../../td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Tersoff_LAMMPS_ErhartJuslinGoy_2006_ZnO__MO_616776018688_004 Zn 65.409 fcc 3.816246017813683e-10 0.8 1.5 18 23 8 20