element:
Y
lattice type:
fcc
modelname:
MEAM_LAMMPS_KimJeonLee_2015_MgY__MO_018428823000_002

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

Optimization terminated successfully.
         Current function value: -17.328639
         Iterations: 32
         Function evaluations: 67
{'lattice_constant': 5.117240436375141, 'cohesive_energy': 4.3321596920350025, 'element': 'Y', 'species': 'Y" "Y" "Y" "Y', 'crystal_structure': 'fcc', 'space_group': 'Fm-3m', 'wyckoff_code': '4a', 'basis_atoms': '[[0.0 0.0 0.0] [0.5 0.5 0.0] [0.5 0.0 0.5] [0.0 0.5 0.5]]', 'iterations': 32, 'func_calls': 67, 'warnflag': 0, 'repeat': 0}