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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3974 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2010-04-09 14:58:45 +00:00
parent cbaa0907ad
commit c33d4bbc98
2 changed files with 4 additions and 4 deletions
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4
bench/in.rhodo
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@ -15,8 +15,8 @@ kspace_style pppm 1e-4
read_data data.rhodo
fix 1 all shake 0.0001 5 0 m 1.0 a 232
fix 2 all npt 300.0 300.0 100.0 &
aniso NULL NULL NULL NULL 0.0 0.0 1000.0
fix 2 all npt temp 300.0 300.0 100.0 &
z 0.0 0.0 1000.0 mtk no pchain 0 tchain 1
special_bonds charmm

4
bench/in.rhodo.scaled
View File

@ -22,8 +22,8 @@ read_data data.rhodo
replicate $x $y $z
fix 1 all shake 0.0001 5 0 m 1.0 a 232
fix 2 all npt 300.0 300.0 100.0 &
aniso NULL NULL NULL NULL 0.0 0.0 1000.0
fix 2 all npt temp 300.0 300.0 100.0 &
z 0.0 0.0 1000.0 mtk no pchain 0 tchain 1
special_bonds charmm