Dear all,
I’m trying to use the GPU with a QUIP (GAP) potential. I know that the GPU package can’t use the Newton flag on, and that the QUIP potential demands Newton flag on. By saying that, I’m almost certain that I can’t use the GPU in this case. However, I need so bad to gain more computational power that I’m here to confirm that there’s really no way to make this works. Using the 29 Oct 2020 lammps version.
Best regards,
Alexandre