element=lattice type=modelname=He bcc LJ_ElliottAkerson_2015_Universal__MO_959249795837_003

Detected that energy at a lattice constant of 2.5 Angstroms was equal to isolated energy (i.e. no interactions). Shrinking box until significant forces are present...


Attempting to perform relaxation using initial lattice constant guess of 0.3125 Angstroms

Optimization terminated successfully.
         Current function value: -0.014998
         Iterations: 30
         Function evaluations: 60
{'basis_atoms': '[[0.0 0.0 0.0] [0.5 0.5 0.5]]', 'repeat': 0, 'cohesive_energy': 0.007499055020236852, 'space_group': 'Im-3m', 'element': 'He', 'lattice_constant': 0.6163840591907501, 'wyckoff_code': '2a', 'crystal_structure': 'bcc', 'iterations': 30, 'warnflag': 0, 'species': 'He" "He', 'func_calls': 60}