Axel Kohlmeyer fa9062a87e make Force::special_lj and Force::special_coul accessible through the library interface

2023-03-15 18:39:32 -04:00

..

mliap

Developed MLIAP-KOKKOS version of the Unified model/descriptor

2023-01-23 18:01:26 +01:00

__init__.py

Merge remote-tracking branch 'github/master' into collected-small-changes

2021-06-04 00:28:32 -04:00

constants.py

add comment that this file needs to be updated when APIs are added

2022-10-28 21:13:50 -04:00

core.py

make Force::special_lj and Force::special_coul accessible through the library interface

2023-03-15 18:39:32 -04:00

data.py

expand homepage checker tool to check a few more folders and apply updates

2022-10-24 10:58:39 -04:00

formats.py

expand homepage checker tool to check a few more folders and apply updates

2022-10-24 10:58:39 -04:00

numpy_wrapper.py

Replacing arbitrary LAMMPS version with TBD in numpy_wrapper.py

2023-01-26 16:50:05 +02:00

pylammps.py

expand homepage checker tool to check a few more folders and apply updates

2022-10-24 10:58:39 -04:00