanguan
23:04 Re: [lammps-users] Invoking force_clear() from a fix? Diaz,Adrian
22:52 [lammps-users] Invoking force_clear() from a fix? Anne B
20:53 Re: [lammps-users] running error "MPI_ABORT" liyi bai
16:10 Re: [lammps-users] Problem with temperature in NVT Jun Li
15:51 Re: [lammps-users] Problem with temperature in NVT Axel Kohlmeyer
15:43 [lammps-users] Problem with temperature in NVT Jun Li
14:09 [lammps-users] Postdoc position PANIA NEWELL
08:28 Re: [lammps-users] Force field selection Axel Kohlmeyer
08:22 Re: [lammps-users] rigid/nvt Axel Kohlmeyer
08:20 Re: [lammps-users] running error "MPI_ABORT" Axel Kohlmeyer
02:44 [lammps-users] Force field selection zhanganying
01:54 [lammps-users] running error "MPI_ABORT" liyi bai
01:43 Re: [lammps-users] make data file for Hydroxylated SiO2 tip liyi bai

April 11, 2020
13:51 Re: [lammps-users] make data file for Hydroxylated SiO2 tip Andrew Jewett
09:47 [lammps-users] rigid/nvt shahriar dadras
07:36 Re: [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? Giacomo Fiorin
06:23 [lammps-users] 回复: the total momentum is not zero ZHANG zhang
06:01 Re: [lammps-users] the total momentum is not zero Axel Kohlmeyer
03:32 Re: [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? O Drecun
02:08 [lammps-users] 回复: the total momentum is not zero ZHANG zhang
00:29 Re: [lammps-users] cross terms writing in Axel Kohlmeyer
00:24 [lammps-users] cross terms writing in omid gh

April 10, 2020
20:49 Re: [lammps-users] make data file for Hydroxylated SiO2 tip Axel Kohlmeyer
20:36 Re: [lammps-users] make data file for Hydroxylated SiO2 tip liyi bai
15:49 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Vrindaa Somjit
10:01 Re: [lammps-users] make data file for Hydroxylated SiO2 tip Andrew Jewett
09:40 Re: [lammps-users] Recommendation for molecular motors in LAMMPS? Andrew Jewett
09:05 Re: [lammps-users] make data file for Hydroxylated SiO2 tip Andrew Jewett
09:05 Re: [lammps-users] the total momentum is not zero Axel Kohlmeyer
08:56 Re: [lammps-users] make data file for Hydroxylated SiO2 tip Axel Kohlmeyer
08:53 Re: [lammps-users] Error when compiling USER-OMP package Axel Kohlmeyer
08:36 [lammps-users] Error when compiling USER-OMP package Cao Thang, Nguyen
08:29 [lammps-users] make data file for Hydroxylated SiO2 tip liyi bai
03:39 [lammps-users] the total momentum is not zero da zhang
02:20 Re: [lammps-users] lennard jones cut off bahman daneshian

April 09, 2020
10:24 Re: [lammps-users] ERROR: Fix ave/time compute does not calculate a vector Axel Kohlmeyer
09:19 [lammps-users] ERROR: Fix ave/time compute does not calculate a vector Nahid Khiabani
07:23 Re: [lammps-users] pair_style cosine/squared Alessio Alexiadis
07:22 Re: [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? Giacomo Fiorin
07:19 Re: [lammps-users] pair_style cosine/squared Axel Kohlmeyer
07:17 Re: [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? Giacomo Fiorin
07:16 [lammps-users] lennard jones cut off bahman daneshian
07:14 Re: [lammps-users] pair_style cosine/squared Alessio Alexiadis
05:06 Re: [lammps-users] pair_style cosine/squared Axel Kohlmeyer
03:35 Re: [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? O Drecun
02:53 [lammps-users] pair_style cosine/squared Alessio Alexiadis

April 08, 2020
20:32 Re: [lammps-users] Write_coeff with lj/long Sara Mosallanejad
20:24 Re: [lammps-users] LAMMPS library not applying kokkos command line options as expected Axel Kohlmeyer
20:21 Re: [lammps-users] Write_coeff with lj/long Axel Kohlmeyer
20:06 Re: [lammps-users] Write_coeff with lj/long Sara Mosallanejad
19:55 Re: [lammps-users] Write_coeff with lj/long Axel Kohlmeyer
19:53 Re: [lammps-users] Write_coeff with lj/long Axel Kohlmeyer
19:13 [lammps-users] Write_coeff with lj/long Sara Mosallanejad
16:50 Re: [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? Giacomo Fiorin
15:40 [lammps-users] LAMMPS library not applying kokkos command line options as expected Calvin Anderson
15:04 Re: [lammps-users] Recommendation for molecular motors in LAMMPS? Jacob Gissinger
15:03 [lammps-users] *Updated*COLVARS PMF extraction from separate simulations. Possible? O Drecun
14:20 [lammps-users] pressure variation with and without restart santhosh mathesan
13:42 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Axel Kohlmeyer
13:05 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Vrindaa Somjit
06:46 Re: [lammps-users] How to apply pressure load Mingrui Dong
06:19 Re: [lammps-users] Are the simulation results reliable if the LAMMPS executable compiled on a old machine to be used on a new HPC? Wenqiang Liu

April 07, 2020
23:44 Re: [lammps-users] LJ paramters for aluminium Will Pisani
23:41 Re: [lammps-users] LJ paramters for aluminium MASATO KOIZUMI
21:42 [lammps-users] LJ paramters for aluminium Navjot Kaur
21:00 Re: [lammps-users] How to apply pressure load zhanganying
18:14 Re: [lammps-users] hyperdynamics : error with fix hyper/local ness smart
13:15 Re: [lammps-users] forcefield parameter optimizing omid gh
13:07 Re: [lammps-users] increase of pressure in restart file Axel Kohlmeyer
13:02 Re: [lammps-users] forcefield parameter optimizing Axel Kohlmeyer
12:53 Re: [lammps-users] forcefield parameter optimizing omid gh
12:52 [lammps-users] Recommendation for molecular motors in LAMMPS? Adam, Brian
12:04 Re: [lammps-users] forcefield parameter optimizing Will Pisani
11:38 [lammps-users] forcefield parameter optimizing omid gh
11:18 Re: [lammps-users] Sandia network problems? Axel Kohlmeyer
11:06 Re: [lammps-users] Sandia network problems? Axel Kohlmeyer
10:01 Re: [lammps-users] Sandia network problems? Van Dam, Hubertus
09:49 Re: [lammps-users] Any command for empty space in LAMMPS? Axel Kohlmeyer
09:39 [lammps-users] Sandia network problems? Van Dam, Hubertus
09:27 Re: [lammps-users] Any command for empty space in LAMMPS? Atefeh Tarokh
08:41 Re: [lammps-users] Are the simulation results reliable if the LAMMPS executable compiled on a old machine to be used on a new HPC? Axel Kohlmeyer
07:50 Re: [lammps-users] Are the simulation results reliable if the LAMMPS executable compiled on a old machine to be used on a new HPC? Wenqiang Liu
05:02 [lammps-users] increase of pressure in restart file omid gh
04:40 Re: [lammps-users] How to apply pressure load Mingrui Dong
00:09 [lammps-users] How to apply pressure load zhanganying

April 06, 2020
17:01 Re: [lammps-users] Any command for empty space in LAMMPS? Axel Kohlmeyer
16:33 [lammps-users] Any command for empty space in LAMMPS? Atefeh Tarokh
15:21 Re: [lammps-users] How to add Alireza Shadloo
14:58 Re: [lammps-users] class 2 datafile omid gh
14:50 Re: [lammps-users] class 2 datafile Axel Kohlmeyer
14:32 Re: [lammps-users] [EXTERNAL] Re: Small granular particles falling through walls Arman Guerra
14:31 Re: [lammps-users] class 2 datafile omid gh
10:31 Re: [lammps-users] Avoiding solution clustering Axel Kohlmeyer
10:26 Re: [lammps-users] class 2 datafile Axel Kohlmeyer
10:12 [lammps-users] class 2 datafile omid gh
10:01 Re: [lammps-users] Implementing forward communication in a pre_exchange fix Anne B
10:00 Re: [lammps-users] Avoiding solution clustering Anne B
09:46 Re: [lammps-users] 回复: 回复: fix shake and angle harmonic Axel Kohlmeyer
09:19 [lammps-users] ?????? ?????? fix shake and angle harmonic ??????
08:57 Re: [lammps-users] Replicated system atom IDs are too big Christopher Knight
08:28 [lammps-users] 回复: 回复: 回复: about water-oil interface da zhang
08:21 Re: [lammps-users] 回复: 回复: about water-oil interface Axel Kohlmeyer
08:08 [lammps-users] 回复: 回复: 回复: about water-oil interface da zhang
01:34 Re: [lammps-users] Different random seeds in different processes Haidong Fan_SCU
01:26 Re: [lammps-users] Different random seeds in different processes Axel Kohlmeyer
01:11 [lammps-users] Different random seeds in different processes Haidong Fan_SCU

April 05, 2020
14:28 Re: [lammps-users] Simulation cell smaller than pair cutoff Giacomo Fiorin
12:40 Re: [lammps-users] 回复: fix shake and angle harmonic Axel Kohlmeyer
10:50 [lammps-users] ?????? fix shake and angle harmonic ??????
10:07 Re: [lammps-users] fix shake and angle harmonic Axel Kohlmeyer
08:50 [lammps-users] fix shake and angle harmonic ??????

April 04, 2020
11:40 Re: [lammps-users] use dump in if condition Axel Kohlmeyer
10:49 [lammps-users] use dump in if condition mohammad rezaei
10:04 Re: [lammps-users] [EXTERNAL] Re: Small granular particles falling through walls Bolintineanu, Dan Stefan
09:59 Re: [lammps-users] Simulation cell smaller than pair cutoff Axel Kohlmeyer
09:48 Re: [lammps-users] Speed up pair_style loading time with QUIP/GAP Axel Kohlmeyer
09:44 Re: [lammps-users] Are the simulation results reliable if the LAMMPS executable compiled on a old machine to be used on a new HPC? Axel Kohlmeyer
09:28 [lammps-users] Speed up pair_style loading time with QUIP/GAP Ross Williams
08:51 [lammps-users] Are the simulation results reliable if the LAMMPS executable compiled on a old machine to be used on a new HPC? Wenqiang Liu
05:45 [lammps-users] Simulation cell smaller than pair cutoff MD Simulation
04:12 Re: [lammps-users] temperature in LJ units Ευάγγελος Βογιατζής
02:55 Re: [lammps-users] Replicated system atom IDs are too big Haidong Fan_SCU
01:39 [lammps-users] Replicated system atom IDs are too big Haidong Fan_SCU

April 03, 2020
22:23 Re: [lammps-users] Generating the data file using python Andrew Jewett
20:14 Re: [lammps-users] temperature in LJ units Navjot Kaur
19:35 Re: [lammps-users] temperature in LJ units Navjot Kaur
19:21 Re: [lammps-users] Small granular particles falling through walls Axel Kohlmeyer
18:38 Re: [lammps-users] Typo or mistake in "pair_style sph/taitwater/morris command " documentation page Axel Kohlmeyer
15:31 [lammps-users] Typo or mistake in "pair_style sph/taitwater/morris command " documentation page Carlos Alberto Duque Daza
11:32 Re: [lammps-users] temperature in LJ units Giacomo Fiorin
09:39 [lammps-users] 回复: 回复: about water-oil interface da zhang
09:26 Re: [lammps-users] 回复: about water-oil interface Axel Kohlmeyer
09:08 [lammps-users] 回复: 回复: about water-oil interface da zhang
08:22 Re: [lammps-users] How to constrain rounded polyhedrons into a cylinder and a likely bug in LAMMPS Trung Nguyen
08:12 [lammps-users] Small granular particles falling through walls Arman Guerra
07:30 Re: [lammps-users] How to constrain rounded polyhedrons into a cylinder and a likely bug in LAMMPS Axel Kohlmeyer
07:18 [lammps-users] How to constrain rounded polyhedrons into a cylinder and a likely bug in LAMMPS 祖梦婕
07:02 Re: [lammps-users] R: Install LAMMPS on CentOS 7 Axel Kohlmeyer
06:43 [lammps-users] R: R: Install LAMMPS on CentOS 7 Giuseppe Petrillo
05:42 [lammps-users] 回复: about water-oil interface da zhang
04:13 Re: [lammps-users] about water-oil interface Axel Kohlmeyer

April 02, 2020
22:54 Re: [lammps-users] about water-oil interface Will Pisani
22:32 [lammps-users] about water-oil interface da zhang
21:09 Re: [lammps-users] Read_dump without atom ID Haidong Fan_SCU
13:35 [lammps-users] Implementing forward communication in a pre_exchange fix Anne B
09:41 Re: [lammps-users] compute coord/atom Xu, Wenting (xuwt)
09:24 Re: [lammps-users] compute reduce - compute not current MD Simulation
09:04 Re: [lammps-users] Read_dump without atom ID Haidong Fan_SCU
08:55 Re: [lammps-users] Read_dump without atom ID Axel Kohlmeyer
08:42 Re: [lammps-users] Read_dump without atom ID Haidong Fan_SCU
08:35 Re: [lammps-users] Read_dump without atom ID Axel Kohlmeyer
08:21 [lammps-users] temperature in LJ units Navjot Kaur
08:06 Re: [lammps-users] Read_dump without atom ID Haidong Fan_SCU
07:17 Re: [lammps-users] compute reduce - compute not current Axel Kohlmeyer
07:04 Re: [lammps-users] Read_dump without atom ID Axel Kohlmeyer
05:00 [lammps-users] Nan e_coulomb in GCMC simulation alberto
04:25 [lammps-users] compute reduce - compute not current MD Simulation
02:37 [lammps-users] Read_dump without atom ID Haidong Fan_SCU

April 01, 2020
21:38 Re: [lammps-users] compute coord/atom Axel Kohlmeyer
20:40 [lammps-users] How to add Atefeh Tarokh
15:10 [lammps-users] compute coord/atom Xu, Wenting (xuwt)
15:08 Re: [lammps-users] Hybrid Potential Error Axel Kohlmeyer
13:48 [lammps-users] R: Install LAMMPS on CentOS 7 Giuseppe Petrillo
12:42 Re: [lammps-users] Hybrid Potential Error Sinha Sumit
12:39 Re: [lammps-users] Hybrid Potential Error Sinha Sumit
12:37 Re: [lammps-users] Hybrid Potential Error Axel Kohlmeyer
12:31 Re: [lammps-users] Hybrid Potential Error Will Pisani
12:22 Re: [lammps-users] Hybrid Potential Error Sinha Sumit
10:49 Re: [lammps-users] NEB - ReaxFF convergence issue Julien Guénolé
10:07 Re: [lammps-users] Install LAMMPS on CentOS 7 Axel Kohlmeyer
08:12 Re: [lammps-users] [EXTERNAL] Calculation of x y z coordinates in CFG file Thompson, Aidan
06:35 [lammps-users] Install LAMMPS on CentOS 7 Giuseppe Petrillo
03:55 Re: [lammps-users] NEB - ReaxFF convergence issue Julien Guénolé
01:43 [lammps-users] NEB - ReaxFF convergence issue Kritikos, Efstratios

March 31, 2020
22:42 Re: [lammps-users] [EXTERNAL] Calculation of x y z coordinates in CFG file Jeongwoo Lee
21:56 Re: [lammps-users] [EXTERNAL] Calculation of x y z coordinates in CFG file Thompson, Aidan
20:58 [lammps-users] Calculation of x y z coordinates in CFG file Jeongwoo Lee
16:33 Re: [lammps-users] Fix deform with NPT to model Uniaxial Tension - appears to give unstable result Will Pisani
13:59 Re: [lammps-users] Avoiding solution clustering Axel Kohlmeyer
13:20 [lammps-users] Avoiding solution clustering Anne B
11:48 [lammps-users] Fix deform with NPT to model Uniaxial Tension - appears to give unstable result Richard Gustafson
08:11 Re: [lammps-users] How to use eam potential function Axel Kohlmeyer
08:03 Re: [lammps-users] Moving a group of atoms at constant velocity Axel Kohlmeyer
07:45 [lammps-users] How to use eam potential function zhanganying
07:09 [lammps-users] Moving a group of atoms at constant velocity Shoieb Ahmed Chowdhury
07:02 Re: [lammps-users] How to use eam potential function Axel Kohlmeyer
06:28 [lammps-users] How to use eam potential function zhanganying
05:19 Re: [lammps-users] Force filed about the none-bonded term between two atoms in the angle. Axel Kohlmeyer
04:56 Re: [lammps-users] How to use eam potential function Axel Kohlmeyer
04:38 [lammps-users] (no subject) 유승주
02:11 [lammps-users] How to use eam potential function zhanganying
01:48 [lammps-users] Force filed about the none-bonded term between two atoms in the angle. 徐云轩

March 30, 2020
22:57 Re: [lammps-users] Frozen atoms from fix deposit Axel Kohlmeyer
22:53 Re: [lammps-users] Frozen atoms from fix deposit Anne B
22:49 Re: [lammps-users] Strain along shrink-wrapped direction Axel Kohlmeyer
22:41 Re: [lammps-users] Frozen atoms from fix deposit Axel Kohlmeyer
22:26 Re: [lammps-users] Strain along shrink-wrapped direction Shoieb Ahmed Chowdhury
22:14 [lammps-users] Frozen atoms from fix deposit Anne B
21:26 [lammps-users] fix tmd reza namakian
19:01 Re: [lammps-users] Strain along shrink-wrapped direction Ali shargh
17:51 Re: [lammps-users] Strain along shrink-wrapped direction Will Pisani
14:35 [lammps-users] Strain along shrink-wrapped direction Ali shargh
12:18 Re: [lammps-users] PPPM with non-periodic boundary Axel Kohlmeyer
11:43 [lammps-users] PPPM with non-periodic boundary pmoreira
09:51 Re: [lammps-users] Timestep in FIRE 2.0 Julien Guénolé
04:16 Re: [lammps-users] Generating the data file using python Axel Kohlmeyer
01:30 Re: [lammps-users] Generating the data file using python Will Pisani
00:50 Re: [lammps-users] Hybrid Potential Error Axel Kohlmeyer

March 29, 2020
23:41 Re: [lammps-users] Hybrid Potential Error Sinha Sumit
20:00 Re: [lammps-users] Hybrid Potential Error Axel Kohlmeyer
19:53 Re: [lammps-users] Hybrid Potential Error Sinha Sumit
19:12 [lammps-users] Generating the data file using python Faiz, Umer Sarwar
12:50 Re: [lammps-users] Loading in Lammps Asadollahzadeh
12:16 Re: [lammps-users] A question about dumping the output while delete the atoms Will Pisani
12:14 Re: [lammps-users] Loading in Lammps Will Pisani
06:24 Re: [lammps-users] Using multiple potential for alloys Axel Kohlmeyer
06:21 [lammps-users] Using multiple potential for alloys Mahmudul Islam

