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lammps/tools/msi2lmp/test
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sjplimp 2ea115cfc2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
..
reference
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
benzene-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
benzene-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
benzene-class2a.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
benzene-class2a.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
benzene-class2b.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
benzene-class2b.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
crambin-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
crambin-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
data-compare.pl
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-class2a.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-class2a.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-class2b.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-class2b.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-oplsaa.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
ethane-oplsaa.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
h2-h2o-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
h2-h2o-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
h2-h2o-class2b.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
h2-h2o-class2b.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
hydrogen-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
hydrogen-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
hydrogen-class2a.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
hydrogen-class2a.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.benzene-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.benzene-class2a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.benzene-class2b
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.crambin-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.ethane-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.ethane-class2a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.ethane-class2b
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.ethane-oplsaa
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.h2-h2o-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.h2-h2o-class2b
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.hydrogen-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.hydrogen-class2a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.naphthalene-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.naphthalene-class2a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.naphthalene-class2b
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.nylon-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.phen3_cff97-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.PyAC_bulk-clayff
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.water-class1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
in.water-class2b
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
naphthalene-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
naphthalene-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
naphthalene-class2a.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
naphthalene-class2a.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
naphthalene-class2b.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
naphthalene-class2b.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
nylon-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
nylon-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
phen3_cff97-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
phen3_cff97-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
PyAC_bulk-clayff.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
PyAC_bulk-clayff.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
runtests.sh
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
test.input
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
water-class1.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
water-class1.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
water-class2b.car
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00
water-class2b.mdf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10663 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 14:31:33 +00:00