element:
Li
lattice type:
bcc
modelname:
SNAP_ZuoChenLi_2019_Li__MO_732106099012_000

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

Optimization terminated successfully.
         Current function value: -1.119817
         Iterations: 30
         Function evaluations: 62
{'lattice_constant': 3.5061865001916885, 'cohesive_energy': 0.5599087099986524, 'element': 'Li', 'species': 'Li" "Li', 'crystal_structure': 'bcc', 'space_group': 'Im-3m', 'wyckoff_code': '2a', 'basis_atoms': '[[0.0 0.0 0.0] [0.5 0.5 0.5]]', 'iterations': 30, 'func_calls': 62, 'warnflag': 0, 'repeat': 0}