[lammps-users] How to use the fix/nvt? Why my simulation is stopped when I use the fix/nvt?

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1

Dear All,

I tried to run my graphene simulation and have something trouble. I was only able to run up to the first step, but after that my simulation stopped.

I think the problem is in my “fix/nvt” code.

I attach my code also. I hope you can help me to solve this problem.

Thank you

Rizal Arifin

in.tugas (563 Bytes)

SiC.tersoff (762 Bytes)

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Are you printing thermo output every timestep? Were the
values leading up to the "stop" good ones?

Steve