element=lattice type=modelname=Ni sc Sim_LAMMPS_ADP_MishinMehlPapaconstantopoulos_2005_Ni__SM_477692857359_000 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -3.726400 Iterations: 26 Function evaluations: 52 {'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 3.7264002263706986, 'space_group': 'Pm-3m', 'element': 'Ni', 'lattice_constant': 2.396500937640667, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 26, 'warnflag': 0, 'species': 'Ni', 'func_calls': 52}