Try Modelling Coordination Complexes
with Quantum Computing

Find the most stable spin state of the iron complex Fe(III)-NTA through Coordination Complex Modelling, and check whether quantum algorithms reproduce the trusted classical answer. Compare classical methods (ROHF, CCSD, MP2) and quantum methods (VQE, Adiabatic) against the trusted CASCI reference across a range of active spaces. Results are precomputed and served from a cache.