element: Zr lattice type: sc modelname: EAM_Dynamo_MendelevKramerOtt_2009_CuZr__MO_600021860456_005 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -5.751255 Iterations: 27 Function evaluations: 55 {'lattice_constant': 2.840708389878273, 'cohesive_energy': 5.751254929806942, 'element': 'Zr', 'species': 'Zr', 'crystal_structure': 'sc', 'space_group': 'Pm-3m', 'wyckoff_code': '1a', 'basis_atoms': '[[0.0 0.0 0.0]]', 'iterations': 27, 'func_calls': 55, 'warnflag': 0, 'repeat': 0}