element=lattice type=modelname=Be fcc Sim_LAMMPS_ModifiedTersoff_ByggmastarHodilleFerro_2018_BeO__SM_305223021383_000

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

Optimization terminated successfully.
         Current function value: -14.251256
         Iterations: 29
         Function evaluations: 59
{'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]]', 'repeat': 0, 'cohesive_energy': 3.562813940343752, 'space_group': 'Fm-3m', 'element': 'Be', 'lattice_constant': 3.251147985458374, 'wyckoff_code': '4a', 'crystal_structure': 'fcc', 'iterations': 29, 'warnflag': 0, 'species': 'Be" "Be" "Be" "Be', 'func_calls': 59}