/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_001/runner Pair_Lennard_Jones_Shifted_Bernardes_LowCutoff_Xe__MO_648694198005_002 Xe 131.293 diamond 9.98450386524 0.8 1.5 18 23 8 20