lammps

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sjplimp 1d4a6440d1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5715 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2011-02-22 22:35:22 +00:00

data.ch4

2011-02-22 22:35:22 +00:00

data.ch4_ionized

2011-02-22 22:35:22 +00:00

in.ch4_ionized.dynamics

2011-02-22 22:35:22 +00:00

in.ch4.dynamics

2011-02-22 22:35:22 +00:00

in.ch4.min

2011-02-22 22:35:22 +00:00

README

2011-02-22 22:35:22 +00:00

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