/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Cr bcc Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Cr__MO_245813471114_003 2.87695632875e-10