/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Mo bcc Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Mo__MO_666830945336_002 3.14096280932e-10