/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_002/runner LJ_Shifted_Bernardes_1958MedCutoff_Ne__MO_160637895352_003 Ne 20.1797 fcc 4.2296808362e-10 0.8 1.5 18 23 8 20