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Spiers Memorial Lecture: Quantum chemistry, classical heuristics, and quantum advantage

Garnet Kin‐Lic Chan

2024Faraday Discussions18 citationsDOIOpen Access PDF

Abstract

We describe the problems of quantum chemistry, the intuition behind classical heuristic methods used to solve them, a conjectured form of the classical complexity of quantum chemistry problems, and the subsequent opportunities for quantum advantage. This article is written for both quantum chemists and quantum information theorists. In particular, we attempt to summarize the domain of quantum chemistry problems as well as the chemical intuition that is applied to solve them within concrete statements (such as a classical heuristic cost conjecture) in the hope that this may stimulate future analysis.

Topics & Concepts

Quantum chemistryQuantumHeuristicsChemistryComputer scienceNanotechnologyStatistical physicsTheoretical physicsPhysicsQuantum mechanicsMaterials scienceReaction mechanismOrganic chemistryCatalysisOperating systemQuantum Computing Algorithms and ArchitectureQuantum Information and CryptographyQuantum many-body systems
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