Cited by 5Quantum Computing Algorithms and ArchitectureAdvanced Chemical Physics StudiesQuantum many-body systems

Artificial neural network encoding of molecular wavefunctions for quantum computing

Open access
Hagai, Masaya, Sugiyama, Mahito, Tsuda, Koji, Yanai, Takeshi·2023·Digital Discovery

Published version of a preprint

Abstract

Molecular wavefunction encoded with artificial neural networks (BM2, BM3, and RBM) is prepared by the quantum algorithm.

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Integrity signals

Registry

Crossref · 10.1039/d2dd00093h

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10 of 10 references verified0 citation errors · 0 not checkable

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Authors
Hagai, M., Sugiyama, M., Tsuda, K., & Yanai, T.
Affiliations
  • Nagoya University (JP)
  • National Institute of Informatics (JP)
  • National Institute for Materials Science (JP)
  • Institute of Transformative Bio-Molecules (JP)
Corresponding author
  • Hagai, Masaya
  • Yanai, Takeshi
Venue
Digital Discovery
Published
2023
Volume
2
Issue
3
Pages
634-650
ISSN
2635-098X (ISSN-L)
OpenAlex
W4361854484
Cited by
5
References
10
Citations by year
2025: 1 · 2024: 3 · 2023: 1
FWCI
0.47
Type
journal article
Language
en
Open access
Locations
  • Digital Discovery (publishedVersion, cc-by)
  • ChemRxiv (acceptedVersion, cc-by-nc-nd)
Funders
  • Japan Society for the Promotion of Science (21K18931, 21H01881, JPJSBP120229601)
  • Japan Science and Technology Agency (17937609, JPMJFR206J, JPMJCR22D3)
Topics
  • Physical Sciences › Computer Science › Artificial Intelligence › Quantum Computing Algorithms and Architecture
  • Physical Sciences › Physics and Astronomy › Atomic and Molecular Physics, and Optics › Advanced Chemical Physics Studies
  • Physical Sciences › Physics and Astronomy › Atomic and Molecular Physics, and Optics › Quantum many-body systems
Keywords
artificial neural networks, molecular wave functions, quantum computing, variational quantum algorithms, restricted Boltzmann machine, Boltzmann machine, quantum chemistry

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