/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_001/runner Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 Si 28.0855 diamond 5.42939171195 0.8 1.5 18 23 8 20