../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner O Ti A2B_tP6_136_f_a a c/a x2 standard 1 4.6726 0.64700595 0.30516921 Sim_LAMMPS_MEAM_ZhangTrinkle_2016_TiO__SM_513612626462_000