../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner C Mn AB6_cF112_227_c_def a x3 x4 standard 1 11.9127 0.70637448 0.9380054 MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002