From 0ab61a40ca217aa5efceaf6caf8da9fbf25de741 Mon Sep 17 00:00:00 2001 From: sjplimp Date: Mon, 6 Jul 2015 16:44:22 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13531 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- examples/reax/AB/ffield.reax.AB | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/examples/reax/AB/ffield.reax.AB b/examples/reax/AB/ffield.reax.AB index a745193882..c34e5483d2 100644 --- a/examples/reax/AB/ffield.reax.AB +++ b/examples/reax/AB/ffield.reax.AB @@ -1,4 +1,4 @@ -Reactive MD-force field for Ammonia Borane: Weismiller, M.R.; van Duin, A.C.T.; Lee, J.; Yetter, R.A. J. Phys. Chem. A 2010, 114, 5485-5492 +DATE: 2011-02-18 CONTRIBUTOR: Aidan Thompson, athomps@sandia.gov CITATION: Weismiller, van Duin, Lee, Yetter, J Phys Chem A, 114, 5485-5492 (2010) COMMENT: Reactive MD-force field for Ammonia Borane: Weismiller, M.R.; van Duin, A.C.T.; Lee, J.; Yetter, R.A. J. Phys. Chem. A 2010, 114, 5485-5492 39 ! Number of general parameters 50.0000 !Overcoordination parameter 9.4514 !Overcoordination parameter