element:
Al
lattice type:
bcc
modelname:
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000

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

Optimization terminated successfully.
         Current function value: -6.410030
         Iterations: 28
         Function evaluations: 56
{'lattice_constant': 3.2057228684425354, 'cohesive_energy': 3.20501518559933, 'element': 'Al', 'species': 'Al" "Al', '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': 28, 'func_calls': 56, 'warnflag': 0, 'repeat': 0}