element=lattice type=modelname=Ni fcc EAM_Dynamo_MishinFarkasMehl_1999_Ni__MO_400591584784_005

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: -4.450000
         Iterations: 28
         Function evaluations: 56
{'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': 4.449999998348886, 'space_group': 'Fm-3m', 'element': 'Ni', 'lattice_constant': 3.519999432563782, 'wyckoff_code': '4a', 'crystal_structure': 'fcc', 'iterations': 28, 'warnflag': 0, 'species': 'Ni" "Ni" "Ni" "Ni', 'func_calls': 56}