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Re: [lammps-users] [lammps-user]Conversion of VMD files to lammps file -Continued
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Re: [lammps-users] [lammps-user]Conversion of VMD files to lammps file -Continued


From: sumit nagar <sn971489@...24...>
Date: Sat, 23 Sep 2017 12:28:25 +0530

Sir ,

Currently i am using version Lammps 20150608 (64 bit) .

Sumit ,Nagar
M.Tech (Production engg)
B.E (Production and Ind Engg)
MCSA 70-290 ,SQL (Oracle z -007)
ITIL certified ,MCAD 70-306
GATE 2006,2013

On Fri, Sep 22, 2017 at 4:06 PM, sumit nagar <sn971489@...24...> wrote:
Sir,

This time i have not included any bonds,dihedrals,impropers and angles in my graphene sheet created from  VMD and converted to lammps data by tk console .The data file looks like the attached file.It is giving  a error Incorrect atom format in data file.The documentation says this error comes when number of values per atom line in the data file is not consistent with atom style .What needs to be changed in the data file ? Will i have to manually edit it .

Sumit ,Nagar
M.Tech (Production engg)
B.E (Production and Ind Engg)
MCSA 70-290 ,SQL (Oracle z -007)
ITIL certified ,MCAD 70-306
GATE 2006,2013