add support enforce writing a data file with pair ij as required by sdk styles (a42365bf) · Commits · 郑智淋 / lammps

unittest/force-styles/test_pair_style.cpp

+2 −1

Original line number	Diff line number	Diff line
		@@ -130,8 +130,9 @@ LAMMPS init_lammps(int argc, char *argv, const TestConfig &cfg, const bool new
		}

		command("run 0 post no");
		command("variable write_data_pair index ii");
		command("write_restart " + cfg.basename + ".restart");
		command("write_data " + cfg.basename + ".data");
		command("write_data " + cfg.basename + ".data pair ${write_data_pair}");
		command("write_coeff " + cfg.basename + "-coeffs.in");

		return lmp;