/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner Ba bcc LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 4.732946127653122e-10 2.42311345356616e-18