element=lattice type=modelname=Pt fcc EAM_Dynamo_AdamsFoilesWolfer_1989Universal6_Pt__MO_388062184209_000

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


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


Attempting to perform relaxation using initial lattice constant guess of 3.0 Angstroms

Optimization terminated successfully.
         Current function value: -5.770000
         Iterations: 29
         Function evaluations: 60
{'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': 5.769999999231409, 'space_group': 'Fm-3m', 'element': 'Pt', 'lattice_constant': 3.920000052452089, 'wyckoff_code': '4a', 'crystal_structure': 'fcc', 'iterations': 29, 'warnflag': 0, 'species': 'Pt" "Pt" "Pt" "Pt', 'func_calls': 60}