/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Mo bcc Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Mo__MO_228581001644_002 3.1582519412e-10