../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner O Ti A2B_tI24_141_h_c a c/a y2 z2 standard 1 6.0231 1.4227889 0.53191384 0.23345488 Sim_LAMMPS_MEAM_ZhangTrinkle_2016_TiO__SM_513612626462_000