What can quantum information theory offer to quantum chemistry?-Reference-Cited by-同舟云学术

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What can quantum information theory offer to quantum chemistry?

Published:2024 Issue: Volume: Page:
ISSN:1359-6640
Container-title:Faraday Discussions
language:en
Short-container-title:Faraday Discuss.

Author:

Aliverti-Piuri Damiano¹²^ORCID,Chatterjee Kaustav¹²,Ding Lexin¹²^ORCID,Liao Ke¹²^ORCID,Liebert Julia¹²^ORCID,Schilling Christian¹²^ORCID

Affiliation:

1. Department of Physics, Arnold Sommerfeld Center for Theoretical Physics, Ludwig-Maximilians-Universität München, Theresienstrasse 37, 80333 München, Germany

2. Munich Center for Quantum Science and Technology (MCQST), Schellingstrasse 4, 80799 München, Germany

Abstract

QIT offers a comprehensive toolbox for electron correlation analysis, and development of new methods for solving the electronic problem. QChem in turn provides a platform to realize quantum technology, and supplies the valuable resource of quantum entanglement in molecules.

Funder

Deutsche Forschungsgemeinschaft

Munich Center for Quantum Science and Technology

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/FD/D4FD00059E

Reference143 articles.

1. Ab initiocalculations on porphin

2. Ab initio carbon capture in open-site metal–organic frameworks

3. Entangled quantum electronic wavefunctions of the Mn4CaO5 cluster in photosystem II

4. Low-energy spectrum of iron–sulfur clusters directly from many-particle quantum mechanics

5. Understanding the Mechanism Stabilizing Intermediate Spin States in Fe(II)-Porphyrin

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