element=lattice type=modelname=Fe sc Tersoff_LAMMPS_MuellerErhartAlbe_2007_Fe__MO_137964310702_002

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

Optimization terminated successfully.
         Current function value: -3.131276
         Iterations: 26
         Function evaluations: 53
{'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 3.1312755368870246, 'space_group': 'Pm-3m', 'element': 'Fe', 'lattice_constant': 2.417325720191002, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 26, 'warnflag': 0, 'species': 'Fe', 'func_calls': 53}