element=lattice type=modelname=Pr 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: -7.115453 Iterations: 30 Function evaluations: 60 {'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 7.115453050638467, 'space_group': 'Pm-3m', 'element': 'Pr', 'lattice_constant': 3.8650142177939415, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 30, 'warnflag': 0, 'species': 'Pr', 'func_calls': 60}