Molecule Problem Result¶
Executing a ground state molecule problem returns a list of tuples, with the second element providing the following (as a dictionary):
energy: float – The energy reached by VQE, i.e., the electronic part of energy in the Born-Oppenheimer approximation.
nuclear_repulsion_energy: float – The energy of the nucleus in the Born-Oppenheimer approximation.
total_energy: [float] – The total energy of the molecule, i.e., the sum over nuclear_repulsion_energy and energy.
hartree_fock_energy: float – The energy in the Hartree-Fock approximation.
vqe_result: Dict[str, Any] – The fields for the
VQESolverResult object, received from the VQE execution.