/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner Ar fcc LJ_Shifted_Bernardes_1958MedCutoff_Ar__MO_126566794224_004 5.248509056866169e-10 1.385971032811922e-20