Fixed reax per-atom energy and virial at periodic boundary
76b4aec8e50c
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Authored by athomps <athomps@f3b2605a-c512-4ea7-a41b-209d697bcdaa> on May 7 2012, 22:33.

Description

Fixed reax per-atom energy and virial at periodic boundary

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8050 f3b2605a-c512-4ea7-a41b-209d697bcdaa

Committed

athomps <athomps@f3b2605a-c512-4ea7-a41b-209d697bcdaa>

May 7 2012, 22:33

Pushed

junge

Oct 6 2016, 16:49

Parents

rLAMMPS819fcd6bb825: Added space to FullNghs output

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athomps <athomps@f3b2605a-c512-4ea7-a41b-209d697bcdaa> committed rLAMMPS76b4aec8e50c: Fixed reax per-atom energy and virial at periodic boundary (authored by athomps <athomps@f3b2605a-c512-4ea7-a41b-209d697bcdaa>).May 7 2012, 22:33

				Path
	M			src/USER-REAXC/reaxc_bond_orders.cpp
	M			src/pair.cpp
	M			src/pair.h