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lammps/tools/reax/Cutoff.dic
athomps 4bd0f5d3fd Added Cutoff.dic and bonds.reax
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5388 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2010-12-09 20:16:31 +00:00

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# Interesting name. This file contains
# the bond-order cut off for each
# pair of ReaxFF elements
C N 0.3
C C 0.55
C O 0.65
C H 0.4
O O 0.65
N O 0.40
O H 0.4
H H 0.55
H N 0.55
N N 0.55
#