ISISNeutronMuon / ISISNeutronMuon/MDMC
LAMMPS with MDMC on GPU
Open
enhancement
P2
- Dominant language
- Python
- Stars
- 4
- Forks
- 0
- Avg merge
- 2d 4h
- Merged PRs (30d)
- 5
Description
For larger systems it might be convenient to enable the usage of GPUs for MDMC. It means that this will require some additional features in inputs for simulations as well as for calling lmp-executable. LAMMPS then has to be installed for a suitable GPU architecture.
More information can be seen here: https://docs.lammps.org/Speed_gpu.html
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