element=lattice type=modelname=Mg sc EAM_Dynamo_LiuOhotnickyAdams_1997_AlMg__MO_559870613549_000

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


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


Attempting to perform relaxation using initial lattice constant guess of 3.0 Angstroms

Optimization terminated successfully.
         Current function value: -1.269143
         Iterations: 25
         Function evaluations: 51
{'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 1.2691426833904742, 'space_group': 'Pm-3m', 'element': 'Mg', 'lattice_constant': 2.9139402866363517, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 25, 'warnflag': 0, 'species': 'Mg', 'func_calls': 51}