/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Ar fcc LJ_Smoothed_Bernardes_1958_Ar__MO_764178710049_001 5.29216037691e-10