I have few questions and its very urgent. I am confused about couple of things related to lammps. So am trying to make graphene oxide sheet and water in the same box however all of this should be done through the cmd window. I don’t understand should i make the script (code) for it or i have to download it from another place. I just don’t understand how to set and run lammps through cmd with my simulation.

Please help it’s urgent

for the record, I attempted to answer this question on another thread...

  1. Google “LAMMPS tutorial”

  2. Follow tutorial instructions, and make your own simulation script, and just run it.

  3. If you facing on erratic behaviour of LAMMPS, read the docs.

  4. Make your model(ensemble, time-integration method, lattice generation, equilibration, simulation).

2019년 2월 7일 (목) 오전 9:12, Andrew Jewett <jewett.aij@…24…>님이 작성: