Imported bulk from ase.lattice element=lattice type=modelname=Mn diamond MEAM_2NN_Fe_to_Ga__MO_145522277939_001 4.0 Optimization terminated successfully. Current function value: -11246.656280 Iterations: 38 Function evaluations: 76 {'cutoff': 4.0, 'basis_atoms': '[[0.0 0.0 0.0] [0.25 0.25 0.25] [0.0 0.5 0.5] [0.25 0.75 0.75] [0.5 0.0 0.5] [0.75 0.25 0.75] [0.5 0.5 0.0] [0.75 0.75 0.25]]', 'repeat': 9, 'cohesive_energy': 1.9284390055413063, 'space_group': 'Fd-3m', 'element': 'Mn', 'lattice_constant': 5.2189231216907572, 'wyckoff_code': '8a', 'nbctype': 'MI_OPBC_F', 'crystal_structure': 'diamond', 'iterations': 38, 'warnflag': 0, 'species': 'Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "Mn', 'func_calls': 76} 1 Mn