March 28, 2020
23:47 Re: [lammps-users] parameter errors on writing a run loop in Python Axel Kohlmeyer
21:38 Re: [lammps-users] parameter errors on writing a run loop in Python Yanggang
14:14 Re: [lammps-users] A question about dumping the output while delete the atoms Axel Kohlmeyer
14:08 Re: [lammps-users] A question about dumping the output while delete the atoms Atefeh Tarokh
12:28 Re: [lammps-users] GPU is not finding any accelerator device Mahmudul Islam
11:55 Re: [lammps-users] A question about dumping the output while delete the atoms Axel Kohlmeyer
11:50 Re: [lammps-users] A question about dumping the output while delete the atoms Atefeh Tarokh
10:36 Re: [lammps-users] GPU is not finding any accelerator device Axel Kohlmeyer
10:29 [lammps-users] GPU is not finding any accelerator device Mahmudul Islam
06:29 Re: [lammps-users] A question about dumping the output while delete the atoms Axel Kohlmeyer
03:51 [lammps-users] Loading in Lammps Asadollahzadeh

March 27, 2020
22:28 [lammps-users] A question about dumping the output while delete the atoms Atefeh Tarokh
18:51 [lammps-users] question on ion bombardment using reaxff Carly Johnson
07:57 Re: [lammps-users] Bias-free temperature profile in the case of Couette flow Steve Plimpton

March 26, 2020
20:48 Re: [lammps-users] parameter errors on writing a run loop in Python Axel Kohlmeyer
20:41 [lammps-users] parameter errors on writing a run loop in Python Yanggang
20:22 Re: [lammps-users] NaN Issue M. E. Torki
20:10 Re: [lammps-users] NaN Issue Axel Kohlmeyer
20:07 Re: [lammps-users] NaN Issue M. E. Torki
20:07 Re: [lammps-users] NaN Issue M. E. Torki
19:32 Re: [lammps-users] NaN Issue Axel Kohlmeyer
19:22 Re: [lammps-users] NaN Issue M. E. Torki
19:10 Re: [lammps-users] NaN Issue Axel Kohlmeyer
18:59 Re: [lammps-users] NaN Issue M. E. Torki
18:09 Re: [lammps-users] NaN Issue Axel Kohlmeyer
17:48 Re: [lammps-users] Accessing a global/computed value in a fix Anne B
17:46 [lammps-users] NaN Issue M. E. Torki
17:46 Re: [lammps-users] Accessing a global/computed value in a fix Axel Kohlmeyer
17:31 [lammps-users] Accessing a global/computed value in a fix Anne B
12:33 Re: [lammps-users] Combining fixed charges and variable (qEq) charges? Axel Kohlmeyer
12:18 [lammps-users] Combining fixed charges and variable (qEq) charges? Anne B
12:16 Re: [lammps-users] the atom moved from one side of the periodic condition to the other one Steve Plimpton
12:14 Re: [lammps-users] Timestep in FIRE 2.0 Steve Plimpton
10:17 Re: [lammps-users] the atom moved from one side of the periodic condition to the other one Will Pisani
08:54 [lammps-users] the atom moved from one side of the periodic condition to the other one John Lee
08:35 [lammps-users] Bias-free temperature profile in the case of Couette flow shahin mohamadnejad
08:18 Re: [lammps-users] Question about pair_coeff Ivan Moncayo
03:52 Re: [lammps-users] Timestep in FIRE 2.0 Julien Guénolé

March 25, 2020
17:45 Re: [lammps-users] Timestep in FIRE 2.0 Steve Plimpton
17:24 Re: [lammps-users] Question about pair_coeff Steve Plimpton
15:05 Re: [lammps-users] Setting the parameter d for an MEAM library Sebastian Hütter
13:26 [lammps-users] Setting the parameter d for an MEAM library Antoine Rincent
09:46 Re: [lammps-users] Question regarding eam/alloy Axel Kohlmeyer
09:44 Re: [lammps-users] Question regarding eam/alloy Talya Vaknin
09:31 Re: [lammps-users] Doubt about Born Mayer Huggins potential Mauricio Rodriguez
09:24 Re: [lammps-users] Doubt about Born Mayer Huggins potential Axel Kohlmeyer
08:52 [lammps-users] Doubt about Born Mayer Huggins potential Mauricio Rodriguez
04:40 Re: [lammps-users] Hooke with fix rigid/small molecule Axel Kohlmeyer
02:43 [lammps-users] Hooke with fix rigid/small molecule Luis Cebamanos

March 24, 2020
16:56 Re: [lammps-users] Timestep in FIRE 2.0 Axel Kohlmeyer
16:27 [lammps-users] Timestep in FIRE 2.0 reza namakian
15:29 Re: [lammps-users] Question regarding eam/alloy Talya Vaknin
13:27 Re: [lammps-users] Question regarding eam/alloy Axel Kohlmeyer
13:16 Re: [lammps-users] Pair coeff modified Will Pisani
13:05 Re: [lammps-users] Pair coeff modified Axel Kohlmeyer
12:59 Re: [lammps-users] ELASTIC_T problem (maybe) on GPU Axel Kohlmeyer
12:52 Re: [lammps-users] Pair coeff modified Will Pisani
12:50 Re: [lammps-users] Pair coeff modified Axel Kohlmeyer
12:17 [lammps-users] Pair coeff modified Ivan Moncayo
04:39 [lammps-users] ELASTIC_T problem (maybe) on GPU Domenico Marson

March 23, 2020
20:47 Re: [lammps-users] call python from a lammps input script Axel Kohlmeyer
20:36 [lammps-users] call python from a lammps input script weiqi chen
19:47 Re: [lammps-users] Sort output for write_data Filip Simeski
19:45 Re: [lammps-users] Sort output for write_data Axel Kohlmeyer
19:33 Re: [lammps-users] Sort output for write_data Piskulich, Ezekiel Ashe
19:30 [lammps-users] Sort output for write_data Filip Simeski
19:12 Re: [lammps-users] GPU on windows Axel Kohlmeyer
19:08 Re: [lammps-users] LAMMPS packages not getting installed when built Axel Kohlmeyer
19:04 [lammps-users] GPU on windows Lucas Andrade Silva
19:00 Re: [lammps-users] Problem with building Lammps with modified pair_sw.cpp files Axel Kohlmeyer
17:56 [lammps-users] Problem with building Lammps with modified pair_sw.cpp files Shoieb Ahmed Chowdhury
10:55 Re: [lammps-users] LAMMPS packages not getting installed when built Will Pisani
09:58 [lammps-users] LAMMPS packages not getting installed when built J Pundarikaksha Kavipurapu
09:24 Re: [lammps-users] Residual Stress Will Pisani
08:37 Re: [lammps-users] lammps on CPU with GPU Will Pisani
06:39 Re: [lammps-users] Atom Stuck at Harmonic Wall Giacomo Fiorin
03:16 Re: [lammps-users] Temperature in FixGCMC Bjørn Strøm
03:01 Re: [lammps-users] Residual Stress Asadollahzadeh
01:40 Re: [lammps-users] Fluctuations in Stress - Young's Modulus Will Pisani
01:33 Re: [lammps-users] Residual Stress Will Pisani
01:07 Re: [lammps-users] Hybrid Potential Error Axel Kohlmeyer
01:02 Re: [lammps-users] Hybrid Potential Error Axel Kohlmeyer
00:33 [lammps-users] Hybrid Potential Error Sinha Sumit

March 22, 2020
16:00 Re: [lammps-users] Question regarding eam/alloy Talya Vaknin
07:04 Re: [lammps-users] MEAM potential for Al 7075 Sebastian Hütter
05:00 [lammps-users] Residual Stress Asadollahzadeh

March 21, 2020
20:13 Re: [lammps-users] Fluctuations in Stress - Young's Modulus spandu K
15:44 Re: [lammps-users] MEAM potential for Al 7075 isra muscati
09:55 [lammps-users] Fwd: Question about pair_coeff Ivan Moncayo

March 20, 2020
20:10 Re: [lammps-users] Why the distributions of centro-symmetry parameters are different for FCC and BCC monocrystals? yl1007
12:54 Re: [lammps-users] Atom Stuck at Harmonic Wall Tyler Schmidt
12:27 Re: [lammps-users] lammps on CPU with GPU Will Pisani
12:10 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Vrindaa Somjit
08:11 [lammps-users] Question about pair_coeff Ivan Moncayo
06:27 Re: [lammps-users] Re-enable colvars from binary file using read_restart Steve Plimpton
06:24 Re: [lammps-users] Question on fix addtorque Steve Plimpton
06:10 Re: [lammps-users] Question regarding eam/alloy Steve Plimpton
06:01 [lammps-users] lammps on CPU with GPU Holger Badorreck
05:59 Re: [lammps-users] Why the distributions of centro-symmetry parameters are different for FCC and BCC monocrystals? Steve Plimpton
05:18 Re: [lammps-users] Re-enable colvars from binary file using read_restart Julen Mendieta Esteban
04:32 [lammps-users] Why the distributions of centro-symmetry parameters are different for FCC and BCC monocrystals? yl1007

March 19, 2020
18:37 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system Steve Plimpton
13:03 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla
12:47 [lammps-users] Question regarding eam/alloy Talya Vaknin
08:00 Re: [lammps-users] Question on fix addtorque Diaz,Adrian
04:46 Re: [lammps-users] Question on fix addtorque Laurent Joly

March 18, 2020
17:09 Re: [lammps-users] hyperdynamics : error with fix hyper/local Steve Plimpton
17:08 Re: [lammps-users] fix qeq/comb Steve Plimpton
15:04 Re: [lammps-users] energy drift when using fix rigid in 2d simulations Valerio Sorichetti
15:02 Re: [lammps-users] Fluctuations in Stress - Young's Modulus Will Pisani
14:13 Re: [lammps-users] energy drift when using fix rigid in 2d simulations Trung Nguyen
13:04 Re: [lammps-users] [EXTERNAL] Re: Temperature in FixGCMC Thompson, Aidan
12:32 Re: [lammps-users] Different output stress values when using different TIP3P water models Axel Kohlmeyer
12:08 Re: [lammps-users] Different output stress values when using different TIP3P water models Vo, Anh
07:46 Re: [lammps-users] fix qeq/comb Ray Shan
03:41 Re: [lammps-users] Copy molecule and randomize initial position Axel Kohlmeyer
03:38 Re: [lammps-users] Randomized initial position Axel Kohlmeyer
03:18 Re: [lammps-users] Different output stress values when using different TIP3P water models Axel Kohlmeyer
02:48 Re: [lammps-users] Question related to Library.MEAM Sebastian Hütter
01:41 [lammps-users] Different output stress values when using different TIP3P water models Vo, Anh

March 17, 2020
23:42 Re: [lammps-users] Fluctuations in Stress - Young's Modulus spandu K
22:59 [lammps-users] Copy molecule and randomize initial position Alireza Fazeli
22:46 [lammps-users] Randomized initial position Alireza Fazeli
22:25 Re: [lammps-users] fix qeq/comb Martin, Seth Curtis
22:21 [lammps-users] Question related to Library.MEAM Nuruzzaman Sakib
19:24 [lammps-users] Difference between the distributions of the centro-symmetry parameters in FCC and BCC metals yl1007
18:28 Re: [lammps-users] Query regarding data file Andrew Jewett
18:25 Re: [lammps-users] fix qeq/comb Ray Shan
18:01 Re: [lammps-users] Calling force->pair->list->inum when using hybrid/overlay Axel Kohlmeyer
17:55 Re: [lammps-users] Calling force->pair->list->inum when using hybrid/overlay Anne B
17:44 Re: [lammps-users] Calling force->pair->list->inum when using hybrid/overlay Axel Kohlmeyer
17:18 [lammps-users] Calling force->pair->list->inum when using hybrid/overlay Anne B
15:27 Re: [lammps-users] [EXTERNAL] Re: Single-precision KOKKOS? Moore, Stan
14:45 Re: [lammps-users] energy drift when using fix rigid in 2d simulations Axel Kohlmeyer
14:36 Re: [lammps-users] hyperdynamics : error with fix hyper/local ness smart
14:30 Re: [lammps-users] Atom Stuck at Harmonic Wall Giacomo Fiorin
14:17 [lammps-users] fix qeq/comb Martin, Seth Curtis
13:45 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla
13:32 Re: [lammps-users] Couette flow simulation with isothermal walls Steve Plimpton
13:29 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system Steve Plimpton
13:29 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system Steve Plimpton
13:25 Re: [lammps-users] Sending only bonded particles Steve Plimpton
13:18 Re: [lammps-users] hyperdynamics : error with fix hyper/local Steve Plimpton
13:10 [lammps-users] hyperdynamics : error with fix hyper/local ness smart
13:06 Re: [lammps-users] Single-precision KOKKOS? Steve Plimpton
12:57 Re: [lammps-users] energy drift when using fix rigid in 2d simulations Valerio Sorichetti
12:46 Re: [lammps-users] CG error message in ATC Steve Plimpton
11:46 Re: [lammps-users] Simulating Melting-Solidification Cycle Steve Plimpton
11:42 Re: [lammps-users] Asking information regarding LAMMPS Steve Plimpton
11:40 Re: [lammps-users] Question on fix addtorque Steve Plimpton
11:09 Re: [lammps-users] Graphene temperature modeled with AIREBO potential Steve Plimpton
11:04 Re: [lammps-users] problem with restart Steve Plimpton
10:59 Re: [lammps-users] temperature profile in the case of Couette flow Steve Plimpton
10:54 Re: [lammps-users] MSD not increasing with time for LiMn2O4 Steve Plimpton
10:50 Re: [lammps-users] energy drift when using fix rigid in 2d simulations Steve Plimpton
10:44 Re: [lammps-users] Temperature in FixGCMC Steve Plimpton
10:42 Re: [lammps-users] [EXTERNAL] Calculation of enthalp Thompson, Aidan
10:40 Re: [lammps-users] Atom Stuck at Harmonic Wall Steve Plimpton
10:39 Re: [lammps-users] spatial profile of stress printing Steve Plimpton
10:37 [lammps-users] Query regarding data file Faiz, Umer Sarwar
10:26 Re: [lammps-users] viscosity via fix deform+implicit solvent / temperature issues Steve Plimpton
10:23 Re: [lammps-users] Heterogeneous nucleation of a FeMnCrCoHigh Entropy Alloy Steve Plimpton
10:16 Re: [lammps-users] Size effect in the GK Method for finding thermal conductivity Steve Plimpton

March 16, 2020
17:15 Re: [lammps-users] compute_pe_atom called used in WriteDump Axel Kohlmeyer
14:34 [lammps-users] compute_pe_atom called used in WriteDump Mishkin,Alec S

March 15, 2020
12:35 Re: [lammps-users] relation between Atomman and LAMMPS Axel Kohlmeyer

March 14, 2020
14:16 [lammps-users] relation between Atomman and LAMMPS isra muscati
03:41 Re: [lammps-users] segmentation fault Davide Mandelli

March 13, 2020
15:48 Re: [lammps-users] segmentation fault Axel Kohlmeyer
14:57 [lammps-users] segmentation fault Davide Mandelli
14:43 Re: [lammps-users] Run LAMMPS on GPU Will Pisani
14:31 [lammps-users] Run LAMMPS on GPU ZetaText
12:34 Re: [lammps-users] Out of range atoms - pppm: triclinic box and user-intel Will Pisani
10:41 Re: [lammps-users] Inserting an arbitrary plane in the snapshot. Diljith T
10:40 Re: [lammps-users] Inserting an arbitrary plane in the snapshot. Axel Kohlmeyer
10:25 [lammps-users] Inserting an arbitrary plane in the snapshot. Diljith T
07:41 Re: [lammps-users] Binary does not work out for examples Axel Kohlmeyer
07:31 [lammps-users] Binary does not work out for examples Kalthoff, Benedikt Johannes

March 12, 2020
22:46 Re: [lammps-users] How to apply torque force through springs? Axel Kohlmeyer
21:10 Re: [lammps-users] How to apply torque force through springs? Xing Yang
16:16 [lammps-users] using OPLSAA or ATB with moltemplate? (Re: moltemplate error) Andrew Jewett
14:17 Re: [lammps-users] Temperature fluctuations in NVT simulation Axel Kohlmeyer
13:21 Re: [lammps-users] Out of range atoms - pppm: triclinic box and user-intel Axel Kohlmeyer
12:27 [lammps-users] Out of range atoms - pppm: triclinic box and user-intel Will Pisani
11:33 Re: [lammps-users] Temperature fluctuations in NVT simulation Mohammed Alhissi
09:42 Re: [lammps-users] Single-precision KOKKOS? Axel Kohlmeyer
09:07 Re: [lammps-users] range-based ‘for’ loops are not allowed in C++98 mode Giacomo Fiorin
08:39 Re: [lammps-users] range-based ‘for’ loops are not allowed in C++98 mode Giacomo Fiorin
08:31 Re: [lammps-users] Single-precision KOKKOS? Michael
07:33 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Steve Plimpton
04:45 Re: [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Axel Kohlmeyer
04:32 Re: [lammps-users] range-based ‘for’ loops are not allowed in C++98 mode Axel Kohlmeyer
04:03 [lammps-users] range-based ‘for’ loops are not allowed in C++98 mode Kalthoff, Benedikt Johannes

March 11, 2020
18:47 Re: [lammps-users] How to apply torque force through springs? Andrew Jewett
17:29 Re: [lammps-users] question on units Andrew Jewett
16:20 Re: [lammps-users] Single-precision KOKKOS? Axel Kohlmeyer
15:56 Re: [lammps-users] Single-precision KOKKOS? Michael
15:45 Re: [lammps-users] Fluctuations in Stress - Young's Modulus spandu K
15:34 Re: [lammps-users] Fluctuations in Stress - Young's Modulus Will Pisani
15:02 Re: [lammps-users] Fluctuations in Stress - Young's Modulus spandu K
14:38 Re: [lammps-users] Single-precision KOKKOS? Axel Kohlmeyer
14:27 [lammps-users] Single-precision KOKKOS? Michael
11:02 Re: [lammps-users] How to apply torque force through springs? Axel Kohlmeyer
10:23 [lammps-users] How to apply torque force through springs? Xing Yang
09:58 [lammps-users] Running LAMMPS as a client code to perform Grand Canonical Monte Carlo moves and VASP as a server code Vrindaa Somjit
08:37 Re: [lammps-users] Fluctuations in Stress - Young's Modulus Will Pisani

March 10, 2020
22:04 [lammps-users] Fluctuations in Stress - Young's Modulus spandu K
21:02 Re: [lammps-users] read_restart and complex bond_coeff Yanggang
20:56 Re: [lammps-users] read_restart and complex bond_coeff Axel Kohlmeyer
19:57 [lammps-users] read_restart and complex bond_coeff Yanggang
15:35 [lammps-users] CG error message in ATC Chionye Okwuashi
15:11 [lammps-users] Fluctuations in Stress - Young's Modulus spandu K
05:10 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla
04:52 Re: [lammps-users] RDF and coordination numbers. Axel Kohlmeyer

