lammps

Files

History

Axel Kohlmeyer 633ff19ab9 fix up some EFF inputs and create conventional log files

2024-08-12 21:51:59 -04:00

data.ch4

rename example folders

2021-06-29 11:23:47 -04:00

data.ch4_ionized

rename example folders

2021-06-29 11:23:47 -04:00

in.ch4_ionized.dynamics

2024-08-12 21:51:59 -04:00

in.ch4.dynamics

2024-08-12 21:51:59 -04:00

in.ch4.min

2024-08-12 21:51:59 -04:00

2024-08-12 21:51:59 -04:00

2024-08-12 21:51:59 -04:00

log.12Aug24.ch4.dynamics.g++.1

2024-08-12 21:51:59 -04:00

log.12Aug24.ch4.dynamics.g++.4

2024-08-12 21:51:59 -04:00

log.12Aug24.ch4.min.g++.1

2024-08-12 21:51:59 -04:00

log.12Aug24.ch4.min.g++.4

2024-08-12 21:51:59 -04:00

README

rename example folders

2021-06-29 11:23:47 -04:00

Methane, valence electron ionization and full molecule tests (spe, min, dynamics).
Note: electron mass set to 1