Deciphering Dynamics of the Cl + SiH<sub>4</sub> → H + SiH<sub>3</sub>Cl Reaction on a Machine Learning Made Globally Accurate Full-Dimensional Potential Energy Surface-Reference-Cited by-同舟云学术

Deciphering Dynamics of the Cl + SiH₄ → H + SiH₃Cl Reaction on a Machine Learning Made Globally Accurate Full-Dimensional Potential Energy Surface

Published:2022-09-09 Issue:37 Volume:126 Page:6456-6466
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Xu Xiaohu¹,Li Jun¹^ORCID

Affiliation:

1. School of Chemistry and Chemical Engineering & Chongqing Key Laboratory of Theoretical and Computational Chemistry, Chongqing University, Chongqing 401331, China

Funder

Natural Science Foundation of Chongqing

Venture and Innovation Support Program for Chongqing Overseas Returnees

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c05417

Reference37 articles.

1. Reaction Dynamics of Methane with F, O, Cl, and Br on ab Initio Potential Energy Surfaces

2. Advances and New Challenges to Bimolecular Reaction Dynamics Theory

3. Crossed Beams Study on the Dynamics of Cl Atom Reaction with Silane

4. Mechanistic Studies of Chemical Vapor Deposition

5. An accurate potential energy surface and ring polymer molecular dynamics study of the Cl + CH4→ HCl + CH3reaction

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