Files
lammps/tools/reax
2018-12-10 14:38:25 -05:00
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2010-12-09 20:16:31 +00:00

=== ReaxFF tools ===
===============================

The programs in this folder can be used to analyze the
output of simulations using the ReaxFF potentials;

reaxc_bond.pl: reads the bonding information in the
                .trj file produced by pair_style reax/c and
                outputs molecule counts for each frame.