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lammps/examples/dreiding
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sjplimp 7ebdff8bbd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9514 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-15 21:00:56 +00:00
..
README git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7062 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 16:33:07 +00:00
ch3oh.box.dreiding.bgf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7062 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 16:33:07 +00:00
ch3oh.box.dreiding.cerius2.eng.dat git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7062 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 16:33:07 +00:00
data.dreiding git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7062 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 16:33:07 +00:00
in.dreiding git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7062 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 16:33:07 +00:00
log.dreiding.18Feb13.linux.1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9514 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-15 21:00:56 +00:00
log.dreiding.18Feb13.linux.4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9514 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-15 21:00:56 +00:00

README 

The LAMMPS input script and data file were built to
match the Cerius Dreiding files included
in this directory (ch3oh.box.*) so that you
can compare LAMMPS output to a Dreiding implementation
in the Cerius code.