/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Sim_LAMMPS_BOP_WardZhouWong_2012_CdZnTe__SM_409035133405_000 Cd 112.411 sc 3.12039215862751e-10 0.8 1.5 18 23 8 20