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Approximation de Born-Oppenheimer×Algorithme variationnel quantique d'estimation d'énergie×
DomaineInformatique quantiqueInformatique quantique
FamilleMachine learningMachine learning
Année d'origine19272014
Auteur d'origineMax Born and Julius Robert OppenheimerAlberto Peruzzo
TypeFundamental approximationHybrid quantum-classical algorithm
Source fondatriceBorn, M., Oppenheimer, J. R. (1927). Zur Quantentheorie der Moleküle. Annalen der Physik, 84, 457–484. DOI ↗Peruzzo, A., McClean, J., Shadbolt, P., et al. (2014). A variational eigenvalue solver on a photonic quantum processor. Nature Communications, 5, 4213. DOI ↗
AliasBO approximation, clamped nucleiVQE, hybrid quantum-classical
Apparentées34
RésuméThe Born-Oppenheimer (BO) Approximation is a foundational assumption in molecular quantum mechanics that nuclei can be treated as fixed while solving for electrons, and vice versa. Introduced by Born and Oppenheimer in 1927, this separation reduces the complex many-body electronic-nuclear problem to a sequence of simpler problems, enabling nearly all molecular calculations.The Variational Quantum Eigensolver (VQE) is a hybrid quantum-classical algorithm designed to find the lowest eigenvalue (ground state energy) of a quantum Hamiltonian. Introduced by Peruzzo et al. in 2014, it exploits the variational principle to combine the power of quantum circuits with classical optimization to solve chemistry and materials science problems on near-term quantum devices.
ScholarGateJeu de données
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ScholarGateComparer des méthodes: Born-Oppenheimer Approximation · Variational Quantum Eigensolver. Consulté le 2026-06-17 sur https://scholargate.app/fr/compare