/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner 
/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner
Kr
fcc
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
3.190614968538285e-10
2.311150015020129e-20