Real-Space Approach to the Reaction Force: Understanding the Origin of Synchronicity/Nonsynchronicity in Multibond Chemical Reactions-Reference-Cited by-同舟云学术

Real-Space Approach to the Reaction Force: Understanding the Origin of Synchronicity/Nonsynchronicity in Multibond Chemical Reactions

Published:2020-02-14 Issue:10 Volume:124 Page:1959-1972
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Yepes Diana¹^ORCID,Munarriz Julen²,l’Anson Daniel²,Contreras-Garcia Julia²^ORCID,Jaque Pablo³^ORCID

Affiliation:

1. Departamento de Ciencias Quı́micas, Facultad de Ciencias Exactas, Universidad Andres Bello , Av. República 275, Santiago, Chile

2. Sorbonne Université, CNRS, Laboratoire de Chimie Théorique , CC 137-4, place Jussieu, F-75252 Paris Cedex 05, France

3. Departamento de Quı́mica Orgánica y Fisicoquı́mica, Facultad de Ciencias Quı́micas y Farmacéuticas, Universidad de Chile , Olivos, 1007 Santiago, Chile

Funder

Universidad de Zaragoza

Ministerio de Ciencia, Innovación y Universidades

Fondo Nacional de Desarrollo Científico y Tecnológico

Fundación Bancaria Ibercaja

Fundación CAI

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.9b10508

Reference69 articles.

1. Multibond reactions cannot normally be synchronous

2. Dynamics, transition states, and timing of bond formation in Diels-Alder reactions

3. Dynamics of 1,3-Dipolar Cycloadditions: Energy Partitioning of Reactants and Quantitation of Synchronicity

4. Complementarity of reaction force and electron localization function analyses of asynchronicity in bond formation in Diels–Alder reactions

5. Effect of the exchange–correlation functional on the synchronicity/nonsynchronicity in bond formation in Diels–Alder reactions: a reaction force constant analysis

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