/disk2/worker/repository/td/CohesiveEnergyVsLatticeConstant__TD_554653289799_003/runner Sim_LAMMPS_BOP_WardZhouWong_2012_CdTe__SM_509819366101_000 Cd 112.411 fcc 4.452126175165176e-10 0.8 1.5 18 23 8 20