March 09, 2020
23:31 [lammps-users] RDF and coordination numbers. Chung Suk Choi
04:34 Re: [lammps-users] Neb method Axel Kohlmeyer
04:19 [lammps-users] Neb method Nitin Chaudhary
00:55 Re: [lammps-users] N-body simulation of ions in a harmonic trap with ion-ion Coulombic interactions Axel Kohlmeyer

March 08, 2020
22:31 [lammps-users] N-body simulation of ions in a harmonic trap with ion-ion Coulombic interactions Kia Ng
17:57 Re: [lammps-users] question on units Morrissey, Liam S.
15:21 Re: [lammps-users] fix print - variable in title MD Simulation
15:18 Re: [lammps-users] fix print - variable in title Axel Kohlmeyer
15:10 Re: [lammps-users] fix print - variable in title MD Simulation
15:06 Re: [lammps-users] fix print - variable in title Axel Kohlmeyer
09:48 Re: [lammps-users] fix print - variable in title MD Simulation
08:35 Re: [lammps-users] PLUMED running issue Axel Kohlmeyer
08:09 Re: [lammps-users] PLUMED running issue Radhika Holmes
07:16 Re: [lammps-users] fix print - variable in title MD Simulation
06:40 Re: [lammps-users] fix print - variable in title Axel Kohlmeyer
05:49 [lammps-users] fix print - variable in title MD Simulation
04:17 Re: [lammps-users] PLUMED running issue Axel Kohlmeyer
00:51 Re: [lammps-users] PLUMED running issue Radhika Holmes

March 07, 2020
08:41 Re: [lammps-users] compute property/local for bond connectivity Axel Kohlmeyer
08:34 Re: [lammps-users] Trouble with 1-3 bond count inconsistency DYLAN ANSTINE
07:13 Re: [lammps-users] ERROR: Compute used in variable between runs is not current Axel Kohlmeyer
06:30 Re: [lammps-users] question on units Morrissey, Liam S.
05:39 Re: [lammps-users] question on units Andrew Jewett
03:05 [lammps-users] ERROR: Compute used in variable between runs is not current Voidshatter
00:45 [lammps-users] Sending only bonded particles Christian Tabedzki

March 06, 2020
16:11 Re: [lammps-users] Query about delete_atoms Zizhen Zhou
16:05 Re: [lammps-users] Query about delete_atoms Axel Kohlmeyer
15:52 [lammps-users] Query about delete_atoms Zizhen Zhou
15:41 Re: [lammps-users] Query about delete_atoms Axel Kohlmeyer
15:34 Re: [lammps-users] Temperature fluctuations in NVT simulation Axel Kohlmeyer
15:24 [lammps-users] Query about delete_atoms Zizhen Zhou
15:15 Re: [lammps-users] Trouble with 1-3 bond count inconsistency Axel Kohlmeyer
13:51 [lammps-users] Trouble with 1-3 bond count inconsistency DYLAN ANSTINE
08:47 [lammps-users] compute property/local for bond connectivity Jayaraman Rukmani,Shalini
08:12 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Will Pisani
07:31 [lammps-users] question on units Morrissey, Liam S.
03:33 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi

March 05, 2020
14:14 Re: [lammps-users] CSlib error while trying to use LAMMPS in coupled client/server mode Vrindaa Somjit
11:20 [lammps-users] Temperature fluctuations in NVT simulation Mohammed Alhissi
06:53 Re: [lammps-users] Error while using hybrid pair style kagdada hardik
06:17 Re: [lammps-users] Newbie question: how to relate MD results to thermodynamic derivatives? Axel Kohlmeyer
06:14 Re: [lammps-users] Calculate angular MSD Axel Kohlmeyer
06:12 Re: [lammps-users] Martini force field in Lammps Axel Kohlmeyer
06:02 Re: [lammps-users] Error while using hybrid pair style Axel Kohlmeyer
05:07 [lammps-users] Couette flow simulation with isothermal walls shahin mohamadnejad
02:35 Re: [lammps-users] Any update on migration of LAMMPS licence terms from GLP to LGLP Donal MacKernan
02:06 [lammps-users] Calculate angular MSD Mohammad Hossain

March 04, 2020
23:57 [lammps-users] Martini force field in Lammps Jun Zhou
22:37 [lammps-users] Error while using hybrid pair style kagdada hardik
20:44 Re: [lammps-users] Any update on migration of LAMMPS licence terms from GLP to LGLP Axel Kohlmeyer
20:39 Re: [lammps-users] CSlib error while trying to use LAMMPS in coupled client/server mode Axel Kohlmeyer
18:08 [lammps-users] Any update on migration of LAMMPS licence terms from GLP to LGLP Donal MacKernan
16:01 [lammps-users] CSlib error while trying to use LAMMPS in coupled client/server mode Vrindaa Somjit
15:46 [lammps-users] CSlib error while trying to use LAMMPS in coupled client/server mode Vrindaa Somjit
14:54 Re: [lammps-users] Simulating Melting-Solidification Cycle Victor Fabiyi
14:34 [lammps-users] Simulating Melting-Solidification Cycle Victor Fabiyi
14:34 [lammps-users] new 3 Mar 2020 stable release of LAMMPS Steve Plimpton
11:56 Re: [lammps-users] 2-27 lammps version bug Axel Kohlmeyer
11:29 Re: [lammps-users] 2-27 lammps version bug Benjamin Beeler
11:08 Re: [lammps-users] 2-27 lammps version bug Axel Kohlmeyer
09:44 [lammps-users] 2-27 lammps version bug Benjamin Beeler
08:51 Re: [lammps-users] How to use COMPASS Force Field for adsorption of Inhibitor molecules On Iron Surface Will Pisani
03:02 Re: [lammps-users] lj potential/polydisperse-colloid/epsilon Axel Kohlmeyer
02:46 [lammps-users] lj potential/polydisperse-colloid/epsilon Raghvendra P. Singh

March 03, 2020
23:05 [lammps-users] How to use COMPASS Force Field for adsorption of Inhibitor molecules On Iron Surface avinash007
21:45 Re: [lammps-users] hybrid atom styles and hybrid pair styles Yanggang
13:50 Re: [lammps-users] boundary condition when using kspace_style bahman daneshian
10:01 [lammps-users] Newbie question: how to relate MD results to thermodynamic derivatives? Ant Stone
09:07 Re: [lammps-users] boundary condition when using kspace_style Will Pisani
07:43 Re: [lammps-users] hybrid atom styles and hybrid pair styles Axel Kohlmeyer
05:35 Re: [lammps-users] PLUMED running issue Axel Kohlmeyer
05:27 [lammps-users] PLUMED running issue Radhika Holmes
02:07 Re: [lammps-users] Create chunk of rigid body Axel Kohlmeyer
01:35 [lammps-users] Create chunk of rigid body Mohammad Hossain
01:18 Re: [lammps-users] Na0.5Bi0.5TiO3 Axel Kohlmeyer

March 02, 2020
21:05 [lammps-users] Na0.5Bi0.5TiO3 Zizhen Zhou
20:36 [lammps-users] hybrid atom styles and hybrid pair styles Yanggang
17:34 Re: [lammps-users] Asking information regarding LAMMPS Axel Kohlmeyer
11:14 [lammps-users] boundary condition when using kspace_style bahman daneshian
08:21 [lammps-users] Asking information regarding LAMMPS SAHIRE ANSARY
08:19 Re: [lammps-users] [EXTERNAL] Re: question on the spin package Tranchida, Julien (-EXP)
06:53 Re: [lammps-users] [EXTERNAL] Fluctuations cubic-parallelepiped box Thompson, Aidan
06:42 [lammps-users] Fluctuations cubic-parallelepiped box Simona Focacci
01:17 Re: [lammps-users] Question on fix addtorque Axel Kohlmeyer

March 01, 2020
22:17 Re: [lammps-users] using if(factor_coul) or _lj to completely skip calculation loops Axel Kohlmeyer
21:15 [lammps-users] using if(factor_coul) or _lj to completely skip calculation loops Shern Tee
18:28 [lammps-users] Graphene temperature modeled with AIREBO potential Amir Afshar
14:31 [lammps-users] Question on fix addtorque Abolfazl Musavi
14:10 Re: [lammps-users] CORRECT PROTEIN TRAJECTORY FORMAT FOR VISUALIZATION Axel Kohlmeyer
13:59 [lammps-users] CORRECT PROTEIN TRAJECTORY FORMAT FOR VISUALIZATION Eduardo Estevez
11:57 Re: [lammps-users] Output from fix print Axel Kohlmeyer
11:03 [lammps-users] Output from fix print reza namakian
03:12 Re: [lammps-users] Atom count is inconsistent, cannot write restart file Theo Cronenberg
02:01 [lammps-users] problem with restart Paweł Wolski

February 29, 2020
20:47 Re: [lammps-users] [EXTERNAL] Re: question on the spin package Jay Wai
19:18 Re: [lammps-users] fcc (111) oriented lattice: how to propely specifiy dimensions to get perdiodic lattice Axel Kohlmeyer
16:19 Re: [lammps-users] fcc (111) oriented lattice: how to propely specifiy dimensions to get perdiodic lattice Frank Zack
12:48 Re: [lammps-users] Atom count is inconsistent, cannot write restart file Axel Kohlmeyer
12:47 Re: [lammps-users] Atom count is inconsistent, cannot write restart file Axel Kohlmeyer
12:08 Re: [lammps-users] Friction Coefficient in fix Langevin andri sharma
11:35 Re: [lammps-users] fcc (111) oriented lattice: how to propely specifiy dimensions to get perdiodic lattice Frank Zack
11:00 Re: [lammps-users] fcc (111) oriented lattice: how to propely specifiy dimensions to get perdiodic lattice Frank Zack
10:46 Re: [lammps-users] Atom count is inconsistent, cannot write restart file Theo Cronenberg
10:40 Re: [lammps-users] Atom count is inconsistent, cannot write restart file Axel Kohlmeyer
10:28 [lammps-users] Atom count is inconsistent, cannot write restart file Theo Cronenberg
09:23 [lammps-users] fcc (111) oriented lattice: how to propely specifiy dimensions to get perdiodic lattice Frank Zack
08:33 [lammps-users] 回复: About using both force fields in system da zhang
08:14 Re: [lammps-users] About using both force fields in system Axel Kohlmeyer
07:23 [lammps-users] About using both force fields in system da zhang
07:05 Re: [lammps-users] Friction Coefficient in fix Langevin Axel Kohlmeyer
05:02 [lammps-users] Friction Coefficient in fix Langevin andri sharma
01:50 Re: [lammps-users] reaxff with Cu/Ag/O Chung Suk Choi
00:57 Re: [lammps-users] reaxff with Cu/Ag/O Will Pisani
00:23 Re: [lammps-users] fix bond/create Will Pisani

February 28, 2020
19:30 [lammps-users] reaxff with Cu/Ag/O Chung Suk Choi
17:55 Re: [lammps-users] fix bond/create Andrew Jewett
08:51 Re: [lammps-users] [EXTERNAL] Re: question on the spin package Tranchida, Julien (-EXP)
08:30 Re: [lammps-users] question on the spin package Axel Kohlmeyer
08:29 Re: [lammps-users] Energy Minimization stuck Axel Kohlmeyer
07:58 [lammps-users] question on the spin package Jay Wai
07:53 [lammps-users] Energy Minimization stuck Mohamad Monazam
06:30 Re: [lammps-users] problem in building lammps on macOS Catalina (10.15.3) Axel Kohlmeyer
05:46 [lammps-users] temperature profile in the case of Couette flow shahin mohamadnejad
05:28 [lammps-users] problem in building lammps on macOS Catalina (10.15.3) Chandana Mondal
03:09 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla

February 27, 2020
16:38 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Moore, Stan
15:51 Re: [lammps-users] [EXTERNAL] Re: Device time info with KOKKOS-GPU and performance issue with KOKKOS Moore, Stan
15:36 Re: [lammps-users] TMD output Steve Plimpton
15:31 Re: [lammps-users] MSD not increasing with time for LiMn2O4 Steve Plimpton
15:27 Re: [lammps-users] bulk solid with bond_style Steve Plimpton
10:51 Re: [lammps-users] Error: Atom Sorting Bin Size 0 Axel Kohlmeyer
10:41 [lammps-users] Error: Atom Sorting Bin Size 0 Sanhita Pal
10:22 Re: [lammps-users] source file for defining units Axel Kohlmeyer
10:13 Re: [lammps-users] source file for defining units Samaneh Sadeghi
08:28 Re: [lammps-users] Issue with reax/c/species command global vectors Axel Kohlmeyer
06:52 Re: [lammps-users] Issue with reax/c/species command global vectors Axel Kohlmeyer
06:35 Re: [lammps-users] Issue with reax/c/species command global vectors Kritikos, Efstratios
06:17 Re: [lammps-users] Issue with reax/c/species command global vectors Kritikos, Efstratios
05:43 Re: [lammps-users] Issue with reax/c/species command global vectors Axel Kohlmeyer
05:21 [lammps-users] Issue with reax/c/species command global vectors Kritikos, Efstratios
05:03 Re: [lammps-users] Phase Transition of Nanoparticle in vaccum Axel Kohlmeyer
04:37 [lammps-users] viscosity via fix deform+implicit solvent / temperature issues Raghvendra P. Singh
00:25 [lammps-users] Phase Transition of Nanoparticle in vaccum Theo Cronenberg

February 26, 2020
22:58 Re: [lammps-users] source file for defining units Axel Kohlmeyer
22:53 Re: [lammps-users] compilation error "error: ‘Suffix’ is not a class or namespace" for LAMMPS (4 Feb 2020) Axel Kohlmeyer
21:30 [lammps-users] compilation error "error: ‘Suffix’ is not a class or namespace" for LAMMPS (4 Feb 2020) Cun Zhang
20:30 [lammps-users] source file for defining units Samaneh Sadeghi
13:54 Re: [lammps-users] Transforming a monoclinic supercell to orthogonal Pratt, Doug
13:24 Re: [lammps-users] Transforming a monoclinic supercell to orthogonal Axel Kohlmeyer
12:46 [lammps-users] Transforming a monoclinic supercell to orthogonal Pratt, Doug
12:04 Re: [lammps-users] the calculation data is "nan" Axel Kohlmeyer
11:59 [lammps-users] the calculation data is "nan" Chung Suk Choi
11:23 Re: [lammps-users] Problem with fix evaporation Axel Kohlmeyer
11:21 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla
10:47 [lammps-users] Problem with fix evaporation Atefeh Tarokh
09:39 Re: [lammps-users] Mass command vs set type mass Steve Plimpton
09:32 Re: [lammps-users] Mass command vs set type mass Steve Plimpton
06:01 Re: [lammps-users] Velocity discrepancy - Kinetic theory and MD using LAMMPS Axel Kohlmeyer
01:52 [lammps-users] Heterogeneous nucleation of a FeMnCrCoHigh Entropy Alloy M. MAHESHWARI
01:10 Re: [lammps-users] ERROR on proc 0: Particle outside surface of region used in fix wall/region Axel Kohlmeyer

February 25, 2020
23:58 [lammps-users] ERROR on proc 0: Particle outside surface of region used in fix wall/region vinoth m
18:30 [lammps-users] fep & system potential Lamm Gro
11:27 [lammps-users] energy drift when using fix rigid in 2d simulations Valerio Sorichetti
09:57 [lammps-users] energy drift when using fix rigid in 2d simulations Valerio Sorichetti
09:47 Re: [lammps-users] COMB3 bulk structure optimisation Axel Kohlmeyer
09:37 [lammps-users] Fwd: Velocity discrepancy - Kinetic theory and MD using LAMMPS Suman Chakraborty
09:32 [lammps-users] COMB3 bulk structure optimisation Science is the solution
09:05 [lammps-users] Re :Re: Ionic diffusion of lithium cation and TFSI kadjesteve7@...24...
06:08 Re: [lammps-users] Ionic diffusion of lithium cation and TFSI Agilio Padua
04:21 [lammps-users] Re :Re: Ionic diffusion of lithium cation and TFS kadjesteve7@...24...
04:18 Re: [lammps-users] Ionic diffusion of lithium cation and TFSI anion through the amorph POE Poly (oxyde)Ethylene Axel Kohlmeyer
03:31 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system Axel Kohlmeyer
02:42 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla

February 24, 2020
20:38 [lammps-users] Ionic diffusion of lithium cation and TFSI anion through the amorph POE Poly (oxyde)Ethylene kadjesteve7@...24...
15:44 [lammps-users] PhD Open Positions in Polymer Modeling and Machine Learning at University of Connecticut Li, Ying
12:05 Re: [lammps-users] visualization Will Pisani
10:03 Re: [lammps-users] visualization Navjot Kaur
07:43 Re: [lammps-users] user-package running on muliple cores 284237308
07:27 Re: [lammps-users] user-package running on muliple cores Axel Kohlmeyer
07:24 Re: [lammps-users] user-package running on muliple cores 284237308
06:33 Re: [lammps-users] Question about compute temp/chunk Axel Kohlmeyer
05:58 Re: [lammps-users] Mass command vs set type mass Axel Kohlmeyer
04:24 Re: [lammps-users] Mass command vs set type mass Paul Appshaw
04:13 [lammps-users] Question about compute temp/chunk shahin mohamadnejad

February 23, 2020
14:12 Re: [lammps-users] Possible Bug in read_data.cpp Sagar Patil
14:08 Re: [lammps-users] Possible Bug in read_data.cpp Will Pisani
13:57 Re: [lammps-users] Possible Bug in read_data.cpp Will Pisani
13:11 Re: [lammps-users] Possible Bug in read_data.cpp Axel Kohlmeyer
12:46 [lammps-users] Possible Bug in read_data.cpp Will Pisani
12:23 Re: [lammps-users] user-package running on muliple cores Axel Kohlmeyer
12:14 [lammps-users] user-package running on muliple cores 284237308
10:01 Re: [lammps-users] Mass command vs set type mass Axel Kohlmeyer
09:20 Re: [lammps-users] Mass command vs set type mass Paul Appshaw
05:24 [lammps-users] MSD not increasing with time for LiMn2O4 Ramavtar Tyagi

February 22, 2020
23:19 Re: [lammps-users] AIREBO force field for graphene Dr. SUNIL KUMAR
23:07 Re: [lammps-users] AIREBO force field for graphene Axel Kohlmeyer
17:25 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
17:00 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
16:58 Re: [lammps-users] AIREBO force field for graphene Dr. SUNIL KUMAR
16:37 Re: [lammps-users] AIREBO force field for graphene Axel Kohlmeyer
16:24 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
16:04 Re: [lammps-users] AIREBO force field for graphene Pascal Brault
15:00 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
12:31 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
11:16 Re: [lammps-users] AIREBO force field for graphene Will Pisani
11:07 Re: [lammps-users] visualization Will Pisani
09:50 Re: [lammps-users] AIREBO force field for graphene Ray Shan
09:11 Re: [lammps-users] Problems modelling tethered particle with angular momentum Bergen, J.R.
04:07 [lammps-users] Calculation of enthalp bahman daneshian

