Reactive mode composition factor analysis of transition states: the case of coupled electron–proton transfers-Reference-Cited by-同舟云学术

Reactive mode composition factor analysis of transition states: the case of coupled electron–proton transfers

Published:2019 Issue:45 Volume:21 Page:24912-24918
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Maldonado-Domínguez Mauricio¹²³⁴^ORCID,Bím Daniel¹²³⁴⁵^ORCID,Fučík Radek⁶⁷⁸⁴^ORCID,Čurík Roman¹²³⁴^ORCID,Srnec Martin¹²³⁴^ORCID

Affiliation:

1. J. Heyrovský Institute of Physical Chemistry

2. The Czech Academy of Sciences

3. Prague 8

4. Czech Republic

5. Institute of Organic Chemistry and Biochemistry

6. Department of Mathematics, Faculty of Nuclear Sciences and Physical Engineering

7. Czech Technical University in Prague

8. 12000 Praha 2

Abstract

The kinetic energy distribution in the reactive mode in transition states correlates the asynchronicity of CPET with relative kinetic isotope effects.

Funder

Ministerstvo Školství, Mládeže a Tělovýchovy

Grantová Agentura České Republiky

European Commission

České Vysoké Učení Technické v Praze

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP05131G

Reference39 articles.

1. Partial Control of an Ion-Molecule Reaction by Selection of the Internal Motion of the Polyatomic Reagent Ion

2. Ground-State Chemical Reactivity under Vibrational Coupling to the Vacuum Electromagnetic Field

3. How Is C–H Vibrational Energy Redistributed in F + CHD3(ν1 = 1) → HF + CD3?

4. Reactions of O, H, and Cl atoms with highly vibrationally excited HCN: Using product states to determine mechanisms

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