../../td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Sim_LAMMPS_ADP_StarikovSmirnova_2021_ZrNb__SM_993852507257_000 Nb 92.90638 bcc 3.294839940965176e-10 0.8 1.5 18 23 8 20