../../td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Tersoff_LAMMPS_ByggmastarNagelAlbe_2019_FeO__MO_608695023236_000 Fe 55.845 fcc 3.647307395935058e-10 0.8 1.5 18 23 8 20