/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner Ca fcc Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Ca__MO_159753408472_004 5.559938663989308e-10 2.974056576899466e-19