Understanding the Physics and Chemistry of Reaction Mechanisms from Atomic Contributions: A Reaction Force Perspective-Reference-Cited by-同舟云学术

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Understanding the Physics and Chemistry of Reaction Mechanisms from Atomic Contributions: A Reaction Force Perspective

Published:2012-06-29 Issue:27 Volume:116 Page:7419-7423
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Vöhringer-Martinez Esteban¹,Toro-Labbé Alejandro²

Affiliation:

1. Departamento de Físico-Química, Facultad de Ciencias Químicas, Universidad de Concepción, Concepción, Chile

2. Laboratorio de Química Teórica y Computacional (QTC), Facultad de Ciencias Químicas, Pontificia Universidad Cátolica de Chile, Santiago, Chile

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp303075k

Reference16 articles.

1. Characterization of Chemical Reactions from the Profiles of Energy, Chemical Potential, and Hardness

2. Reaction Force and Its Link to Diabatic Analysis: A Unifying Approach to Analyzing Chemical Reactions

3. Reaction Force Decomposition of Activation Barriers To Elucidate Solvent Effects

4. Reaction Force Analysis of the Effect of Mg(II) on the 1,3 Intramolecular Hydrogen Transfer in Thymine

5. Decomposition of energy and free energy changes by following the flow of work along reaction path

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1. On the link between the reaction force constant and conceptual DFT;Journal of Molecular Modeling;2024-09-14

2. Reaction fragility method: monitoring evolution of atoms and bonds on a reaction path;Chemical Reactivity;2023

3. Interacting Quantum Atoms Analysis of the Reaction Force: A Tool to Analyze Driving and Retarding Forces in Chemical Reactions;ChemPhysChem;2021-08-19

4. Feynman Force Analysis of Chemical Processes in Terms of Topological Atomic Contributions;The Journal of Physical Chemistry A;2020-07-13

5. Spectral Decomposition of the Reaction Force Constant;The Journal of Physical Chemistry A;2020-03-03

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