/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner K bcc LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 4.4687884375453e-10 7.037215986572731e-19