../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Fe Ti A2B_oC24_63_acg_f a b/a c/a y2 y3 z3 x4 y4 standard 1 5.0729 1.7268821 1.6082911 0.83414724 0.33486069 0.060698188 0.75214904 0.58621228 Sim_LAMMPS_MEAM_KimJungLee_2009_FeTiC__SM_531038274471_000