element=lattice type=modelname=N diamond Sim_LAMMPS_Polymorphic_NordAlbeErhart_2003_GaN__SM_333071728528_000

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

Optimization terminated successfully.
         Current function value: -16.186800
         Iterations: 30
         Function evaluations: 61
{'basis_atoms': '[[0.0 0.0 0.0] [0.25 0.25 0.25] [0.5 0.5 0.0] [0.75 0.75 0.25] [0.5 0.0 0.5] [0.75 0.25 0.75] [0.0 0.5 0.5] [0.25 0.75 0.75]]', 'repeat': 0, 'cohesive_energy': 2.023349966741416, 'space_group': 'Fd-3m', 'element': 'N', 'lattice_constant': 4.0446663945913315, 'wyckoff_code': '8a', 'crystal_structure': 'diamond', 'iterations': 30, 'warnflag': 0, 'species': 'N" "N" "N" "N" "N" "N" "N" "N', 'func_calls': 61}