An <i>ab initio</i> study of the photodissociation of the vinyl radical-Reference-Cited by-同舟云学术

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An ab initio study of the photodissociation of the vinyl radical

Published:2022 Issue:12 Volume:24 Page:7387-7395
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Bouallagui A.¹²,Zanchet A.²^ORCID,Bañares L.³⁴,García-Vela A.²^ORCID

Affiliation:

1. Laboratoire de Spectroscopie Atomique, Moléculaire et Applications-LSAMA LR01ES09, Faculté des Sciences de Tunis, Université de Tunis El Manar, 2092, Tunis, Tunisia

2. Instituto de Física Fundamental, Consejo Superior de Investigaciones Científicas, Serrano 123, 28006 Madrid, Spain

3. Departamento de Química Física, Facultad de Ciencias Químicas, Universidad Complutense de Madrid (Unidad Asociada I + D + i CSIC), 28040 Madrid, Spain

4. Instituto Madrileño de Estudios Avanzados en Nanociencia (IMDEA-Nanoscience), 28049 Madrid, Spain

Abstract

The photodissociation pathways of the vinyl radical are investigated by means of high-level ab initio calculations.

Funder

Ministerio de Ciencia e Innovación

Consejo Superior de Investigaciones Científicas

Horizon 2020

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D2CP00180B

Reference53 articles.

1. Forming benzene in flames by chemically activated isomerization

2. Chemical Kinetics and Combustion Modeling

3. Ab Initio Computation of Combustion Kinetics. 1. Vinyl Radical + O2

4. Collision processes of C2,3Hy and C2,3Hy+ hydrocarbons with electrons and protons

5. Clouds, aerosols, and photochemistry in the Jovian atmosphere

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1. A high-level ab initio study of the photodissociation of acetaldehyde;The Journal of Chemical Physics;2024-06-14

2. A High-level Ab Initio Study of the Destruction of Methanimine under UV Radiation;The Astrophysical Journal;2023-10-01

3. Photoinduced Remote C(sp³)–H Imination Enabled by Vinyl Radical-Mediated 1,5-Hydrogen Atom Transfer;Organic Letters;2023-02-24

4. An ab initio study of the photodissociation of CH₂I and CH₂I⁺;Physical Chemistry Chemical Physics;2023

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