/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner 
/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner
Kr
fcc
LJ_Shifted_Bernardes_1958MedCutoff_Kr__MO_984281096460_003
5.63442887366e-10