A quantum computing formulation of electron nuclear dynamics is derived with the Fukutome unitary representation and demonstrated on H2+ with simulator circuits.
Time-dependent theoretical treatments of the dynamics of electrons and nuclei in molecular systems
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Toward a Quantum Computing Formulation of the Electron Nuclear Dynamics Method via Fukutome Unitary Representation
A quantum computing formulation of electron nuclear dynamics is derived with the Fukutome unitary representation and demonstrated on H2+ with simulator circuits.