../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Fe A_cF4_225_a a standard 3 3.7691 3.449 3.6011 Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000