/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Na bcc Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Na__MO_587469264453_002 4.30042004585e-10