Jan Eitzinger
|
c2fcd50773
|
Initial version of lammps halfneighbor list
|
2022-03-10 17:06:45 +01:00 |
|
Jan Eitzinger
|
ba3a0524f6
|
Merge branch 'master' of github.com:RRZE-HPC/MD-Bench
|
2022-03-10 16:30:40 +01:00 |
|
Jan Eitzinger
|
6203cb12b6
|
Start to introduce halfneigh version
|
2022-03-10 16:30:37 +01:00 |
|
Rafael Ravedutti
|
ed2929c813
|
Add percentage of atoms within cutoff radius when using LAMMPS reference version
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
|
2022-02-25 14:40:33 +01:00 |
|
Rafael Ravedutti
|
aa0f4048d0
|
Rename default directory to lammps and reorganize gromacs variant steps
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
|
2022-01-25 21:00:11 +01:00 |
|