February 21, 2020
22:38 Re: [lammps-users] Centos8 break Thomas Leps
21:41 Re: [lammps-users] Centos8 break Axel Kohlmeyer
20:24 [lammps-users] Centos8 break Thomas Leps
17:41 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
15:47 Re: [lammps-users] visualization Navjot Kaur
15:33 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
15:20 Re: [lammps-users] How to remove a specific molecule type from a specific region? Axel Kohlmeyer
15:14 [lammps-users] How to remove a specific molecule type from a specific region? Atefeh Tarokh
15:09 Re: [lammps-users] AIREBO force field for graphene Will Pisani
15:07 Re: [lammps-users] Problems modelling tethered particle with angular momentum Axel Kohlmeyer
15:02 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
14:55 Re: [lammps-users] AIREBO force field for graphene Pascal Brault
14:41 Re: [lammps-users] visualization Will Pisani
14:38 Re: [lammps-users] visualization Navjot Kaur
14:36 Re: [lammps-users] visualization Will Pisani
14:31 Re: [lammps-users] AIREBO force field for graphene Will Pisani
14:26 Re: [lammps-users] visualization Navjot Kaur
14:19 Re: [lammps-users] visualization Will Pisani
14:18 Re: [lammps-users] bulk solid with bond_style Noam Bernstein
14:17 Re: [lammps-users] AIREBO force field for graphene Amir Afshar
14:09 Re: [lammps-users] AIREBO force field for graphene Pascal Brault
14:06 Re: [lammps-users] visualization Navjot Kaur
13:49 [lammps-users] AIREBO force field for graphene Amir Afshar
13:42 Re: [lammps-users] bulk solid with bond_style Axel Kohlmeyer
13:33 Re: [lammps-users] visualization Axel Kohlmeyer
13:32 [lammps-users] bulk solid with bond_style Noam Bernstein
13:26 Re: [lammps-users] visualization Will Pisani
13:15 Re: [lammps-users] visualization Navjot Kaur
13:09 [lammps-users] Size effect in the GK Method for finding thermal conductivity Khaled Mohamed Fawzy Badawy
12:56 Re: [lammps-users] Issues computing stress in a sdpd particles + fene springs system Axel Kohlmeyer
12:03 [lammps-users] Issues computing stress in a sdpd particles + fene springs system David Nieto Simavilla
10:11 [lammps-users] Problems modelling tethered particle with angular momentum Bergen, J.R.
09:18 Re: [lammps-users] Mass command vs set type mass Axel Kohlmeyer
08:59 Re: [lammps-users] Mass command vs set type mass Paul Appshaw
08:01 Re: [lammps-users] Mass command vs set type mass Axel Kohlmeyer
07:36 Re: [lammps-users] Mass command vs set type mass Paul Appshaw

February 20, 2020
21:33 Re: [lammps-users] visualization Will Pisani
16:26 Re: [lammps-users] MULTIPLE POTENTIALS IN DATA FILE AND INPUT FILE Axel Kohlmeyer
16:12 [lammps-users] MULTIPLE POTENTIALS IN DATA FILE AND INPUT FILE Eduardo Estevez
15:49 Re: [lammps-users] Mass command vs set type mass Axel Kohlmeyer
15:08 Re: [lammps-users] Mass command vs set type mass Steve Plimpton
10:48 Re: [lammps-users] visualization William Pisani
10:15 Re: [lammps-users] visualization Navjot Kaur
09:17 [lammps-users] Mass command vs set type mass Paul Appshaw
08:43 Re: [lammps-users] visualization William Pisani
06:41 [lammps-users] TMD output Xabier M. Aretxabaleta
02:19 Re: [lammps-users] Calculate RDF Axel Kohlmeyer
02:02 [lammps-users] Calculate RDF Mohammad Hossain

February 19, 2020
16:55 Re: [lammps-users] Calculation of MSD for multiple rigid body Steve Plimpton
16:52 Re: [lammps-users] lammps Steve Plimpton
16:26 Re: [lammps-users] visualization Navjot Kaur
15:08 Re: [lammps-users] visualization William Pisani
14:54 Re: [lammps-users] visualization Navjot Kaur
14:31 Re: [lammps-users] visualization William Pisani
14:26 Re: [lammps-users] visualization Navjot Kaur
14:04 Re: [lammps-users] visualization William Pisani
13:51 Re: [lammps-users] visualization Navjot Kaur
13:47 Re: [lammps-users] visualization William Pisani
13:38 Re: [lammps-users] visualization Navjot Kaur
13:28 Re: [lammps-users] visualization William Pisani
11:51 Re: [lammps-users] Cluster/atom doesn't group atoms within cutoff Axel Kohlmeyer
11:27 [lammps-users] Cluster/atom doesn't group atoms within cutoff Vu Nguyen
04:45 Re: [lammps-users] Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi
03:10 Re: [lammps-users] Device time info with KOKKOS-GPU and performance issue with KOKKOS Axel Kohlmeyer

February 18, 2020
20:43 Re: [lammps-users] Deposition on the surface of cylinder Axel Kohlmeyer
19:15 [lammps-users] Deposition on the surface of cylinder Chung Suk Choi
17:51 Re: [lammps-users] visualization William Pisani
17:16 [lammps-users] visualization Navjot Kaur
14:04 Re: [lammps-users] Calculation of MSD for multiple rigid body Mohammad Hossain
13:48 Re: [lammps-users] Calculation of MSD for multiple rigid body Axel Kohlmeyer
13:43 Re: [lammps-users] Calculation of MSD for multiple rigid body Mohammad Hossain
13:42 Re: [lammps-users] Lammps Axel Kohlmeyer
08:10 [lammps-users] Lammps İSMAİL AK
04:58 Re: [lammps-users] Radial distribution function and the Verlet integration timestep (dt) Mohammed Alhissi
04:43 [lammps-users] Device time info with KOKKOS-GPU and performance issue with KOKKOS Prithwish Nandi
00:30 [lammps-users] lammps İSMAİL AK

February 17, 2020
13:25 Re: [lammps-users] vashishta hybrid Xu, Wenting (xuwt)
12:46 Re: [lammps-users] vashishta hybrid Axel Kohlmeyer
11:03 Re: [lammps-users] Simulation of flow via creation/elimination of atoms at boundaries? Axel Kohlmeyer
10:03 [lammps-users] vashishta hybrid Xu, Wenting (xuwt)
06:52 [lammps-users] Simulation of flow via creation/elimination of atoms at boundaries? Boucher, Dr Derrick
02:42 Re: [lammps-users] Brownian dynamics simulation for planar shear Raghvendra P. Singh
02:29 Re: [lammps-users] Temperature in FixGCMC Bjørn Strøm
02:01 Re: [lammps-users] How to print kinetic energy for one group only? Axel Kohlmeyer
01:59 Re: [lammps-users] Velocity discrepancy - Kinetic theory and MD using LAMMPS Axel Kohlmeyer
00:51 [lammps-users] How to print kinetic energy for one group only? Theo Cronenberg
00:24 [lammps-users] Velocity discrepancy - Kinetic theory and MD using LAMMPS Suman Chakraborty

February 15, 2020
13:47 Re: [lammps-users] tfmc & spring/self reza namakian
05:28 Re: [lammps-users] Why the interaction potential parameters are not working for Iron-oxide nanoparticles? Axel Kohlmeyer
04:21 [lammps-users] Why the interaction potential parameters are not working for Iron-oxide nanoparticles? Sankhadeep Bose

February 14, 2020
22:30 Re: [lammps-users] Check overlapping between merged structures Axel Kohlmeyer
20:14 [lammps-users] Check overlapping between merged structures Amir Afshar
18:27 Re: [lammps-users] Calculation of MSD for multiple rigid body Axel Kohlmeyer
18:12 [lammps-users] Calculation of MSD for multiple rigid body Mohammad Hossain
15:40 Re: [lammps-users] difficality for using compute pair/local for group. Axel Kohlmeyer
15:27 [lammps-users] difficality for using compute pair/local for group. Mohammadreza Heidari Pebdani
14:01 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long Axel Kohlmeyer
13:46 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long William Pisani
13:32 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long Axel Kohlmeyer
13:16 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long William Pisani
13:13 Re: [lammps-users] QTB user package - result puzzles me Steve Plimpton
13:04 Re: [lammps-users] Lennard Jones wall pressure Steve Plimpton
12:59 Re: [lammps-users] tfmc & spring/self Steve Plimpton
12:16 Re: [lammps-users] Diffusion coefficient of tungsten from MSD Ankit Roy
11:48 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long Axel Kohlmeyer
11:03 [lammps-users] Atom Stuck at Harmonic Wall Tyler Schmidt
10:57 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long William Pisani
10:51 Re: [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long Axel Kohlmeyer
10:41 [lammps-users] Segmentation Fault with GPU and lj/class2/coul/long William Pisani
03:42 Re: [lammps-users] pair_style lj/sdk/soft and pair_style lj/sdk/coul/long/soft Axel Kohlmeyer
03:32 [lammps-users] pair_style lj/sdk/soft and pair_style lj/sdk/coul/long/soft Sibbu Dixit
02:04 [lammps-users] spatial profile of stress printing nidhi verma
01:30 Re: [lammps-users] Using ave/correlate/long outputs in variable Axel Kohlmeyer

February 13, 2020
20:06 Re: [lammps-users] A issue when using mpirun to run python script of lammps Axel Kohlmeyer
18:57 Re: [lammps-users] A issue when using mpirun to run python script of lammps 李吉辰
18:54 [lammps-users] Lennard Jones wall pressure Lamm Gro
18:38 Re: [lammps-users] compute MSD Lamm Gro
17:30 Re: [lammps-users] question about documentation Steve Plimpton
17:24 Re: [lammps-users] Using ave/correlate/long outputs in variable Steve Plimpton
17:20 Re: [lammps-users] Seeking a better method of particle looping Steve Plimpton
17:19 Re: [lammps-users] compute MSD Steve Plimpton
17:14 Re: [lammps-users] Brownian dynamics simulation for planar shear Steve Plimpton
17:08 Re: [lammps-users] QTB user package - result puzzles me Steve Plimpton
17:06 Re: [lammps-users] Diffusion coefficient of tungsten from MSD Steve Plimpton
17:00 Re: [lammps-users] shear value is negative? Steve Plimpton
16:57 Re: [lammps-users] Okay to add C++11 code to LAMMPS? Steve Plimpton
15:55 [lammps-users] tfmc & spring/self reza namakian
15:18 Re: [lammps-users] Equiliberating confined water with graphite sheets Amir Afshar
14:56 Re: [lammps-users] Equiliberating confined water with graphite sheets Amir Afshar
14:08 Re: [lammps-users] Equiliberating confined water with graphite sheets yahoo
13:54 [lammps-users] Equiliberating confined water with graphite sheets Amir Afshar
10:16 Re: [lammps-users] A issue when using mpirun to run python script of lammps lijichen365
10:07 Re: [lammps-users] A issue when using mpirun to run python script of lammps Axel Kohlmeyer
09:38 Re: [lammps-users] Using ave/correlate/long outputs in variable Germain Clavier
09:26 [lammps-users] A issue when using mpirun to run python script of lammps 李吉辰
09:06 Re: [lammps-users] Using ave/correlate/long outputs in variable Axel Kohlmeyer
08:29 [lammps-users] Using ave/correlate/long outputs in variable Germain Clavier
07:15 Re: [lammps-users] Error while building LAMMPS with gpu Axel Kohlmeyer
03:18 [lammps-users] Error while building LAMMPS with gpu Suleman Ansari (P19PH004)

February 12, 2020
18:01 Re: [lammps-users] Pair Probability using LAMMPS Ankit Roy
12:52 Re: [lammps-users] [EXTERNAL] Lammps version not working Jones, Keith
11:06 [lammps-users] Three Ph.D. Positions in Computational Atomistic Modeling Ma, Duancheng
00:39 Re: [lammps-users] What kind of cases can benefit a lot from pair_style of "table"? Axel Kohlmeyer
00:32 Re: [lammps-users] Pair Probability using LAMMPS Axel Kohlmeyer
00:28 Re: [lammps-users] question about documentation Axel Kohlmeyer

February 11, 2020
19:25 [lammps-users] Pair Probability using LAMMPS Ankit Roy
17:09 [lammps-users] What kind of cases can benefit a lot from pair_style of "table"? Zhen Xie
16:35 Re: [lammps-users] Lammps version not working Axel Kohlmeyer
16:29 [lammps-users] Lammps version not working Chung Suk Choi
14:42 Re: [lammps-users] how to get pe/atom into numpy array (using PyLammps) Axel Kohlmeyer
13:06 [lammps-users] how to get pe/atom into numpy array (using PyLammps) Murray Daw
11:43 [lammps-users] question about documentation Murray Daw
11:18 [lammps-users] Seeking a better method of particle looping Christian Tabedzki
06:16 Re: [lammps-users] compute_peratom() Axel Kohlmeyer
05:53 [lammps-users] compute_peratom() Gianluca GERARDI

February 10, 2020
23:59 [lammps-users] compute MSD Lamm Gro
23:54 Re: [lammps-users] How to simulate hitting/shooting a copper box with H+ ions? Axel Kohlmeyer
23:45 Re: [lammps-users] How to simulate hitting/shooting a copper box with H+ ions? Sami, Sayeed Nafis
23:36 Re: [lammps-users] How to use lookup table Axel Kohlmeyer
23:16 [lammps-users] How to use lookup table Zhen Xie
22:13 Re: [lammps-users] fix store/state segfault + setting eflag_atom from fix Axel Kohlmeyer
20:16 [lammps-users] fix store/state segfault + setting eflag_atom from fix Shern Tee
14:28 Re: [lammps-users] "Set" command for alloy systems Chung Suk Choi
12:08 Re: [lammps-users] "Set" command for alloy systems Axel Kohlmeyer
11:57 [lammps-users] "Set" command for alloy systems Chung Suk Choi
09:30 Re: [lammps-users] COMB3 - single point calculation (fixed optimisation) Axel Kohlmeyer
09:27 Re: [lammps-users] Problems restarting dynamics Axel Kohlmeyer
09:08 Re: [lammps-users] Questions about REAXFF package commands Kritikos, Efstratios
08:49 [lammps-users] COMB3 - single point calculation (fixed optimisation) Science is the solution
08:40 Re: [lammps-users] Problems restarting dynamics Steve Plimpton
07:33 Re: [lammps-users] Questions about REAXFF package commands Axel Kohlmeyer
07:18 Re: [lammps-users] Radial distribution function and the Verlet integration timestep (dt) Axel Kohlmeyer
07:14 [lammps-users] Questions about REAXFF package commands Kritikos, Efstratios
07:03 [lammps-users] fix bond/create ??????
07:00 [lammps-users] Radial distribution function and the Verlet integration timestep (dt) Mohammed Alhissi
01:12 Re: [lammps-users] How to simulate hitting/shooting a copper box with H+ ions? Axel Kohlmeyer
01:04 Re: [lammps-users] Yukawa pair_style to simulate dust in plasma Fathi Kamal Abdurrahman

February 09, 2020
16:49 [lammps-users] How to simulate hitting/shooting a copper box with H+ ions? Sami, Sayeed Nafis
16:29 Re: [lammps-users] Diffusion coefficient of tungsten from MSD Ankit Roy
15:34 [lammps-users] QTB user package - result puzzles me jorgen larsson
13:21 Re: [lammps-users] Yukawa pair_style to simulate dust in plasma Axel Kohlmeyer
05:45 [lammps-users] Yukawa pair_style to simulate dust in plasma Fathi Kamal Abdurrahman
05:38 [lammps-users] shear value is negative? Zheng Tan
01:21 Re: [lammps-users] WSe2 Axel Kohlmeyer
00:40 Re: [lammps-users] WSe2 sedigheh mousanezhad

February 08, 2020
06:12 Re: [lammps-users] 5 element equi-atomic system Sandeep Kumar Singh
05:56 Re: [lammps-users] 5 element equi-atomic system Axel Kohlmeyer
05:54 Re: [lammps-users] Implementing TIP4P/2005 Axel Kohlmeyer
05:52 Re: [lammps-users] 5 element equi-atomic system Sandeep Kumar Singh
05:31 Re: [lammps-users] Average Atom Inter-atomic potential for random alloys Axel Kohlmeyer
05:15 Re: [lammps-users] Average Atom Inter-atomic potential for random alloys Axel Kohlmeyer
04:56 [lammps-users] Average Atom Inter-atomic potential for random alloys Sandeep Kumar Singh
04:09 Re: [lammps-users] 5 element equi-atomic system Sandeep Kumar Singh
04:07 Re: [lammps-users] 5 element equi-atomic system Axel Kohlmeyer

February 07, 2020
22:50 [lammps-users] 5 element equi-atomic system Sandeep Kumar Singh
22:18 Re: [lammps-users] Fwd: fix pour gravity direction Yechen Tang
16:30 Re: [lammps-users] Interatomic potential - Indices for the local atoms Axel Kohlmeyer
16:29 Re: [lammps-users] Okay to add C++11 code to LAMMPS? Andrew Jewett
16:03 Re: [lammps-users] Interatomic potential - Indices for the local atoms Gurjot Dhaliwal
15:55 Re: [lammps-users] Problems restarting dynamics Axel Kohlmeyer
15:44 Re: [lammps-users] Okay to add C++11 code to LAMMPS? Axel Kohlmeyer
14:27 Re: [lammps-users] WSe2 Axel Kohlmeyer
12:35 Re: [lammps-users] Units metals / Default unit of energy in LAMMPS calculator DYLAN ANSTINE
11:59 [lammps-users] WSe2 sedigheh mousanezhad
11:42 [lammps-users] Units metals / Default unit of energy in LAMMPS calculator Abid Channa
10:52 Re: [lammps-users] Implementing TIP4P/2005 jamal kazazi
10:07 Re: [lammps-users] Guidelines for creating a simple data file for LJ+FENE simulations Steve Plimpton
10:05 Re: [lammps-users] Brownian dynamics simulation for planar shear Steve Plimpton
10:02 [lammps-users] Guidelines for creating a simple data file for LJ+FENE simulations Amir Sadeghi
09:59 Re: [lammps-users] Lammps compiling with ASE Steve Plimpton
09:57 Re: [lammps-users] Problems restarting dynamics Steve Plimpton
09:50 Re: [lammps-users] Create multiple rigid body Steve Plimpton
09:47 Re: [lammps-users] Fwd: fix pour gravity direction Steve Plimpton
09:38 Re: [lammps-users] Segmentation fault at high total number of timesteps Axel Kohlmeyer
08:22 Re: [lammps-users] Segmentation fault at high total number of timesteps Kritikos, Efstratios
06:56 Re: [lammps-users] Incorrect crystal orientation on outside of periodic simulation box Morrissey, Liam S.
04:48 Re: [lammps-users] Implementing TIP4P/2005 Axel Kohlmeyer
04:36 Re: [lammps-users] Segmentation fault at high total number of timesteps Axel Kohlmeyer
04:08 Re: [lammps-users] Can LAMMPS model radiation Manoj Warrier

