element=lattice type=modelname=Mo fcc Three_Body_Stillinger_Weber_MoS__MO_201919462778_000 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -8.285409 Iterations: 29 Function evaluations: 59 {'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': 8.285408915759621, 'space_group': 'Fm-3m', 'element': 'Mo', 'lattice_constant': 3.4375253319740295, 'wyckoff_code': '4a', 'crystal_structure': 'fcc', 'iterations': 29, 'warnflag': 0, 'species': 'Mo" "Mo" "Mo" "Mo', 'func_calls': 59}