Nonadiabatic Nuclear–Electron Dynamics: A Quantum Computing Approach-Reference-Cited by-同舟云学术

Nonadiabatic Nuclear–Electron Dynamics: A Quantum Computing Approach

Published:2023-08-01 Issue:31 Volume:14 Page:7065-7072
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Kovyrshin Arseny¹^ORCID,Skogh Mårten¹²,Tornberg Lars¹,Broo Anders¹,Mensa Stefano³,Sahin Emre³,Symons Benjamin C. B.³,Crain Jason⁴⁵^ORCID,Tavernelli Ivano⁶^ORCID

Affiliation:

1. Data Science and Modelling, Pharmaceutical Sciences, R&D, AstraZeneca Gothenburg, Pepparedsleden 1, Molndal SE-431 83, Sweden

2. Department of Chemistry and Chemical Engineering, Chalmers University of Technology, 412 96 Gothenburg, Sweden

3. The Hartree Centre, STFC, Sci-Tech Daresbury, Warrington WA4 4AD, United Kingdom

4. IBM Research Europe, Hartree Centre STFC Laboratory, Sci-Tech Daresbury, Warrington WA4 4AD, United Kingdom

5. Department of Biochemistry, University of Oxford, Oxford OX1 3QU, U.K.

6. IBM Quantum, IBM Research Europe−Zurich, Säumerstrasse 4, 8803 Rüschlikon, Switzerland

Funder

Wallenberg Center for Quantum Technology, Chalmers University of Technology

H2020 Future and Emerging Technologies

National Center of Competence in Research Quantum Science and Technology

Hartree National Centre for Digital Innovation

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.3c01589

Reference28 articles.

1. Rate of quantum-tunnelling reaction revealed

2. Capture of hydroxymethylene and its fast disappearance through tunnelling

3. Methylhydroxycarbene: Tunneling Control of a Chemical Reaction

4. Hydrogen Tunneling Links Protein Dynamics to Enzyme Catalysis

5. Hydrogen Tunneling in Enzyme Reactions

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