../../td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Sim_LAMMPS_ADP_XuWangQian_2022_NiRh__SM_306597220004_000 Rh 102.90550 diamond 5.50099827349186e-10 0.8 1.5 18 23 8 20