element=lattice type=modelname=Ba fcc Pair_Morse_Shifted_GirifalcoWeizer_HighCutoff_Ba__MO_676977998912_001

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

Optimization terminated successfully.
         Current function value: -1.773258
         Iterations: 34
         Function evaluations: 72
{'basis_atoms': '[[0.0 0.0 0.0] [0.0 0.5 0.5] [0.5 0.0 0.5] [0.5 0.5 0.0]]', 'repeat': 0, 'cohesive_energy': 1.773257929807967, 'space_group': 'Fm-3m', 'element': 'Ba', 'lattice_constant': 6.332024872303009, 'wyckoff_code': '4a', 'crystal_structure': 'fcc', 'iterations': 34, 'warnflag': 0, 'species': 'Ba" "Ba" "Ba" "Ba', 'func_calls': 72}