February 06, 2020
23:04 Re: [lammps-users] Okay to add C++11 code to LAMMPS? Andrew Jewett
18:41 Re: [lammps-users] Fwd: fix pour gravity direction Yechen Tang
18:05 [lammps-users] Okay to add C++11 code to LAMMPS? Andrew Jewett
16:44 Re: [lammps-users] Atom missing problems in bond break simulation 徐浩
16:20 Re: [lammps-users] Segmentation fault at high total number of timesteps Kritikos, Efstratios
13:30 [lammps-users] Implementing TIP4P/2005 jamal kazazi
13:30 [lammps-users] Problems restarting dynamics Oscar Gutiérrez
10:50 Re: [lammps-users] Using electric field for solute+solvent system Axel Kohlmeyer
10:43 Re: [lammps-users] Create multiple rigid body Axel Kohlmeyer
10:39 Re: [lammps-users] Segmentation fault at high total number of timesteps Axel Kohlmeyer
10:34 [lammps-users] Create multiple rigid body Mohammad Hossain
10:10 Re: [lammps-users] Incorrect crystal orientation on outside of periodic simulation box Steve Plimpton
09:39 [lammps-users] Call for Abstracts: SES - Advances In Polymer Modeling And Simulations Doris
08:37 [lammps-users] Segmentation fault at high total number of timesteps Kritikos, Efstratios
06:27 Re: [lammps-users] Fwd: fix pour gravity direction Steve Plimpton
06:11 Re: [lammps-users] Incorrect crystal orientation on outside of periodic simulation box Julien Guénolé
03:52 [lammps-users] Lammps compiling with ASE Abid Channa

February 05, 2020
18:37 [lammps-users] Fwd: fix pour gravity direction Yechen Tang
18:28 [lammps-users] Using electric field for solute+solvent system longkun xu
17:11 Re: [lammps-users] Can LAMMPS model radiation Axel Kohlmeyer
17:04 Re: [lammps-users] Can LAMMPS model radiation Jake Dorin
16:26 Re: [lammps-users] Can LAMMPS model radiation Axel Kohlmeyer
16:20 Re: [lammps-users] Can LAMMPS model radiation Collin Wilkinson
15:58 Re: [lammps-users] How can I do this - Create an FCC Copper System with hydrogen atoms placed at random positions to observe diffusion Andrew Jewett
15:44 [lammps-users] Can LAMMPS model radiation Jake Dorin
15:35 Re: [lammps-users] [EXTERNAL] Re: gcmc - Non-numeric positions - simulation unstable Thompson, Aidan
15:32 Re: [lammps-users] [EXTERNAL] Fix GCMC - Number of inserted molecules different with changing insertion frequency Thompson, Aidan
11:55 [lammps-users] Incorrect crystal orientation on outside of periodic simulation box Morrissey, Liam S.
10:26 [lammps-users] Brownian dynamics simulation for planar shear Ethayaraja Mani
09:09 [lammps-users] Problem with using hardy stress in LAMMPS abhiram br
08:37 Re: [lammps-users] Does lammps support computation of Intermediate Scattering function? Axel Kohlmeyer
06:20 [lammps-users] Does lammps support computation of Intermediate Scattering function? Mohammed Alhissi
05:53 Re: [lammps-users] Code for Calculating MSD Steve Plimpton
05:48 Re: [lammps-users] Need Help !! Steve Plimpton
04:21 Re: [lammps-users] Peptide example fails with USER-INTEL package Axel Kohlmeyer
04:05 Re: [lammps-users] Problem with using hardy stress in LAMMPS Axel Kohlmeyer
03:59 Re: [lammps-users] MEAM potential for Al 7075 Axel Kohlmeyer
00:53 Re: [lammps-users] MEAM potential for Al 7075 isra muscati

February 04, 2020
21:03 [lammps-users] Peptide example fails with USER-INTEL package Jonathan D. Halverson
17:05 [lammps-users] Need Help !! Faiz, Umer Sarwar
16:51 [lammps-users] (no subject) Sayeed Nafis
16:48 [lammps-users] Code for Calculating MSD Sayeed Nafis
12:31 Re: [lammps-users] Accessing drude ID in a fix Steve Plimpton
12:27 Re: [lammps-users] CoCrFeMnNi inter atomic potential Steve Plimpton
12:23 Re: [lammps-users] Regarding the meam potential Steve Plimpton
12:11 Re: [lammps-users] How can I do this - Create an FCC Copper System with hydrogen atoms placed at random positions to observe diffusion Sami, Sayeed Nafis
12:04 Re: [lammps-users] How can I do this - Create an FCC Copper System with hydrogen atoms placed at random positions to observe diffusion Sami, Sayeed Nafis
10:18 Re: [lammps-users] NEB Steve Plimpton
10:13 Re: [lammps-users] comb 2010 lattice constant of alpha quartz Steve Plimpton
10:10 [lammps-users] Fix GCMC - Number of inserted molecules different with changing insertion frequency MD Simulation
10:06 Re: [lammps-users] Quasi-static tensile simulation - Temperature control Steve Plimpton
10:02 Re: [lammps-users] shear stress calculation Steve Plimpton
09:59 Re: [lammps-users] thestress-strain curve in bcc Fe with an edge dislocation Steve Plimpton
09:57 Re: [lammps-users] Diffusion coefficient of tungsten from MSD Steve Plimpton
09:51 Re: [lammps-users] minimisation after temperature increase. Axel Kohlmeyer
07:45 Re: [lammps-users] Your opinion/advice on an interatomic potential for MoSSe systems? Steve Plimpton
07:42 Re: [lammps-users] temp/berendsen problem Steve Plimpton
07:40 Re: [lammps-users] compute MSD on a triclinic box Steve Plimpton
07:37 Re: [lammps-users] Temperature in FixGCMC Steve Plimpton
07:29 Re: [lammps-users] Regarding LAMMPS Steve Plimpton
07:08 Re: [lammps-users] Regarding analysis using OVITO DYLAN ANSTINE
05:08 Re: [lammps-users] MEAM library error 3 meaning? Axel Kohlmeyer
02:20 [lammps-users] minimisation after temperature increase. nidhi verma

February 03, 2020
23:14 [lammps-users] Regarding analysis using OVITO M. MAHESHWARI
22:59 Re: [lammps-users] MEAM library error 3 meaning? Sandeep Kumar Singh
20:45 Re: [lammps-users] How can I do this - Create an FCC Copper System with hydrogen atoms placed at random positions to observe diffusion Andrew Jewett
19:25 Re: [lammps-users] [EXTERNAL] Re: MPI vs OpenMP and Moore, Stan
17:35 [lammps-users] How can I do this - Create an FCC Copper System with hydrogen atoms placed at random positions to observe diffusion Sami, Sayeed Nafis
04:38 Re: [lammps-users] MEAM Library error during a run Axel Kohlmeyer
04:37 Re: [lammps-users] MEAM library error 3 meaning? Axel Kohlmeyer
03:34 Re: [lammps-users] MEAM library error 3 meaning? Sandeep Kumar Singh
02:34 [lammps-users] MEAM Library error during a run Sandeep Kumar Singh

February 02, 2020
05:02 Re: [lammps-users] Fix Setforce issue Axel Kohlmeyer
04:49 Re: [lammps-users] Interatomic potential - Indices for the local atoms Axel Kohlmeyer

February 01, 2020
18:40 Re: [lammps-users] Interatomic potential - Indices for the local atoms Gurjot Dhaliwal
13:35 Re: [lammps-users] MEAM potential for Al 7075 Axel Kohlmeyer
04:48 [lammps-users] MEAM potential for Al 7075 isra muscati
04:38 [lammps-users] GCMC - different number of atoms with number of MC exchanges MD Simulation
01:51 [lammps-users] Fix Setforce issue Zeta Text

January 30, 2020
09:31 Re: [lammps-users] create amphiphilic particle Axel Kohlmeyer
09:21 Re: [lammps-users] timing-breakdown and acceleration Axel Kohlmeyer
08:48 Re: [lammps-users] MPI vs OpenMP and Axel Kohlmeyer
08:39 Re: [lammps-users] timing-breakdown and acceleration Prithwish Nandi
08:30 Re: [lammps-users] timing-breakdown and acceleration Axel Kohlmeyer
07:42 [lammps-users] timing-breakdown and acceleration Prithwish Nandi
07:40 [lammps-users] MPI vs OpenMP and Prithwish Nandi
07:35 [lammps-users] create amphiphilic particle Mohammad Hossain
06:17 Re: [lammps-users] Interatomic potential - Indices for the local atoms Axel Kohlmeyer
05:34 [lammps-users] Interatomic potential - Indices for the local atoms Gurjot Dhaliwal

January 29, 2020
19:12 Re: [lammps-users] Accessing drude ID in a fix Axel Kohlmeyer
18:44 [lammps-users] Accessing drude ID in a fix Anne B
18:08 Re: [lammps-users] GCMC+NVT Density of flexible CO2 at dense phase Douglas
11:39 Re: [lammps-users] NEED HELP! Axel Kohlmeyer
11:12 [lammps-users] NEED HELP! Faiz, Umer Sarwar
10:41 Re: [lammps-users] fix npt/cauchy, fix setforce, fix balance Axel Kohlmeyer
10:12 [lammps-users] fix npt/cauchy, fix setforce, fix balance reza namakian
06:49 Re: [lammps-users] compute pair/local command: error on dump local output depending on the cutoff style Gianluca GERARDI
03:18 [lammps-users] compute stress Zheng Tan
02:54 [lammps-users] compute pair/local command: error on dump local output depending on the cutoff style Gianluca GERARDI

January 28, 2020
20:34 Re: [lammps-users] Dynamic creation of core-drude pairs Axel Kohlmeyer
19:48 [lammps-users] Dynamic creation of core-drude pairs Anne B
14:36 Re: [lammps-users] [EXTERNAL] Re: Setting the elapsed time Jones, Keith
14:22 Re: [lammps-users] Setting the elapsed time Axel Kohlmeyer
14:17 [lammps-users] Setting the elapsed time Jones, Keith
13:48 Re: [lammps-users] gcmc - Non-numeric positions - simulation unstable MD Simulation
12:28 Re: [lammps-users] gcmc - Non-numeric positions - simulation unstable Axel Kohlmeyer
08:27 Re: [lammps-users] gcmc - Non-numeric positions - simulation unstable MD Simulation

January 27, 2020
23:09 [lammps-users] CoCrFeMnNi inter atomic potential Sandeep Kumar Singh
14:58 [lammps-users] gcmc - Non-numeric positions - simulation unstable MD Simulation
04:53 [lammps-users] Regarding the meam potential M. MAHESHWARI

January 26, 2020
11:37 Re: [lammps-users] Query Faiz, Umer Sarwar

January 25, 2020
18:51 Re: [lammps-users] how to determine "extra/bond/per/atom" Axel Kohlmeyer
16:05 [lammps-users] how to determine "extra/bond/per/atom" MD Simulation
12:58 Re: [lammps-users] GCMC Git example - Atoms count not increasing MD Simulation
12:49 [lammps-users] GCMC Git example - Atoms count not increasing MD Simulation
09:05 Re: [lammps-users] pair_style vashishta bahman daneshian

January 24, 2020
20:39 Re: [lammps-users] Query Andrew Jewett
17:23 Re: [lammps-users] [EXTERNAL] Incorporation of ACKS2 into Kokkos Reax package in LAMMPS Moore, Stan
16:56 Re: [lammps-users] [EXTERNAL] Re: kspace modify with slab nozforce Moore, Stan
16:50 Re: [lammps-users] [EXTERNAL] Re: Lammps ewald parameters for water gas density Moore, Stan
16:48 Re: [lammps-users] pair_style vashishta Ray Shan
16:36 Re: [lammps-users] [EXTERNAL] Re: Warnings with KoKKOs cuda - calling a __host__ function from a __host__ __device__ function is not allowed Moore, Stan
16:34 Re: [lammps-users] [EXTERNAL] Re: Can't distribute threads among GPUs Moore, Stan
16:30 Re: [lammps-users] [EXTERNAL] Re: Porting Pair-styles in Kokkos Moore, Stan
15:19 [lammps-users] Query Faiz, Umer Sarwar
10:21 Re: [lammps-users] Bulk structure visualisation output Axel Kohlmeyer
09:42 [lammps-users] Bulk structure visualisation output Science is the solution
06:35 Re: [lammps-users] pair_style vashishta bahman daneshian
02:56 [lammps-users] NEB Nitin Chaudhary
01:31 Re: [lammps-users] PyLammps hanging in parallel execution Ευάγγελος Βογιατζής

January 23, 2020
19:47 Re: [lammps-users] pair_style vashishta Ray Shan
15:20 Re: [lammps-users] dpd/tstat in GPU program causes atoms don't move Changnian Han
15:06 Re: [lammps-users] output a compute calculated in loop Axel Kohlmeyer
14:30 [lammps-users] output a compute calculated in loop sepideh Kavousi
13:57 Re: [lammps-users] PyLammps hanging in parallel execution Axel Kohlmeyer
13:30 Re: [lammps-users] pair_style vashishta bahman daneshian
13:16 Re: [lammps-users] pair_style vashishta Pascal Brault
13:13 Re: [lammps-users] fix_modify dynamic/dof for fix deposit Pascal Brault
13:11 Re: [lammps-users] fix_modify dynamic/dof for fix deposit Pascal Brault
12:29 Re: [lammps-users] pair_style vashishta bahman daneshian
12:29 [lammps-users] fix_modify dynamic/dof for fix deposit MD Simulation
10:35 [lammps-users] PyLammps hanging in parallel execution Ευάγγελος Βογιατζής
09:41 Re: [lammps-users] dpd/tstat in GPU program causes atoms don't move Axel Kohlmeyer
09:01 Re: [lammps-users] Lubricate/Brownian colloid particles not working Axel Kohlmeyer
08:53 Re: [lammps-users] Warnings with KoKKOs cuda - calling a __host__ function from a __host__ __device__ function is not allowed Axel Kohlmeyer
08:49 Re: [lammps-users] Lammps ewald parameters for water gas density Axel Kohlmeyer
08:47 Re: [lammps-users] pair_style vashishta Pascal Brault
08:15 [lammps-users] pair_style vashishta bahman daneshian
02:00 [lammps-users] Warnings with KoKKOs cuda - calling a __host__ function from a __host__ __device__ function is not allowed Naga Vydyanathan
01:54 Re: [lammps-users] Lubricate/Brownian colloid particles not working Hector Rusinque

January 22, 2020
22:08 Re: [lammps-users] Installing Python wrapper for LAMMPS Axel Kohlmeyer
21:31 [lammps-users] Installing Python wrapper for LAMMPS Gengör , Görkem
19:19 [lammps-users] dpd/tstat in GPU program causes atoms don't move Changnian Han
16:47 [lammps-users] comb 2010 lattice constant of alpha quartz Xu, Wenting (xuwt)
14:12 Re: [lammps-users] Lammps ewald parameters for water gas density Jo
13:24 Re: [lammps-users] How to get values computed in another chunk for any atom ? Olivier Politano
12:39 Re: [lammps-users] How to get values computed in another chunk for any atom ? Axel Kohlmeyer
12:18 Re: [lammps-users] How to get values computed in another chunk for any atom ? Axel Kohlmeyer
09:22 Re: [lammps-users] How to get values computed in another chunk for any atom ? Olivier Politano
08:52 Re: [lammps-users] How to get values computed in another chunk for any atom ? Axel Kohlmeyer
08:35 Re: [lammps-users] How to get values computed in another chunk for any atom ? Olivier Politano
08:16 Re: [lammps-users] How to get values computed in another chunk for any atom ? Axel Kohlmeyer
08:02 Re: [lammps-users] How to get values computed in another chunk for any atom ? Faiz, Umer Sarwar
07:46 Re: [lammps-users] How to get values computed in another chunk for any atom ? Axel Kohlmeyer
07:42 Re: [lammps-users] LJ potential temperature Axel Kohlmeyer
07:39 Re: [lammps-users] Polymer grafting on a surface Axel Kohlmeyer
07:37 Re: [lammps-users] Running Lammps Axel Kohlmeyer
07:31 Re: [lammps-users] lammps stops generating file but continues to run on the machine Axel Kohlmeyer
05:46 [lammps-users] Running Lammps Moe E
04:01 Re: [lammps-users] ocl_get_devices doesn't find GPU, but NVIDIA's ocl_device_query does find GPU Maksim

January 21, 2020
20:36 [lammps-users] Polymer grafting on a surface Praveen Kumar
19:33 Re: [lammps-users] Using electric field in LAMMPS Axel Kohlmeyer
15:07 [lammps-users] lammps stops generating file but continues to run on the machine Abdullah, Sharmin
11:30 [lammps-users] Quasi-static tensile simulation - Temperature control Sina Zarepakzad
10:49 Re: [lammps-users] Error using hybrid for airebo Pascal Brault
10:36 [lammps-users] Error using hybrid for airebo 1185201182
10:18 [lammps-users] LJ potential temperature Navjot Kaur
08:43 Re: [lammps-users] ocl_get_devices doesn't find GPU, but NVIDIA's ocl_device_query does find GPU Maksim
08:32 Re: [lammps-users] ocl_get_devices doesn't find GPU, but NVIDIA's ocl_device_query does find GPU Maksim

January 20, 2020
18:32 Re: [lammps-users] About running lammps in windows Axel Kohlmeyer
16:14 Re: [lammps-users] About running lammps in windows Dezhao Huang
15:24 [lammps-users] About running lammps in windows yao li
13:49 Re: [lammps-users] computre group/group vs pe/atom MD Simulation
13:47 Re: [lammps-users] computre group/group vs pe/atom Axel Kohlmeyer
13:30 Re: [lammps-users] computre group/group vs pe/atom Axel Kohlmeyer
12:59 Re: [lammps-users] computre group/group vs pe/atom MD Simulation
12:30 Re: [lammps-users] computre group/group vs pe/atom Axel Kohlmeyer
09:53 Re: [lammps-users] computre group/group vs pe/atom Axel Kohlmeyer
09:38 Re: [lammps-users] computre group/group vs pe/atom MD Simulation
09:26 Re: [lammps-users] computre group/group vs pe/atom Axel Kohlmeyer
09:22 Re: [lammps-users] computre group/group vs pe/atom MD Simulation
09:15 Re: [lammps-users] computre group/group vs pe/atom Axel Kohlmeyer
09:05 [lammps-users] computre group/group vs pe/atom MD Simulation
08:44 [lammps-users] How to get values computed in another chunk for any atom ? Olivier Politano
06:44 [lammps-users] shear stress calculation Zheng Tan
06:11 Re: [lammps-users] Bond atom missing - Rerun MD Simulation
05:37 Re: [lammps-users] Bond atom missing - Rerun Axel Kohlmeyer
05:36 Re: [lammps-users] Neb Axel Kohlmeyer
05:16 [lammps-users] Bond atom missing - Rerun MD Simulation
05:16 [lammps-users] thestress-strain curve in bcc Fe with an edge dislocation Zheng Tan
05:15 Re: [lammps-users] Using electric field in LAMMPS Axel Kohlmeyer

