may test for atom types only after system is initialized (0cb3163b) · Commits · 郑智淋 / lammps

src/USER-MISC/pair_e3b.cpp

+2 −2

Original line number	Diff line number	Diff line
		@@ -382,8 +382,6 @@ void PairE3B::settings(int narg, char **arg)
		{
		if (narg != 1) error->all(FLERR,"Illegal pair_style command");
		typeO=force->inumeric(FLERR,arg[0]);
		if (typeO<1 \|\| typeO>atom->ntypes)
		error->all(FLERR,"Invalid Otype: out of bounds");
		}

		/* ----------------------------------------------------------------------
		@@ -477,6 +475,8 @@ void PairE3B::init_style()
		error->all(FLERR,"Pair style E3B requires atom IDs");
		if (force->newton_pair == 0)
		error->all(FLERR,"Pair style E3B requires newton pair on");
		if (typeO<1 \|\| typeO>atom->ntypes)
		error->all(FLERR,"Invalid Otype: out of bounds");

		// need a half neighbor list
		neighbor->request(this,instance_me);