/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Sim_LAMMPS_SNAP_ChenDengTran_2017_Mo__SM_003882782678_000 Mo 95.94 fcc 4.042378067970276e-10 0.8 1.5 18 23 8 20