simplify (f77b8018) · Commits · 郑智淋 / lammps

src/KSPACE/pair_lj_cut_coul_long.cpp

+1 −4

Original line number	Diff line number	Diff line
		@@ -545,10 +545,7 @@ void PairLJCutCoulLong::compute_outer(int eflag, int vflag)
		}
		} else forcecoul = 0.0;

		if (rsq <= cut_in_off_sq) {
		r6inv = r2invr2invr2inv;
		forcelj = r6inv * (lj1[itype][jtype]*r6inv - lj2[itype][jtype]);
		} else if (rsq <= cut_in_on_sq) {
		if (rsq < cut_ljsq[itype][jtype]) {
		r6inv = r2invr2invr2inv;
		forcelj = r6inv * (lj1[itype][jtype]*r6inv - lj2[itype][jtype]);
		}