element=lattice type=modelname=Pt sc Tersoff_LAMMPS_Albe_Nordlund_Averback_PtC__MO_500121566391_001 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms Optimization terminated successfully. Current function value: -4.866458 Iterations: 25 Function evaluations: 51 {'basis_atoms': '[[0.0 0.0 0.0]]', 'repeat': 0, 'cohesive_energy': 4.866457921893669, 'space_group': 'Pm-3m', 'element': 'Pt', 'lattice_constant': 2.6197058707475662, 'wyckoff_code': '1a', 'crystal_structure': 'sc', 'iterations': 25, 'warnflag': 0, 'species': 'Pt', 'func_calls': 51}