Use Au-Si MEAM Potential in LAMMPS: Difference between revisions
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==Installing LAMMPS on '''mc2'''== |
==Installing LAMMPS on '''mc2'''== |
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[http://lammps.sandia.gov/ LAMMPS] is a classical molecular dynamics code for large-scale atomic/molecular massively parallel simulation. |
[http://lammps.sandia.gov/ LAMMPS] is a classical molecular dynamics code for large-scale atomic/molecular massively parallel simulation. On '''mc2''', you can get LAMMPS from our SVN server using the following commands. |
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mkdir Codes |
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cd Codes |
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mkdir LAMMPS.svn |
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cd LAMMPS.svn |
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svn co https://micro.stanford.edu/svn/LAMMPS/ ./ |
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Revision as of 06:50, 21 June 2012
Use Au-Si MEAM Potential in LAMMPS
Yanming wang, Seunghwa Ryu and Wei Cai
This tutorial explains how to use Au-Si MEAM potential in LAMMPS on a cluster like mc2. It starts with the installation of LAMMPS on mc2, then talks about the compiling of the Au-Si MEAM potential. This tutorial also includes a test case to make sure the result from LAMMPS with this MEAM potential is consistent with that from MD++.
Installing LAMMPS on mc2
LAMMPS is a classical molecular dynamics code for large-scale atomic/molecular massively parallel simulation. On mc2, you can get LAMMPS from our SVN server using the following commands.
mkdir Codes cd Codes mkdir LAMMPS.svn cd LAMMPS.svn svn co https://micro.stanford.edu/svn/LAMMPS/ ./