/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner 
/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner
W
bcc
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_W__MO_390128289865_002
3.15557683259e-10