../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner C Fe AB2_oP12_62_c_2c a b/a c/a x1 z1 x2 z2 x3 z3 standard 1 5.7358 0.51555145 1.279281 0.8026762 0.1703805 0.16541283 0.04518592 0.49285668 0.81631433 Sim_LAMMPS_TersoffZBL_HenrikssonBjorkasNordlund_2013_FeC__SM_473463498269_000