../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Fe A_tP28_136_f2ij a c/a x1 x2 y2 x3 y3 x4 z4 standard 1 9.1302 0.52295678 0.40120284 0.47392804 0.13606103 0.75454574 0.045896927 0.20358403 0.25196735 Sim_LAMMPS_Table_GrogerVitekDlouhy_2020_CoCrFeMnNi__SM_786004631953_001