Hi,
I read the discussion on https://github.com/lammps/lammps/issues/467
I didn’t understand how / where to edit the fix_gcmc.cpp file
Can anyone tell me how to do this?
regards
Alberto
What do you want to achieve? By just removing it and still run your simulation will give bad results, so I wouldn’t do that if I were you.
Anders
Hi,
how can I solve the problem?
Alberto
Fix the code. The problem is (I think) rejecting rotations of molecules where one or more atoms changes processors.
Anders
do you know how to correct this thing?
I haven’t found any indication of this and I’m not such an experienced programmer to do it.
regards
Alberto
If I knew I would hey fixed it a long time ago. I just haven’t had time to figure it out.
Anders
we can only hope that the LAMMPS developers correct this.
Alberto