element: Y lattice type: sc modelname: MEAM_LAMMPS_KoLee_2013_VPdY__MO_046547823135_001 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -3.639957 Iterations: 29 Function evaluations: 60 {'lattice_constant': 3.359360858798027, 'cohesive_energy': 3.6399571966955735, 'element': 'Y', 'species': 'Y', 'crystal_structure': 'sc', 'space_group': 'Pm-3m', 'wyckoff_code': '1a', 'basis_atoms': '[[0.0 0.0 0.0]]', 'iterations': 29, 'func_calls': 60, 'warnflag': 0, 'repeat': 0}