../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner Cu Mg Si A16B6C7_cF116_225_2f_e_ad a x3 x4 x5 standard 1 11.705 0.29632707 0.66725823 0.88007167 MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002