../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Mo Se AB2_hR3_160_a_2a a c/a x1 x2 x3 standard 1 3.3361778 6.0737111 0.66674444 0.25067841 0.416092 Tersoff_LAMMPS_ZhangNguyen_2021_MoSe__MO_152208847456_001