/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner Cr bcc Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Cr__MO_859700307573_002 2.875543534755707e-10 6.20752746848679e-19