element=lattice type=modelname=Ir bcc LennardJones612_UniversalShifted__MO_959249795837_002

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

Optimization terminated successfully.
         Current function value: -29.474603
         Iterations: 28
         Function evaluations: 57
{'basis_atoms': '[[0.0 0.0 0.0] [0.5 0.5 0.5]]', 'repeat': 0, 'cohesive_energy': 29.47460250153124, 'space_group': 'Im-3m', 'element': 'Ir', 'lattice_constant': 3.103930324316025, 'wyckoff_code': '2a', 'crystal_structure': 'bcc', 'iterations': 28, 'warnflag': 0, 'species': 'Ir" "Ir', 'func_calls': 57}