Balancing Dynamic and Nondynamic Correlation for Diradical and Aromatic Transition States: A Renormalized Coupled-Cluster Study of the Cope Rearrangement of 1,5-Hexadiene-Reference-Cited by-同舟云学术

Balancing Dynamic and Nondynamic Correlation for Diradical and Aromatic Transition States: A Renormalized Coupled-Cluster Study of the Cope Rearrangement of 1,5-Hexadiene

Published:2005-02-05 Issue:8 Volume:127 Page:2608-2614
ISSN:0002-7863
Container-title:Journal of the American Chemical Society
language:en
Short-container-title:J. Am. Chem. Soc.

Author:

McGuire Michael J.¹,Piecuch Piotr¹

Affiliation:

1. Contribution from the Department of Chemistry, Michigan State University, East Lansing, Michigan 48824

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

Link

https://pubs.acs.org/doi/pdf/10.1021/ja044734d

Reference41 articles.

1. The Cope rearrangement in theoretical retrospect

2. Synchronicity in Multibond Reactions

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