That is actually a different error (out of memory vs illegal memory access). Can you describe the hardware you are running on and the Makefile options you used to build LAMMPS?
Stan
That is actually a different error (out of memory vs illegal memory access). Can you describe the hardware you are running on and the Makefile options you used to build LAMMPS?
Stan
We have 2 GeForce GTX 1080 gpu cards (12 cores) with cuda V8.0.26. In order to compile lammps, I first included all the packages I want, then installed gpu library. After that I installed lammps using: make kokkos_cuda_mpich. I have also attached the makefile used in the compilation.
Thanks,
Aman
Makefile.kokkos_cuda_mpich (3.26 KB)