/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Ca fcc Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Ca__MO_562200212426_002 5.57215130329e-10