January 19, 2020
23:06 [lammps-users] Using electric field in LAMMPS longkun xu
21:12 [lammps-users] Neb Nitin Chaudhary
16:33 [lammps-users] Diffusion coefficient of tungsten from MSD Ankit Roy

January 18, 2020
05:49 Re: [lammps-users] ocl_get_devices doesn't find GPU, but NVIDIA's ocl_device_query does find GPU Axel Kohlmeyer

January 17, 2020
16:47 [lammps-users] ocl_get_devices doesn't find GPU, but NVIDIA's ocl_device_query does find GPU William Pisani
14:53 Re: [lammps-users] Upcoming stable LAMMPS version Pierre de Buyl
14:36 Re: [lammps-users] LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Axel Kohlmeyer
12:27 [lammps-users] LAMMPS Developer/Researcher Needed Brian Parker
11:35 Re: [lammps-users] LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Ritesh Jagatramka

January 16, 2020
14:33 Re: [lammps-users] LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Axel Kohlmeyer
14:20 Re: [lammps-users] LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Ritesh Jagatramka
14:04 [lammps-users] Fwd: LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Ritesh Jagatramka
14:02 Re: [lammps-users] LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Axel Kohlmeyer
13:32 [lammps-users] LAMMPS sandia: Help needed to understand the algorithm that LAMMPS uses to calculate the potential energy of the system. Ritesh Jagatramka
12:34 [lammps-users] Upcoming stable LAMMPS version Axel Kohlmeyer
09:44 Re: [lammps-users] Add electrode in LAMMPS Axel Kohlmeyer
00:10 [lammps-users] Your opinion/advice on an interatomic potential for MoSSe systems? S Swayamjyoti

January 15, 2020
18:17 Re: [lammps-users] hybrid/overlay for pairwise potential with many-body potential Andrew Jewett
17:47 Re: [lammps-users] hybrid/overlay for pairwise potential with many-body potential Axel Kohlmeyer
17:17 [lammps-users] hybrid/overlay for pairwise potential with many-body potential Jo
15:56 Re: [lammps-users] Invalid atom ID in Dihedrals section of data file Axel Kohlmeyer
15:20 Re: [lammps-users] Add electrode in LAMMPS longkun xu
14:29 Re: [lammps-users] LJ potential Axel Kohlmeyer
13:29 Re: [lammps-users] LJ potential Navjot Kaur
13:27 Re: [lammps-users] LJ potential Axel Kohlmeyer
13:26 Re: [lammps-users] LJ potential Navjot Kaur
12:40 Re: [lammps-users] LJ potential Axel Kohlmeyer
12:37 [lammps-users] LJ potential Navjot Kaur
09:46 [lammps-users] Invalid atom ID in Dihedrals section of data file alberto
09:31 Re: [lammps-users] Add electrode in LAMMPS Axel Kohlmeyer
05:52 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Xiaoyu Chen
05:40 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Xiaoyu Chen

January 14, 2020
17:32 [lammps-users] Add electrode in LAMMPS longkun xu
11:57 [lammps-users] Lubricate/Brownian colloid particles not working Hector Rusinque
08:23 Re: [lammps-users] Re-enable colvars from binary file using read_restart Giacomo Fiorin
08:07 Re: [lammps-users] Re-enable colvars from binary file using read_restart Axel Kohlmeyer
07:30 Re: [lammps-users] PPTA (Kevlar) buckling problem during imposing a temperature with ReaxFF Giacomo Fiorin
02:45 Re: [lammps-users] Re-enable colvars from binary file using read_restart Julen Mendieta Esteban

January 13, 2020
15:45 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Peter Wirnsberger
13:24 Re: [lammps-users] PPTA (Kevlar) buckling problem during imposing a temperature with ReaxFF Giacomo Fiorin
13:01 [lammps-users] temp/berendsen problem hossain khan
12:13 Re: [lammps-users] stress-strain curve MASATO KOIZUMI
09:18 [lammps-users] compute MSD on a triclinic box Zhao Fan
06:28 Re: [lammps-users] Re-enable colvars from binary file using read_restart Julen Mendieta Esteban
05:26 [lammps-users] stress-strain curve ??????
03:15 [lammps-users] PPTA (Kevlar) buckling problem during imposing a temperature with ReaxFF 松井 直輝

January 12, 2020
22:37 Re: [lammps-users] question about changing units Axel Kohlmeyer
22:30 Re: [lammps-users] question about changing units Yanggang
21:10 Re: [lammps-users] question about changing units Axel Kohlmeyer
20:12 [lammps-users] question about changing units Yanggang
08:31 Re: [lammps-users] How to connect atoms in different layers with independent springs? Axel Kohlmeyer
07:14 Re: [lammps-users] How to connect atoms in different layers with independent springs? Xing Yang
06:12 Re: [lammps-users] How to connect atoms in different layers with independent springs? Axel Kohlmeyer
06:06 Re: [lammps-users] Segmentation fault with pair_style bop Axel Kohlmeyer
06:04 Re: [lammps-users] Segmentation fault with pair_style bop Axel Kohlmeyer
05:35 Re: [lammps-users] Segmentation fault with pair_style bop 谢家旺
04:05 [lammps-users] How to connect atoms in different layers with independent springs? Xing Yang

January 11, 2020
18:45 [lammps-users] What LAMMPS users should know about OpenKIM Ellad Tadmor
13:31 Re: [lammps-users] Inconsistent short range energy with g++ compiler and intel compiler Axel Kohlmeyer
13:00 Re: [lammps-users] Inconsistent short range energy with g++ compiler and intel compiler Xiang Gao
12:22 Re: [lammps-users] Inconsistent short range energy with g++ compiler and intel compiler Axel Kohlmeyer
12:19 Re: [lammps-users] Segmentation fault with pair_style bop Axel Kohlmeyer
11:51 Re: [lammps-users] Inconsistent short range energy with g++ compiler and intel compiler Xiang Gao
09:35 Re: [lammps-users] Programming question regarding bond and angle Axel Kohlmeyer
09:29 [lammps-users] Fwd: Problem with compute ke/atom Axel Kohlmeyer
05:22 [lammps-users] Inconsistent short range energy with g++ compiler and intel compiler Xiang Gao
03:03 [lammps-users] Segmentation fault with pair_style bop 谢家旺

January 10, 2020
23:33 [lammps-users] Error detecting MPI while building 9Jan2020 Vishnu V. Krishnan
21:16 [lammps-users] Programming question regarding bond and angle Jianlan Ye
12:55 Re: [lammps-users] Re-enable colvars from binary file using read_restart Giacomo Fiorin
12:05 Re: [lammps-users] Re-enable colvars from binary file using read_restart Axel Kohlmeyer
10:50 Re: [lammps-users] memory_usage_return_type Diaz,Adrian
10:28 Re: [lammps-users] memory_usage_return_type Axel Kohlmeyer
10:15 Re: [lammps-users] memory_usage_return_type Diaz,Adrian
10:12 Re: [lammps-users] memory_usage_return_type Axel Kohlmeyer
10:05 [lammps-users] memory_usage_return_type Diaz,Adrian
08:54 [lammps-users] Re-enable colvars from binary file using read_restart Julen Mendieta Esteban
07:28 [lammps-users] Temperature in FixGCMC Bjørn Strøm
06:47 Re: [lammps-users] Problem with adapt charge in combination with kspace Axel Kohlmeyer
04:35 [lammps-users] Problem with adapt charge in combination with kspace Florian Deißenbeck
04:25 Re: [lammps-users] fix bond/break Axel Kohlmeyer
01:11 [lammps-users] 回复: Alpha Quartz unit cell structure da zhang

January 09, 2020
22:09 [lammps-users] Regarding LAMMPS SAHIRE ANSARY
21:07 Re: [lammps-users] fix bond/break SEUK James
13:20 Re: [lammps-users] lammps as python library Axel Kohlmeyer
13:15 Re: [lammps-users] lammps as python library Alessio Alexiadis
12:35 Re: [lammps-users] lammps as python library Axel Kohlmeyer
12:17 [lammps-users] lammps as python library Alessio Alexiadis
11:47 Re: [lammps-users] fix bond/break SEUK James
10:20 Re: [lammps-users] Are benchmarks available for comparing single-threaded LAMMPS performance in recent CPUS? (specifically Ryzen 3900X vs 3950X) Bergen, J.R.
07:36 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Xiaoyu Chen
06:52 Re: [lammps-users] Alpha Quartz unit cell structure Axel Kohlmeyer
06:47 Re: [lammps-users] [moltemplate specific] HUA WONG
06:46 Re: [lammps-users] 回复: fix deform command Axel Kohlmeyer
06:45 [lammps-users] Alpha Quartz unit cell structure da zhang
06:43 Re: [lammps-users] Lammps ewald parameters for water gas density Axel Kohlmeyer
04:04 [lammps-users] [moltemplate specific] HUA WONG
03:15 Re: [lammps-users] lj vs real and velocity rescaling Raghvendra P. Singh

January 08, 2020
23:10 [lammps-users] ?????? fix deform command ??????
22:25 [lammps-users] PhD position at CSIR - NML Dr. SUNIL KUMAR
21:54 Re: [lammps-users] Computing peratom contributions from different individual pair styles Anne B
21:47 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
21:17 Re: [lammps-users] Computing peratom contributions from different individual pair styles Anne B
20:15 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
19:58 Re: [lammps-users] Computing peratom contributions from different individual pair styles Anne B
17:26 Re: [lammps-users] fix bond/break Steve Plimpton
17:23 Re: [lammps-users] log file extract Steve Plimpton
17:20 Re: [lammps-users] lj vs real and velocity rescaling Steve Plimpton
17:17 Re: [lammps-users] Computing peratom contributions from different individual pair styles Steve Plimpton
15:31 [lammps-users] Software engineer for Porting KIM to Windows Ellad Tadmor
14:28 [lammps-users] Lammps ewald parameters for water gas density Jo
11:16 [lammps-users] Calculating dislocation density form output files Azmain Faek Islam
09:57 Re: [lammps-users] Grain boundary in 5 elements system Ankit Roy
09:28 Re: [lammps-users] N^(4/3) runtime scaling? Robert Hoy
09:20 Re: [lammps-users] N^(4/3) runtime scaling? Robert Hoy
07:13 Re: [lammps-users] fix deform command Axel Kohlmeyer
07:05 Re: [lammps-users] Are benchmarks available for comparing single-threaded LAMMPS performance in recent CPUS? (specifically Ryzen 3900X vs 3950X) Axel Kohlmeyer
06:47 Re: [lammps-users] neb command Axel Kohlmeyer
06:31 [lammps-users] fix deform command ??????

January 07, 2020
21:16 [lammps-users] neb command Nitin Chaudhary
19:12 Re: [lammps-users] Lammps dynamic group Axel Kohlmeyer
19:08 Re: [lammps-users] Fix bond/react runs but No reaction occurs Jacob Gissinger
18:55 Re: [lammps-users] Lammps dynamic group zangx371
17:12 Re: [lammps-users] Fix deposit and creating new particles Andrew Jewett
14:46 Re: [lammps-users] N^(4/3) runtime scaling? Diaz,Adrian
14:36 Re: [lammps-users] N^(4/3) runtime scaling? Axel Kohlmeyer
13:41 Re: [lammps-users] Problem with shrinking the simulation box Stanard Mebwe P.
13:26 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Xiaoyu Chen
12:41 Re: [lammps-users] Problem with shrinking the simulation box Axel Kohlmeyer
11:56 [lammps-users] N^(4/3) runtime scaling? Robert Hoy
10:35 Re: [lammps-users] Problem with shrinking the simulation box Axel Kohlmeyer
10:27 Re: [lammps-users] Problem with shrinking the simulation box Stanard Mebwe P.
10:22 Re: [lammps-users] Lammps dynamic group Axel Kohlmeyer
10:20 Re: [lammps-users] lj vs real and velocity rescaling Axel Kohlmeyer
10:16 Re: [lammps-users] Problem with shrinking the simulation box Axel Kohlmeyer
05:20 [lammps-users] Problem with shrinking the simulation box Stanard Mebwe P.
04:30 [lammps-users] lj vs real and velocity rescaling Raghvendra P. Singh
00:35 [lammps-users] Lammps dynamic group zangx371

January 06, 2020
20:39 Re: [lammps-users] Computing peratom contributions from different individual pair styles Anne B
20:33 [lammps-users] Fix bond/react runs but No reaction occurs Gurmeet Singh
16:35 Re: [lammps-users] Are benchmarks available for comparing single-threaded LAMMPS performance in recent CPUS? (specifically Ryzen 3900X vs 3950X) Bergen, J.R.
13:45 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
12:39 Re: [lammps-users] Are benchmarks available for comparing single-threaded LAMMPS performance in recent CPUS? (specifically Ryzen 3900X vs 3950X) Axel Kohlmeyer
12:30 Re: [lammps-users] Grain boundary in 5 elements system Axel Kohlmeyer
10:11 Re: [lammps-users] Orient in lammps lattice command Axel Kohlmeyer
09:49 [lammps-users] Orient in lammps lattice command Sandeep Kumar Singh
09:35 Re: [lammps-users] Grain boundary in 5 elements system Ankit Roy
08:22 [lammps-users] Are benchmarks available for comparing single-threaded LAMMPS performance in recent CPUS? (specifically Ryzen 3900X vs 3950X) Bergen, J.R.
08:00 Re: [lammps-users] log file extract Steve Plimpton
07:47 Re: [lammps-users] how to use fix ave/chunk command output stress Axel Kohlmeyer
07:42 Re: [lammps-users] Using the GPU package via the python interface Axel Kohlmeyer
07:28 [lammps-users] Using the GPU package via the python interface Ευάγγελος Βογιατζής
06:22 Re: [lammps-users] command to reorient H atom in a circle with fixed angle and OH bond Axel Kohlmeyer
06:15 Re: [lammps-users] temperature of relaxation Axel Kohlmeyer
05:52 [lammps-users] temperature of relaxation KIKI
03:36 [lammps-users] how to use fix ave/chunk command output stress Zhang, Anying

January 05, 2020
23:36 [lammps-users] command to reorient H atom in a circle with fixed angle and OH bond liyi bai
02:09 Re: [lammps-users] Can't distribute threads among GPUs 郑宇恒
02:00 [lammps-users] Can't distribute threads among GPUs 郑宇恒

January 04, 2020
20:08 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
20:03 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
19:40 Re: [lammps-users] Computing peratom contributions from different individual pair styles Anne B
19:35 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
19:21 Re: [lammps-users] Computing peratom contributions from different individual pair styles Anne B
17:16 Re: [lammps-users] Query Faiz, Umer Sarwar
17:01 Re: [lammps-users] Query Wang, Jiaqi
15:43 Re: [lammps-users] Query Axel Kohlmeyer
15:15 Re: [lammps-users] Query Faiz, Umer Sarwar
14:31 Re: [lammps-users] Problem implementing custom EAM style between atoms of dissimilar types only Axel Kohlmeyer
14:16 Re: [lammps-users] Query Axel Kohlmeyer
13:52 [lammps-users] Problem implementing custom EAM style between atoms of dissimilar types only Anne B
11:54 [lammps-users] Query Faiz, Umer Sarwar
09:42 Re: [lammps-users] Gay-Berne for discotics Giacomo Saielli

January 03, 2020
21:42 Re: [lammps-users] log file extract hossain khan
21:07 [lammps-users] log file extract hossain khan
20:42 Re: [lammps-users] Atom missing problems in bond break simulation Jacob Gissinger
19:55 [lammps-users] 回复:Re: How to shock velocity (us) and the particle velocity (up), i.e.Hugoniot curve Mr. ZHAN
16:17 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Peter Wirnsberger
15:42 Re: [lammps-users] Regarding EAM potential: how to obtain embedding enegy Steve Plimpton
15:35 Re: [lammps-users] gcmc with fix rigid/nvt/small Steve Plimpton
15:34 Re: [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Steve Plimpton
15:31 Re: [lammps-users] How to shock velocity (us) and the particle velocity (up), i.e.Hugoniot curve Steve Plimpton
15:18 Re: [lammps-users] Is it possible to apply a static electrostatic field from a matrix in an external file? Axel Kohlmeyer
15:05 Re: [lammps-users] Fix deposit and creating new particles Axel Kohlmeyer
15:02 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Zhou, Xiaowang
14:39 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Wang, Jiaqi
14:08 Re: [lammps-users] Can lammps calculate the shear modulus under the hydrostatic pressure? Steve Plimpton
13:59 Re: [lammps-users] LJ potential Steve Plimpton
13:55 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Steve Plimpton
13:46 Re: [lammps-users] delete atoms from dynamic group Steve Plimpton
13:36 [lammps-users] Fix deposit and creating new particles Anna Lappala
13:34 Re: [lammps-users] 回复: question about msd/chunk Steve Plimpton
13:29 Re: [lammps-users] Gay-Berne for discotics Steve Plimpton
13:27 Re: [lammps-users] fix bond/break Steve Plimpton
13:20 Re: [lammps-users] problem in the atom coordinates exceeding the box length Steve Plimpton
13:17 Re: [lammps-users] look for lammps command Steve Plimpton
13:09 Re: [lammps-users] Question about fix_modify Steve Plimpton
13:02 Re: [lammps-users] Preparing complex system information for the input script Steve Plimpton
10:21 [lammps-users] Is it possible to apply a static electrostatic field from a matrix in an external file? Quijano, Cecilia B.
00:01 Re: [lammps-users] Potential Energy at Finite Temprature Axel Kohlmeyer

January 02, 2020
22:23 [lammps-users] Potential Energy at Finite Temprature reza namakian
21:16 Re: [lammps-users] Computing peratom contributions from different individual pair styles Axel Kohlmeyer
20:24 [lammps-users] Computing peratom contributions from different individual pair styles Anne B
14:44 Re: [lammps-users] Disabling PyLammps native Parallelization Collin Wilkinson
13:09 Re: [lammps-users] Disabling PyLammps native Parallelization Axel Kohlmeyer
13:00 [lammps-users] Disabling PyLammps native Parallelization Collin Wilkinson
12:52 Re: [lammps-users] how to control temp. in initial steps Hossein H
11:40 Re: [lammps-users] Help needed with Energy minimization using Monte Carlo for Quartz using Buck Potential Axel Kohlmeyer
11:23 Re: [lammps-users] Unreasonable water temperatures Axel Kohlmeyer
05:06 [lammps-users] Unreasonable water temperatures Huaqiang LIU

