nasty little bug (2baa0b34) · Commits · 郑智淋 / lammps

src/USER-MISC/fix_bond_react.cpp

+1 −1

Original line number	Diff line number	Diff line
		@@ -2101,7 +2101,7 @@ void FixBondReact::update_everything()
		nspecial[atom->map(update_mega_glove[jj+1][i])][1]++;
		nspecial[atom->map(update_mega_glove[jj+1][i])][2]++;
		}
		for (int n = nspecial[atom->map(update_mega_glove[jj+1][i])][2]; n > insert_num; n--) {
		for (int n = nspecial[atom->map(update_mega_glove[jj+1][i])][2]-1; n > insert_num; n--) {
		special[atom->map(update_mega_glove[jj+1][i])][n] = special[atom->map(update_mega_glove[jj+1][i])][n-1];
		}
		special[atom->map(update_mega_glove[jj+1][i])][insert_num] = update_mega_glove[equivalences[twomol->special[j][k]-1][1][rxnID]][i];