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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12799 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp 2014-11-26 16:04:35 +00:00
parent eb8b18913b
commit 1bfeda4e3e
1 changed files with 1 additions and 1 deletions
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examples/USER/pimd/para-h2/in.scp
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@ -20,7 +20,7 @@ thermo ${out_freq}
velocity all create 1.0 1985 rot yes dist gaussian
fix 1 all quantum method nmpimd fmass 1.0 temp 25.0 nhc 4
fix 1 all pimd method nmpimd fmass 1.0 temp 25.0 nhc 4
dump dcd all dcd ${out_freq} dcd/${job_name}_${ibead}.dcd