January 01, 2020
21:22 Re: [lammps-users] Help needed with Energy minimization using Monte Carlo for Quartz using Buck Potential Sanchari Sen
16:35 Re: [lammps-users] how to control temp. in initial steps Axel Kohlmeyer
16:30 Re: [lammps-users] Time-dependent Pairwise Force Axel Kohlmeyer
16:14 Re: [lammps-users] Time-dependent Pairwise Force Victor Wei
15:56 Re: [lammps-users] Atom missing problems in bond break simulation Jacob Gissinger
14:49 Re: [lammps-users] Atom missing problems in bond break simulation 徐浩
11:54 Re: [lammps-users] Atom missing problems in bond break simulation Jacob Gissinger
07:58 [lammps-users] how to control temp. in initial steps Hossein H
00:03 Re: [lammps-users] Atom missing problems in bond break simulation 徐浩

December 31, 2019
00:20 [lammps-users] Why does total energy drop in Compression part at first? Asadollahzadeh

December 30, 2019
20:30 [lammps-users] Regarding EAM potential: how to obtain embedding enegy Wang, Jiaqi
19:51 Re: [lammps-users] Grain boundary in 5 elements system Axel Kohlmeyer
19:36 Re: [lammps-users] Grain boundary in 5 elements system Ankit Roy
15:56 Re: [lammps-users] Pair_style hybrid with SW and Tersoff Potential Axel Kohlmeyer
15:27 [lammps-users] Pair_style hybrid with SW and Tersoff Potential Victor Fabiyi
15:00 Re: [lammps-users] Time-dependent Pairwise Force Axel Kohlmeyer
14:01 Re: [lammps-users] Time-dependent Pairwise Force Victor Wei
07:46 Re: [lammps-users] problem with amorphization Ali shargh
07:45 Re: [lammps-users] Help needed with Energy minimization using Monte Carlo for Quartz using Buck Potential Axel Kohlmeyer
05:27 [lammps-users] Help needed with Energy minimization using Monte Carlo for Quartz using Buck Potential Sanchari Sen
03:49 [lammps-users] Fwd: update of dynamic groups Carol Baruffi

December 29, 2019
15:22 Re: [lammps-users] colvars giving error when using lammps restart file Axel Kohlmeyer
13:09 Re: [lammps-users] colvars giving error when using lammps restart file jamal kazazi
10:04 [lammps-users] gcmc with fix rigid/nvt/small 284237308

December 28, 2019
20:21 Re: [lammps-users] Grain boundary in 5 elements system Axel Kohlmeyer
19:53 [lammps-users] Grain boundary in 5 elements system Ankit Roy
10:03 Re: [lammps-users] colvars giving error when using lammps restart file Giacomo Fiorin

December 27, 2019
22:05 [lammps-users] nonconservation of energy with fix ehex, fix nve and fix rattle command Xiaoyu Chen
17:16 Re: [lammps-users] Atom missing problems in bond break simulation Jacob Gissinger
15:51 Re: [lammps-users] Atom missing problems in bond break simulation 徐浩
12:31 Re: [lammps-users] Velocity autocorrelation function Axel Kohlmeyer
12:09 Re: [lammps-users] Bond atoms * * missing on proc * at step * Axel Kohlmeyer
12:00 Re: [lammps-users] Define a new region Axel Kohlmeyer
11:52 Re: [lammps-users] Switching off electrostatic interactions between TIP4P Water molecules Axel Kohlmeyer
10:45 [lammps-users] Switching off electrostatic interactions between TIP4P Water molecules HAJIAHMADI FARMAHINI Amir
04:40 Re: [lammps-users] problem with amorphization Axel Kohlmeyer

December 26, 2019
18:42 Re: [lammps-users] Atom missing problems in bond break simulation 徐浩
14:52 [lammps-users] problem with amorphization Ali shargh
10:29 Re: [lammps-users] Bond atoms * * missing on proc * at step * MASATO KOIZUMI
10:19 [lammps-users] Define a new region Victor Wei
06:54 Re: [lammps-users] Temperature during relaxation Axel Kohlmeyer
04:45 Re: [lammps-users] Problems about combining fix bond/react and fix gcmc #XIA XIUYANG#
03:22 [lammps-users] Temperature during relaxation KIKI

December 25, 2019
20:51 [lammps-users] How to shock velocity (us) and the particle velocity (up), i.e.Hugoniot curve Mr. ZHAN
20:50 Re: [lammps-users] Atom missing problems in bond break simulation Jacob Gissinger
20:25 Re: [lammps-users] Problems about combining fix bond/react and fix gcmc Jacob Gissinger
20:09 Re: [lammps-users] Atom missing problems in bond break simulation 徐浩
19:38 [lammps-users] Bond atoms * * missing on proc * at step * ??????
18:49 Re: [lammps-users] Compute Wall-Atom PE S M
18:38 Re: [lammps-users] Compute Wall-Atom PE Axel Kohlmeyer
18:11 [lammps-users] Compute Wall-Atom PE S M
18:05 Re: [lammps-users] Atom missing problems in bond break simulation Jacob Gissinger
16:34 [lammps-users] Velocity autocorrelation function Hand Zenia
15:52 Re: [lammps-users] Atom missing problems in bond break simulation Axel Kohlmeyer
11:14 Re: [lammps-users] A problem with compute temp/com command saly jackson
10:12 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Vimal Muthusamy
10:05 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Axel Kohlmeyer
10:03 Re: [lammps-users] A problem with compute temp/com command Axel Kohlmeyer
09:56 [lammps-users] Atom missing problems in bond break simulation 徐浩
09:53 Re: [lammps-users] A problem with compute temp/com command saly jackson
09:51 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Vimal Muthusamy
09:38 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Vimal Muthusamy
09:34 Re: [lammps-users] A problem with compute temp/com command Axel Kohlmeyer
09:25 Re: [lammps-users] A problem with compute temp/com command saly jackson
08:57 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Axel Kohlmeyer
08:44 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Vimal Muthusamy
08:22 Re: [lammps-users] Can lammps calculate the shear modulus under the hydrostatic pressure? 1198193933
08:08 Re: [lammps-users] Porting Pair-styles in Kokkos Axel Kohlmeyer
08:03 Re: [lammps-users] Compute stress / atom - Group form expression (PBC) Axel Kohlmeyer
07:44 [lammps-users] Compute stress / atom - Group form expression (PBC) Vimal Muthusamy
07:42 [lammps-users] Porting Pair-styles in Kokkos Callan Wood
07:17 Re: [lammps-users] A problem with compute temp/com command Axel Kohlmeyer
07:03 Re: [lammps-users] GPU package issue on Windows Axel Kohlmeyer
06:58 Re: [lammps-users] compute pair/local for TIP4P/2005 potential Axel Kohlmeyer
06:53 Re: [lammps-users] Can lammps calculate the shear modulus under the hydrostatic pressure? Axel Kohlmeyer
06:19 [lammps-users] A problem with compute temp/com command saly jackson
05:18 Re: [lammps-users] angular displacement Axel Kohlmeyer
03:55 [lammps-users] angular displacement SHRAVANI NETHI .

December 24, 2019
22:02 [lammps-users] Can lammps calculate the shear modulus under the hydrostatic pressure? 1198193933
04:56 [lammps-users] colvars giving error when using lammps restart file jamal kazazi
02:44 [lammps-users] Problems about combining fix bond/react and fix gcmc #XIA XIUYANG#
01:01 [lammps-users] compute pair/local for TIP4P/2005 potential Shuang Luo

December 23, 2019
16:02 Re: [lammps-users] neigh_modify command Diaz,Adrian
04:12 [lammps-users] GPU package issue on Windows Dima Shyrokorad
04:10 [lammps-users] neigh_modify command Yasti Ghala

December 22, 2019
18:59 [lammps-users] ?????? A problem with using ILP potential Voidshatter
09:16 Re: [lammps-users] log file when using 'run every' 284237308@...1204...
07:55 [lammps-users] A problem with using ILP potential Voidshatter
02:26 [lammps-users] problem of increasing temperature Xiaoyu

December 21, 2019
09:15 Re: [lammps-users] log file when using 'run every' Axel Kohlmeyer
09:08 [lammps-users] log file when using 'run every' 284237308
08:35 Re: [lammps-users] How to perform reaxFF simulation using several parameter files Axel Kohlmeyer
07:56 [lammps-users] How to perform reaxFF simulation using several parameter files Hossein H
00:12 Re: [lammps-users] write_data and current value of computes Carol Baruffi

December 20, 2019
15:18 Re: [lammps-users] appending colvars output to file Giacomo Fiorin
14:06 Re: [lammps-users] FIX NPT with LiTFSI+water using OPLSAA Axel Kohlmeyer
13:48 [lammps-users] appending colvars output to file Ali Morshedi
13:21 Re: [lammps-users] write_data and current value of computes Axel Kohlmeyer
09:10 [lammps-users] FIX NPT with LiTFSI+water using OPLSAA Tribeni Roy
09:06 [lammps-users] update of dynamic groups Carol Baruffi
03:17 [lammps-users] write_data and current value of computes Carol Baruffi

December 19, 2019
17:21 Re: [lammps-users] Calculating viscosity Monir Hosseini Anvari
14:20 Re: [lammps-users] intel memory usage Jesse Carter
13:57 Re: [lammps-users] intel memory usage Brown, Michael W
13:19 [lammps-users] intel memory usage Jesse Carter
07:54 Re: [lammps-users] USER-INTEL with non-orthogonal box Nithin Mathew
07:38 Re: [lammps-users] Using a neighborlist in a custom fix Axel Kohlmeyer
07:33 Re: [lammps-users] Using a neighborlist in a custom fix Diaz,Adrian
07:25 Re: [lammps-users] Using a neighborlist in a custom fix Johannes P . Dürholt
07:01 Re: [lammps-users] Using a neighborlist in a custom fix Diaz,Adrian
01:02 Re: [lammps-users] Using a neighborlist in a custom fix Johannes P . Dürholt
00:21 [lammps-users] 回复: 回复: 回复: diffusion da zhang

December 18, 2019
20:37 Re: [lammps-users] 回复: 回复: diffusion Wang, Jiaqi
19:56 [lammps-users] 回复: 回复: diffusion da zhang
18:46 [lammps-users] 回复: diffusion da zhang
16:54 Re: [lammps-users] Using a neighborlist in a custom fix Diaz,Adrian
16:26 Re: [lammps-users] Using a neighborlist in a custom fix Diaz,Adrian
14:27 Re: [lammps-users] USER-INTEL with non-orthogonal box Brown, Michael W
09:06 Re: [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file Giacomo Fiorin
08:53 [lammps-users] Lattice parameter value Ramavtar Tyagi
08:29 Re: [lammps-users] diffusion Wang, Jiaqi
06:37 [lammps-users] diffusion da zhang

December 17, 2019
20:57 Re: [lammps-users] bond/react help Jacob Gissinger
13:24 Re: [lammps-users] angular velocity coordinate Pierre de Buyl
13:08 Re: [lammps-users] angular velocity coordinate Axel Kohlmeyer
12:24 [lammps-users] LJ potential Navjot Kaur
12:20 [lammps-users] angular velocity coordinate masoud ataee
11:53 [lammps-users] bond/react help Sinha Sumit
07:32 Re: [lammps-users] Lammps integrator adapt charge Axel Kohlmeyer
06:50 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS HUA WONG
04:37 Re: [lammps-users] Lammps integrator adapt charge Florian Deißenbeck
03:53 Re: [lammps-users] Problem regarding fix rigid Axel Kohlmeyer
00:11 [lammps-users] Problem regarding fix rigid Vijay Reddy

December 16, 2019
15:04 Re: [lammps-users] Calculation of ionic conductivity in polymer system Surendra Singh
14:58 Re: [lammps-users] Calculation of ionic conductivity in polymer system Axel Kohlmeyer
14:56 Re: [lammps-users] Calculation of ionic conductivity in polymer system Axel Kohlmeyer
14:48 [lammps-users] Calculation of ionic conductivity in polymer system Surendra Singh
13:14 Re: [lammps-users] I want to calculate the angular velocity of a fulleren at the Coordinate Body Mass Center Axel Kohlmeyer
13:02 Re: [lammps-users] GPU acceleration on RTX 2060 ?? windows version Axel Kohlmeyer
12:37 [lammps-users] I want to calculate the angular velocity of a fulleren at the Coordinate Body Mass Center masoud ataee
11:50 [lammps-users] GPU acceleration on RTX 2060 ?? windows version Maksim
10:21 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS Axel Kohlmeyer
09:42 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS HUA WONG
09:20 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS Axel Kohlmeyer
09:02 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS HUA WONG
08:37 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS Axel Kohlmeyer
08:17 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Zhou, Xiaowang
08:15 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Zhou, Xiaowang
07:33 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS h wong
07:08 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Wang, Jiaqi
06:01 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Ward, Donald

December 15, 2019
21:17 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Zhou, Xiaowang
20:54 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Axel Kohlmeyer
19:47 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Wang, Jiaqi
19:32 Re: [lammps-users] [EXTERNAL] Re: BOP potential cannot proceed with multiple cores Ward, Donald
18:48 Re: [lammps-users] BOP potential cannot proceed with multiple cores Axel Kohlmeyer
12:14 Re: [lammps-users] USER-INTEL with non-orthogonal box Brown, Michael W

December 14, 2019
21:05 [lammps-users] BOP potential cannot proceed with multiple cores Wang, Jiaqi
07:07 Re: [lammps-users] 回复: 回复: (无主题) Axel Kohlmeyer
07:01 [lammps-users] ?????? ?????? (??????) KIKI
05:30 Re: [lammps-users] 回复: (无主题) Axel Kohlmeyer
01:37 [lammps-users] ?????? (??????) KIKI

December 13, 2019
17:34 Re: [lammps-users] Cylinder with reflecting boundary. Diljith T
15:44 Re: [lammps-users] USER-INTEL with non-orthogonal box Nithin Mathew
15:01 Re: [lammps-users] (无主题) Axel Kohlmeyer
14:56 Re: [lammps-users] USER-INTEL with non-orthogonal box Axel Kohlmeyer
14:53 Re: [lammps-users] Cylinder with reflecting boundary. Axel Kohlmeyer
05:29 Re: [lammps-users] Lammps integrator adapt charge Axel Kohlmeyer
05:22 [lammps-users] Lammps integrator adapt charge Florian Deißenbeck

December 12, 2019
21:11 [lammps-users] Cylinder with reflecting boundary. Diljith T
17:05 Re: [lammps-users] Compute used in variable between runs is not current Sally Li
16:50 Re: [lammps-users] Compute used in variable between runs is not current Diaz,Adrian
16:46 Re: [lammps-users] Compute used in variable between runs is not current Sally Li
15:37 [lammps-users] USER-INTEL with non-orthogonal box Nithin Mathew
15:25 Re: [lammps-users] Compute used in variable between runs is not current Diaz,Adrian
15:04 Re: [lammps-users] Compute used in variable between runs is not current Axel Kohlmeyer
14:51 [lammps-users] Compute used in variable between runs is not current Sally Li
11:55 Re: [lammps-users] About potential with erfc term in it Ali shargh
11:45 Re: [lammps-users] About potential with erfc term in it Axel Kohlmeyer
11:14 [lammps-users] About potential with erfc term in it Ali shargh
11:10 Re: [lammps-users] delete atoms from dynamic group Axel Kohlmeyer
10:58 Re: [lammps-users] Issue with lattice command Axel Kohlmeyer
10:30 Re: [lammps-users] Issue with lattice command reza namakian
07:33 [lammps-users] delete atoms from dynamic group Peter Parker
02:24 [lammps-users] Postdoc/group leader job offer Julien Guénolé
02:21 Re: [lammps-users] Query regarding using reduced LJ units for system with charges Axel Kohlmeyer
02:06 Re: [lammps-users] Issue with lattice command Axel Kohlmeyer
01:09 [lammps-users] Issue with lattice command reza namakian

December 11, 2019
23:39 Re: [lammps-users] Query regarding using reduced LJ units for system with charges Mithun Radhakrishna
19:59 [lammps-users] (??????) KIKI
19:21 [lammps-users] 回复: question about msd/chunk da zhang
15:24 Re: [lammps-users] (no subject) Andrew Jewett
13:26 Re: [lammps-users] (no subject) Andrew Jewett
12:04 Re: [lammps-users] Looking for a similar many body potentials Diaz,Adrian
11:38 Re: [lammps-users] How to calculate velocity of shock wave Ray Shan
11:29 Re: [lammps-users] (no subject) Axel Kohlmeyer
11:28 Re: [lammps-users] Apply tension in a isolated crystall in vacuum Axel Kohlmeyer
11:26 [lammps-users] (no subject) Navjot Kaur
10:57 [lammps-users] Apply tension in a isolated crystall in vacuum Tuanan Lourenço
10:43 [lammps-users] Looking for a similar many body potentials Julian Travis
07:19 Re: [lammps-users] Looking for help compiling LAMMPS + POEMS Axel Kohlmeyer
07:01 Re: [lammps-users] Query regarding using reduced LJ units for system with charges Axel Kohlmeyer
06:59 Re: [lammps-users] Angles update Axel Kohlmeyer
06:57 [lammps-users] Looking for help compiling LAMMPS + POEMS HUA WONG
06:44 [lammps-users] Query regarding using reduced LJ units for system with charges Mithun Radhakrishna
06:21 [lammps-users] Gay-Berne for discotics Giacomo Saielli
05:59 [lammps-users] Angles update Fabio Ferri S244152
05:54 [lammps-users] How to calculate velocity of shock wave 詹胜鹏
05:20 Re: [lammps-users] COMB3 example Axel Kohlmeyer
05:15 [lammps-users] COMB3 example Science is the solution
04:44 Re: [lammps-users] dump molfile Pascal Brault
04:40 Re: [lammps-users] dump molfile Axel Kohlmeyer
03:46 Re: [lammps-users] dump molfile Pascal Brault
00:54 [lammps-users] question about msd/chunk da zhang

December 10, 2019
20:24 [lammps-users] the different crystal planes of single crystal silicon KIKI
20:08 Re: [lammps-users] fix bond/break SEUK James
19:56 Re: [lammps-users] fix bond/break Andrew Jewett
19:13 Re: [lammps-users] (no subject) Andrew Jewett
14:42 [lammps-users] (no subject) Navjot Kaur
14:07 Re: [lammps-users] dump molfile Pascal Brault
13:34 [lammps-users] problem in the atom coordinates exceeding the box length Mengwei Yu
13:32 Re: [lammps-users] dump molfile Axel Kohlmeyer
13:18 Re: [lammps-users] fix bond/break SEUK James
13:03 Re: [lammps-users] dump molfile Pascal Brault
12:41 Re: [lammps-users] Copy results - lammpstrj file Monir Hosseini Anvari
12:30 Re: [lammps-users] Copy results - lammpstrj file Axel Kohlmeyer
11:40 Re: [lammps-users] Copy results - lammpstrj file Simona Focacci
11:31 Re: [lammps-users] dump molfile Axel Kohlmeyer
11:30 Re: [lammps-users] Copy results - lammpstrj file Axel Kohlmeyer
11:24 [lammps-users] Copy results - lammpstrj file Simona Focacci
11:15 Re: [lammps-users] dump molfile Pascal Brault
11:09 Re: [lammps-users] dump molfile Axel Kohlmeyer
10:27 Re: [lammps-users] dump molfile Pascal Brault
10:00 Re: [lammps-users] Calculating viscosity Monir Hosseini Anvari
09:28 Re: [lammps-users] dump molfile Axel Kohlmeyer
08:28 Re: [lammps-users] dump molfile Pascal Brault
08:27 Re: [lammps-users] dump molfile Pascal Brault
07:19 Re: [lammps-users] look for lammps command 严锐
05:52 Re: [lammps-users] look for lammps command 严锐

