This shows you the differences between two versions of the page.
Both sides previous revision Previous revision Next revision | Previous revision Next revision Both sides next revision | ||
cluster:73 [2023/02/10 14:52] hmeij07 [OpenHPC] |
cluster:73 [2023/04/27 19:59] hmeij07 [LAMMPS CPU/GPU] |
||
---|---|---|---|
Line 2275: | Line 2275: | ||
====== LAMMPS CPU/GPU ====== | ====== LAMMPS CPU/GPU ====== | ||
+ | |||
+ | ** 25Apr2023** | ||
+ | |||
+ | * / | ||
+ | * lmp_serial and lmp_mpi | ||
+ | * 3 cuda versions with 3 different precision settings | ||
+ | * notes: / | ||
+ | * does **not** support openmp, look for the OpenHPC version for that | ||
+ | |||
+ | < | ||
+ | |||
+ | # CPU | ||
+ | |||
+ | | ||
+ | | ||
+ | | ||
+ | | ||
+ | | ||
+ | | ||
+ | which mpirun mpicc python gcc | ||
+ | |||
+ | |||
+ | # CPU + GPU (exx96 queue, may run on test and amber128 queues) | ||
+ | |||
+ | | ||
+ | | ||
+ | | ||
+ | | ||
+ | which nvcc | ||
+ | |||
+ | # related for starrlab | ||
+ | # https:// | ||
+ | |||
+ | [hmeij@cottontail2 ~]$ module load miniconda3/ | ||
+ | [hmeij@cottontail2 ~]$ which pacemaker | ||
+ | / | ||
+ | [hmeij@cottontail2 ~]$ pacemaker --version | ||
+ | pacemaker/ | ||
+ | ace_evaluator | ||
+ | |||
+ | [hmeij@cottontail2 ~]$ python | ||
+ | Python 3.9.10 | packaged by conda-forge | (main, Feb 1 2022, 21: | ||
+ | [GCC 9.4.0] on linux | ||
+ | Type " | ||
+ | >>> | ||
+ | >>> | ||
+ | |||
+ | |||
+ | </ | ||
** USER_QUIP ** | ** USER_QUIP ** |