State Preparation in Quantum Algorithms for Fragment-Based Quantum Chemistry-Reference-Cited by-同舟云学术

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State Preparation in Quantum Algorithms for Fragment-Based Quantum Chemistry

Published:2024-04-12 Issue:8 Volume:20 Page:3121-3130
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

D’Cunha Ruhee¹^ORCID,Otten Matthew²,Hermes Matthew R.¹^ORCID,Gagliardi Laura¹³⁴⁵^ORCID,Gray Stephen K.⁶

Affiliation:

1. Department of Chemistry, The University of Chicago, Chicago, Illinois 60637, United States

2. HRL Laboratories LLC, Malibu, California 90265, United States

3. Argonne National Laboratory, Lemont, Illinois 60439, United States

4. James Franck Institute, Chicago, Illinois 60637, United States

5. Pritzker School of Molecular Engineering, Chicago, Illinois 60637, United States

6. Center for Nanoscale Materials, Argonne National Laboratory, Lemont, Illinois 60439, United States

Funder

Defense Advanced Research Projects Agency

National Science Foundation

Argonne National Laboratory

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c01283

Reference45 articles.

1. Hartree-Fock on a superconducting qubit quantum computer

2. Hardware-efficient variational quantum eigensolver for small molecules and quantum magnets

3. Quantum computing enhanced computational catalysis

4. Individualized configuration selection in CI calculations with subsequent energy extrapolation

5. Applicability of the multi-reference double-excitation CI (MRD-CI) method to the calculation of electronic wavefunctions and comparison with related techniques

Cited by 2 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. The Localized Active Space Method with Unitary Selective Coupled Cluster;Journal of Chemical Theory and Computation;2024-09-10

2. Size‐consistency and orbital‐invariance issues revealed by VQE‐UCCSD calculations with the FMO scheme;Journal of Computational Chemistry;2024-05-25

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