element=lattice type=modelname=Sr diamond Pair_Morse_Shifted_GirifalcoWeizer_MedCutoff_Sr__MO_964297938209_001 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -1.625962 Iterations: 34 Function evaluations: 71 {'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': 0.81298122665146322, 'space_group': 'Fd-3m', 'element': 'Sr', 'lattice_constant': 9.0771664381027222, 'wyckoff_code': '8a', 'crystal_structure': 'diamond', 'iterations': 34, 'warnflag': 0, 'species': 'Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr', 'func_calls': 71}