../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Al Fe Si A3B2C_cF96_227_f_e_c a x2 x3 standard 1 11.1641 0.21272625 0.81579023 Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000