Commit 4bd0f5d3 authored by athomps's avatar athomps
Browse files

Added Cutoff.dic and bonds.reax 

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5388 f3b2605a-c512-4ea7-a41b-209d697bcdaa
parent ef3e26cb

tools/reax/Cutoff.dic

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Original line number Diff line number Diff line 
# 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

#

tools/reax/bonds.reax

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File added.

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