element=lattice type=modelname=Fe bcc model_Fe_PF_DudarevDerlet__MO_135034229282_001 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -4.316000 Iterations: 27 Function evaluations: 54 {'basis_atoms': '[[0.0 0.0 0.0] [0.5 0.5 0.5]]', 'repeat': 0, 'cohesive_energy': 4.3160000295307945, 'space_group': 'Im-3m', 'element': 'Fe', 'lattice_constant': 2.8664998561143875, 'wyckoff_code': '2a', 'crystal_structure': 'bcc', 'iterations': 27, 'warnflag': 0, 'species': 'Fe" "Fe', 'func_calls': 54} Using a magnetic interatomic potential for alpha iron atomic number is: 26.000000000000000