/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner /disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_003/runner Mo bcc SW_MX2_WenShirodkarPlechac_2017_MoS__MO_201919462778_001 2.65344320983e-10