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

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)

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