December 09, 2019
23:44 [lammps-users] Question about fix_modify reza namakian
21:32 Re: [lammps-users] Latest GPU support Dmitry Z
17:51 Re: [lammps-users] Calculating viscosity Axel Kohlmeyer
17:26 Re: [lammps-users] comb3 potential in mpi Axel Kohlmeyer
16:07 Re: [lammps-users] Using a neighborlist in a custom fix Axel Kohlmeyer
15:03 Re: [lammps-users] [EXTERNAL] Re: SPIN package: variable timestep and heat transfer Tranchida, Julien (-EXP)
14:29 [lammps-users] Calculating viscosity Monir Hosseini Anvari
14:24 Re: [lammps-users] comb3 potential in mpi hossain khan
13:46 [lammps-users] Using a neighborlist in a custom fix Johannes P . Dürholt
09:34 Re: [lammps-users] look for lammps command Axel Kohlmeyer
09:31 Re: [lammps-users] look for lammps command Axel Kohlmeyer
09:03 Re: [lammps-users] look for lammps command 严锐
08:27 Re: [lammps-users] look for lammps command Diaz,Adrian
07:58 [lammps-users] look for lammps command 严锐
07:32 [lammps-users] Call for proposal for 2021 ICTP Scientific programmes Axel Kohlmeyer
06:55 Re: [lammps-users] please help me!propelled particles Pierre de Buyl
04:55 Re: [lammps-users] fe3o4 Axel Kohlmeyer
04:50 Re: [lammps-users] SPIN package: variable timestep and heat transfer Axel Kohlmeyer
04:47 Re: [lammps-users] fix bond/break Axel Kohlmeyer

December 08, 2019
20:24 [lammps-users] fix bond/break SEUK James
18:59 [lammps-users] SPIN package: variable timestep and heat transfer
10:28 [lammps-users] fe3o4 shahriar dadras
09:31 Re: [lammps-users] Coupling Lammps to Fortran Axel Kohlmeyer
08:43 Re: [lammps-users] Coupling Lammps to Fortran Alireza Shadloo
08:19 Re: [lammps-users] Use plumed with lammps for umbrella sampling Axel Kohlmeyer
07:11 [lammps-users] Use plumed with lammps for umbrella sampling Mayank
06:48 [lammps-users] The formula of stress by fix deform 宋青亮
06:39 [lammps-users] The formula of stress by fix deform 宋青亮
02:10 Re: [lammps-users] Coupling Lammps to Fortran Alireza Shadloo

December 07, 2019
22:55 Re: [lammps-users] Preparing complex system information for the input script Mijiddorj B
11:55 Re: [lammps-users] Truncated vs Truncated-Shifted LJ Vaidyanathan M.S
09:35 [lammps-users] Truncated vs Truncated-Shifted LJ Vaidyanathan M.S
02:35 [lammps-users] Coupling Lammps to Fortran Alireza Shadloo
01:29 [lammps-users] 回复: how about Calculating custom angles da zhang

December 06, 2019
20:29 Re: [lammps-users] Asking information regarding LAMMPS Andrew Jewett
12:36 Re: [lammps-users] Dipoles Switching Axel Kohlmeyer
12:35 Re: [lammps-users] MPI issue Zhao Fan
12:21 Re: [lammps-users] Dipoles Switching Hamed Nobarani
12:00 Re: [lammps-users] MPI issue Axel Kohlmeyer
11:45 [lammps-users] MPI issue Zhao Fan
09:57 Re: [lammps-users] Use compute pe/atom with hybrid pair_style Axel Kohlmeyer
09:46 Re: [lammps-users] dump molfile Pascal Brault
09:43 Re: [lammps-users] dump molfile Axel Kohlmeyer
09:02 [lammps-users] Use compute pe/atom with hybrid pair_style Giovanni Del Monte
08:45 Re: [lammps-users] MgO bulk structure simulation Science is the solution
08:43 [lammps-users] dump molfile Pascal Brault
08:41 Re: [lammps-users] [lammbs-users] nanocluster simulation (invalide : Pair_style & kspace) Science is the solution
05:18 Re: [lammps-users] MgO bulk structure simulation Axel Kohlmeyer
05:15 Re: [lammps-users] peridynamics eps model Alessio Alexiadis
05:13 Re: [lammps-users] compute hexorder/atom question Axel Kohlmeyer
05:11 Re: [lammps-users] Asking information regarding LAMMPS Axel Kohlmeyer
05:08 Re: [lammps-users] peridynamics eps model Axel Kohlmeyer
05:06 Re: [lammps-users] comb3 potential in mpi Axel Kohlmeyer
05:03 Re: [lammps-users] Dipoles Switching Axel Kohlmeyer
04:58 Re: [lammps-users] please help me!propelled particles Axel Kohlmeyer
04:53 Re: [lammps-users] [lammbs-users] nanocluster simulation (invalide : Pair_style & kspace) Axel Kohlmeyer
04:50 Re: [lammps-users] how about Calculating custom angles Axel Kohlmeyer
04:14 Re: [lammps-users] [lammbs-users] nanocluster simulation (invalide : Pair_style & kspace) Ευάγγελος Βογιατζής
04:14 Re: [lammps-users] [lammbs-users] nanocluster simulation (invalide : Pair_style & kspace) Science is the solution
03:53 [lammps-users] how about Calculating custom angles da zhang
03:46 Re: [lammps-users] [lammbs-users] nanocluster simulation (invalide : Pair_style & kspace) Ευάγγελος Βογιατζής
03:26 [lammps-users] [lammbs-users] nanocluster simulation (invalide : Pair_style & kspace) Science is the solution
01:53 [lammps-users] please help me!propelled particles mg1822079

December 05, 2019
22:38 [lammps-users] Dipoles Switching Hamed Nobarani
22:33 [lammps-users] Dipoles switching Hamed Nobarani
18:50 Re: [lammps-users] [EXTERNAL] Non-numeric positions - simulation unstable in fix gcmc command Sally Li
12:56 [lammps-users] comb3 potential in mpi hossain khan
11:44 Re: [lammps-users] compression test using fix wall/lj126 sepideh Kavousi

December 04, 2019
13:58 Re: [lammps-users] compression test using fix wall/lj126 DYLAN ANSTINE
12:58 [lammps-users] compression test using fix wall/lj126 sepideh Kavousi
11:31 Re: [lammps-users] [EXTERNAL] Superlarge insertion energy from gcmc Thompson, Aidan
11:14 [lammps-users] Asking information regarding LAMMPS SAHIRE ANSARY
11:07 Re: [lammps-users] [EXTERNAL] Non-numeric positions - simulation unstable in fix gcmc command Thompson, Aidan
11:06 Re: [lammps-users] [EXTERNAL] Non-numeric positions - simulation unstable in fix gcmc command Thompson, Aidan
07:18 Re: [lammps-users] Preparing complex system information for the input script DYLAN ANSTINE
05:41 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Lars Veldscholte
05:37 [lammps-users] compute hexorder/atom question Boris Efremov
04:19 [lammps-users] Preparing complex system information for the input script Mijiddorj B
03:56 [lammps-users] MgO bulk structure simulation Science is the solution
03:53 [lammps-users] peridynamics eps model Alessio Alexiadis
03:00 Re: [lammps-users] regarding the change of coordinates M. MAHESHWARI
02:52 Re: [lammps-users] regarding the change of coordinates Axel Kohlmeyer
02:44 [lammps-users] regarding the change of coordinates M. MAHESHWARI

December 03, 2019
17:10 Re: [lammps-users] hbondchk failed Ray Shan
17:04 Re: [lammps-users] [EXTERNAL] Re: hbondchk failed Jones, Keith
16:41 Re: [lammps-users] Stabilization at wrong pressure Steve Plimpton
16:40 Re: [lammps-users] problem with calculating the dipole vector of liquid Steve Plimpton
16:37 Re: [lammps-users] hbondchk failed Steve Plimpton
14:37 Re: [lammps-users] [EXTERNAL] Non-numeric positions - simulation unstable in fix gcmc command Sally Li
11:39 Re: [lammps-users] [EXTERNAL] Re: hbondchk failed Dr. SUNIL KUMAR

December 02, 2019
19:05 Re: [lammps-users] Segmentation fault when using fix ave/time Axel Kohlmeyer
17:02 Re: [lammps-users] Segmentation fault when using fix ave/time Nagarajan Karthik
14:16 Re: [lammps-users] [EXTERNAL] Non-numeric positions - simulation unstable in fix gcmc command Sally Li
12:54 [lammps-users] Superlarge insertion energy from gcmc Sally Li
11:58 Re: [lammps-users] Hybrid Reax/c and lj potential Axel Kohlmeyer
11:15 Re: [lammps-users] [EXTERNAL] Non-numeric positions - simulation unstable in fix gcmc command Thompson, Aidan
10:31 [lammps-users] Hybrid Reax/c and lj potential ehsan shahini
07:49 Re: [lammps-users] diffusion coefficient Pascal Brault
07:47 Re: [lammps-users] Segmentation fault when using fix ave/time Axel Kohlmeyer
07:30 Re: [lammps-users] diffusion coefficient Axel Kohlmeyer
07:27 Re: [lammps-users] job post Axel Kohlmeyer
07:21 Re: [lammps-users] Tensile loading Muhammad Anwar
06:11 [lammps-users] diffusion coefficient EDWARD BALE
05:14 [lammps-users] job post Ma, Duancheng
05:10 Re: [lammps-users] Coulomb cutoffs of pair hybrid sub-styles do not match Axel Kohlmeyer
04:43 Re: [lammps-users] How to define my compiler in Makefile correctly ? Axel Kohlmeyer
04:28 [lammps-users] Coulomb cutoffs of pair hybrid sub-styles do not match Science is the solution
03:35 Re: [lammps-users] How to define my compiler in Makefile correctly ? Mayank
02:07 [lammps-users] Segmentation fault when using fix ave/time Nagarajan Karthik

December 01, 2019
23:31 [lammps-users] Problem with NPzT system Huaqiang LIU
18:42 [lammps-users] 回复: about BKS da zhang
16:24 Re: [lammps-users] Time-dependent Pairwise Force Axel Kohlmeyer
16:21 Re: [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file Giacomo Fiorin
15:31 Re: [lammps-users] Tensile loading MASATO KOIZUMI
12:23 Re: [lammps-users] Time-dependent Pairwise Force Victor Wei
08:26 Re: [lammps-users] Tensile loading Axel Kohlmeyer

November 30, 2019
13:04 Re: [lammps-users] about BKS Xiao Jia
09:28 Re: [lammps-users] Disable atom charge in specific region Matias Factorovich
05:58 Re: [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file O Drecun
01:46 [lammps-users] about BKS da zhang

November 29, 2019
19:41 Re: [lammps-users] Disable atom charge in specific region Axel Kohlmeyer
19:38 Re: [lammps-users] Time-dependent Pairwise Force Axel Kohlmeyer
19:24 Re: [lammps-users] Invalid pair table cutoff Axel Kohlmeyer
15:55 [lammps-users] Tensile loading Muhammad Anwar
10:40 [lammps-users] Invalid pair table cutoff Science is the solution
10:18 [lammps-users] Time-dependent Pairwise Force Victor Wei
09:10 [lammps-users] Disable atom charge in specific region MD Simulation
08:46 [lammps-users] Stabilization at wrong pressure Beatrice Antonucci
04:58 Re: [lammps-users] How to define my compiler in Makefile correctly ? Axel Kohlmeyer
02:22 Re: [lammps-users] How to define my compiler in Makefile correctly ? Mayank

November 28, 2019
23:55 Re: [lammps-users] problem with calculating the dipole vector of liquid Wei Chen
09:50 Re: [lammps-users] Temperature in NVT and NVE ensembles Axel Kohlmeyer
09:13 Re: [lammps-users] User-phonon installation issue Axel Kohlmeyer
09:06 Re: [lammps-users] Fix smd -- understanding the syntax Axel Kohlmeyer
08:25 Re: [lammps-users] How to define my compiler in Makefile correctly ? Axel Kohlmeyer
05:12 Re: [lammps-users] Evaluating thermo data using pylammps Richard Berger
02:38 [lammps-users] problem with calculating the dipole vector of liquid Wei Chen
02:02 [lammps-users] How to define my compiler in Makefile correctly ? Mayank

November 27, 2019
19:37 [lammps-users] Fix smd -- understanding the syntax Daniel Matté
17:03 Re: [lammps-users] Whether there is a bool style variable in lammps? Steve Plimpton
16:55 Re: [lammps-users] Evaluating thermo data using pylammps Steve Plimpton
11:33 [lammps-users] User-phonon installation issue Gurjot Dhaliwal
09:53 [lammps-users] Temperature in NVT and NVE ensembles Mohammed Alhissi
09:09 Re: [lammps-users] R: Mixture CO2-N2 Axel Kohlmeyer
09:06 Re: [lammps-users] compression- system with two layers sepideh Kavousi
07:51 [lammps-users] R: Mixture CO2-N2 Simona Focacci
07:24 Re: [lammps-users] Mixture CO2-N2 DYLAN ANSTINE
07:17 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush K. Michael Salerno
06:20 Re: [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file Giacomo Fiorin
05:41 Re: [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file O Drecun
05:19 [lammps-users] hbondchk failed Dr. SUNIL KUMAR
03:45 [lammps-users] Mixture CO2-N2 Simona Focacci
01:42 [lammps-users] Whether there is a bool style variable in lammps? ??????
00:09 Re: [lammps-users] problem with "compute group/group" command Wei Chen

November 26, 2019
15:43 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Andrew Jewett
15:25 Re: [lammps-users] [EXTERNAL] Re: Please recommend one GPU model for computing with LAMMPS on our machine Moore, Stan
12:54 Re: [lammps-users] Implementation of machine learning framework not working with fix_box_relax James Chapman
11:59 Re: [lammps-users] Implementation of machine learning framework not working with fix_box_relax Axel Kohlmeyer
10:00 Re: [lammps-users] problem with "compute group/group" command Axel Kohlmeyer
09:23 Re: [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file Giacomo Fiorin
03:50 [lammps-users] problem with "compute group/group" command Wei Chen
03:29 [lammps-users] Calculation of stress in uniaxial tension Muhammad Anwar
01:30 [lammps-users] Regarding too many common neighbors in CNA M. MAHESHWARI

November 25, 2019
18:16 Re: [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Deep Choudhuri
13:32 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Andrew Jewett
13:09 [lammps-users] COLVARS for pulling, too fast? (LAMMPS 7 Aug 2019) - correct .colvars file O Drecun
12:58 Re: [lammps-users] (no subject) Axel Kohlmeyer
12:55 Re: [lammps-users] Regarding the too many neighbor bins error Axel Kohlmeyer
12:53 Re: [lammps-users] about atoms missing on proc * at step * Axel Kohlmeyer
12:50 Re: [lammps-users] compression- system with two layers Axel Kohlmeyer
12:33 Re: [lammps-users] 8-body interactions Axel Kohlmeyer
12:24 Re: [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Axel Kohlmeyer

November 24, 2019
23:57 [lammps-users] 8-body interactions Yanggang
20:18 Re: [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Deep Choudhuri
19:57 [lammps-users] re?? about atoms missing on proc * at step * llv
17:30 Re: [lammps-users] compression- system with two layers sepideh Kavousi
12:55 [lammps-users] COLVARS for pulling, too fast? (LAMMPS: version 7 Aug 2019) O Drecun
09:15 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Lars Veldscholte
06:51 Re: [lammps-users] about LJ unit : perm0 Stefan Paquay
03:45 [lammps-users] (no subject) M. MAHESHWARI
03:12 [lammps-users] Regarding the too many neighbor bins error M. MAHESHWARI

November 23, 2019
14:58 Re: [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Deep Choudhuri
14:03 Re: [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Axel Kohlmeyer
13:25 Re: [lammps-users] Calculation of GaN Unit Vectors for making a Wurtzite lattice Axel Kohlmeyer
13:18 Re: [lammps-users] Regarding the data file Axel Kohlmeyer
09:24 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Lars Veldscholte
08:22 [lammps-users] Calculation of GaN Unit Vectors for making a Wurtzite lattice Farzad Mohades

November 22, 2019
23:10 [lammps-users] Regarding the data file M. MAHESHWARI
21:23 [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Deep Choudhuri
21:15 [lammps-users] Linking with LAMMPS as a static library [Example/COUPLE/simple] Choudhuri, Deep
21:02 Re: [lammps-users] compression- system with two layers Axel Kohlmeyer
19:00 Re: [lammps-users] compression- system with two layers sepideh Kavousi
17:57 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Andrew Jewett
13:25 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Axel Kohlmeyer
12:32 Re: [lammps-users] Error when using the reax/c pair style with the python interface? Axel Kohlmeyer
12:17 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Lars Veldscholte
11:45 [lammps-users] Error when using the reax/c pair style with the python interface? Marcus Purse
08:58 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Axel Kohlmeyer
08:23 Re: [lammps-users] Numerical stability of MARTINI simulation of a PE brush Lars Veldscholte
02:03 Re: [lammps-users] Please recommend one GPU model for computing with LAMMPS on our machine Wenqiang Liu
01:58 Re: [lammps-users] Please recommend one GPU model for computing with LAMMPS on our machine Wenqiang Liu

November 21, 2019
21:35 Re: [lammps-users] compression- system with two layers Axel Kohlmeyer
21:03 [lammps-users] compression- system with two layers sepideh Kavousi
20:37 Re: [lammps-users] generating data and input file Toon Tavas
19:41 [lammps-users] Non-numeric positions - simulation unstable in fix gcmc command Sally Li
17:45 Re: [lammps-users] Please recommend one GPU model for computing with LAMMPS on our machine Andrew Jewett
17:23 Re: [lammps-users] changes in special.cpp Brown, Michael W
17:21 Re: [lammps-users] generating data and input file Andrew Jewett
17:04 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Andrew Jewett
16:47 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Junghans, Christoph
16:43 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Jacob Gissinger
15:57 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Jacob Gissinger
12:59 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Axel Kohlmeyer
11:46 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Andrew Jewett
09:48 Re: [lammps-users] [EXTERNAL] Re: including 3rd-party code in LAMMPS (license issue) Steven J. Plimpton
09:30 Re: [lammps-users] changes in special.cpp Herma Cuppen
06:41 Re: [lammps-users] about atoms missing on proc * at step * Axel Kohlmeyer