../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Al Mg A12B17_cI58_217_g_acg a x2 x3 z3 x4 z4 standard 1 10.5255 0.67239686 0.090442832 0.72399288 0.35667725 0.95944082 MEAM_LAMMPS_DickelBaskesAslam_2018_MgAlZn__MO_093637366498_002