element: Au lattice type: bcc modelname: EAM_Dynamo_NormanStarikovStegailov_2012_Au__MO_592431957881_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 Exception message: Calling kimpy function "compute" failed: the model does not provide an Extension routine! or the model's Extension routine returns error! Attempting to perform relaxation using initial lattice constant guess of 3.0 Angstroms Optimization terminated successfully. Current function value: -8.470834 Iterations: 26 Function evaluations: 53 {'lattice_constant': 3.247228395938874, 'cohesive_energy': 4.235416806943112, 'element': 'Au', 'species': 'Au" "Au', 'crystal_structure': 'bcc', 'space_group': 'Im-3m', 'wyckoff_code': '2a', 'basis_atoms': '[[0.0 0.0 0.0] [0.5 0.5 0.5]]', 'iterations': 26, 'func_calls': 53, 'warnflag': 0, 'repeat': 0}