element:
Ni
lattice type:
bcc
modelname:
SNAP_ZuoChenLi_2019_Ni__MO_365106510449_000

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

Optimization terminated successfully.
         Current function value: -5.615929
         Iterations: 27
         Function evaluations: 55
{'lattice_constant': 2.794606104493141, 'cohesive_energy': 2.8079645436901384, 'element': 'Ni', 'species': 'Ni" "Ni', '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': 27, 'func_calls': 55, 'warnflag': 0, 'repeat': 0}