cluster:73
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cluster:73 [2020/03/30 14:28] hmeij07 [Amber] |
cluster:73 [2020/04/02 14:45] hmeij07 [LAMMPS CPU/GPU] |
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| ====== LAMMPS CPU/GPU ====== | ====== LAMMPS CPU/GPU ====== | ||
| + | * / | ||
| + | * lmp_mpi-[double-double|single-double|single-single] | ||
| + | * consult this file for packages installed and compilations | ||
| + | * / | ||
| + | * CUDA_ARCH = sm_75 (probably only works on queue exx96) | ||
| + | * sample script in ~hmeij/ | ||
| + | < | ||
| + | |||
| + | # simple colloid example | ||
| + | CPU run -n1 | ||
| + | Performance: | ||
| + | GPU run gpu4=1 double-double: | ||
| + | Performance: | ||
| + | GPU run gpu4=1 single-double: | ||
| + | Performance: | ||
| + | GPU run gpu4=1 single-single: | ||
| + | Performance: | ||
| + | |||
| + | </ | ||
| * / | * / | ||
| * consult [[cluster: | * consult [[cluster: | ||
| Line 2061: | Line 2080: | ||
| ** AMBER 18 ** | ** AMBER 18 ** | ||
| + | * **/ | ||
| * compiled on '' | * compiled on '' | ||
| * view compile steps at / | * view compile steps at / | ||
cluster/73.txt ยท Last modified: 2024/02/16 11:17 by hmeij07
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