element=lattice type=modelname=Ra sc LennardJones612_UniversalShifted__MO_959249795837_002 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -9.363448 Iterations: 33 Function evaluations: 67 {'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 9.3634484956023, 'space_group': 'Pm-3m', 'element': 'Ra', 'lattice_constant': 4.20772098004818, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 33, 'warnflag': 0, 'species': 'Ra', 'func_calls': 67}