../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Cu Ti AB2_cF96_227_e_cf a x2 x3 standard 1 11.7212 0.790376 0.44155649 MEAM_LAMMPS_MirazDhariwalMeng_2020_CuNTi__MO_122936827583_002