../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Ca Zn AB13_cF112_226_a_bi a y3 z3 standard 1 12.0649 0.67948844 0.61997547 MEAM_LAMMPS_JangSeolLee_2019_CaZnMg__MO_708495328010_002