element=lattice type=modelname=Ta diamond EAM_MagneticCubic_DerletNguyenDudarev_2007_Ta__MO_261274272789_002 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -11.029271 Iterations: 33 Function evaluations: 68 {'basis_atoms': '[[0.0 0.0 0.0] [0.25 0.25 0.25] [0.0 0.5 0.5] [0.25 0.75 0.75] [0.5 0.0 0.5] [0.75 0.25 0.75] [0.5 0.5 0.0] [0.75 0.75 0.25]]', 'repeat': 0, 'cohesive_energy': 5.514635576846811, 'space_group': 'Fd-3m', 'element': 'Ta', 'lattice_constant': 6.504655569791794, 'wyckoff_code': '8a', 'crystal_structure': 'diamond', 'iterations': 33, 'warnflag': 0, 'species': 'Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ta', 'func_calls': 68} Potential info: Ta potential Atomic number: 73