git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14093 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2015-10-05 15:25:59 +00:00
parent 5fa97f537a
commit c784292298

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@ -2273,6 +2273,7 @@ double PairAIREBO::bondorderLJ(int i, int j, double rij[3], double rijmag,
REBO_neighs_i = REBO_firstneigh[i];
for (k = 0; k < REBO_numneigh[i]; k++) {
atomk = REBO_neighs_i[k];
ktype = map[type[atomk]];
if (atomk != atomj) {
lamdajik = 0.0;
rik[0] = x[atomi][0]-x[atomk][0];