element=lattice type=modelname=Kr sc LJ_Shifted_Bernardes_1958MedCutoff_Kr__MO_984281096460_003

Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms

Optimization terminated successfully.
         Current function value: -0.076601
         Iterations: 30
         Function evaluations: 61
{'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 0.07660113528789567, 'space_group': 'Pm-3m', 'element': 'Kr', 'lattice_constant': 3.9015886932611465, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 30, 'warnflag': 0, 'species': 'Kr', 'func_calls': 61}