element=lattice type=modelname=Zn sc Sim_LAMMPS_BOP_WardZhouWong_2013_CdZnTe__SM_010061267051_000

Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms

Optimization terminated successfully.
         Current function value: -1.605032
         Iterations: 26
         Function evaluations: 53
{'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 1.6050318044001564, 'space_group': 'Pm-3m', 'element': 'Zn', 'lattice_constant': 2.790089577436447, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 26, 'warnflag': 0, 'species': 'Zn', 'func_calls': 53}