/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_001/runner Pair_Lennard_Jones_Shifted_Bernardes_MedCutoff_Ne__MO_160637895352_002 Ne 20.1797 bcc 3.38521178067 0.8 1.5 18 23 8 20