../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Mn Si A4B7_tP44_116_ach2i_e3j a c/a x3 z4 z5 z6 x7 y7 z7 x8 y8 z8 x9 y9 z9 standard 1 5.4832 3.158247 0.33468944 0.12996403 0.43522288 0.19183454 0.15520085 0.19839266 0.113263 0.32237223 0.84163371 0.18279774 0.34671435 0.22970067 0.96086284 MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002