Anchoring the potential energy surface for the Br + H2O → HBr + OH reaction-Reference-Cited by-同舟云学术

Anchoring the potential energy surface for the Br + H2O → HBr + OH reaction

Published:2014-06-17 Issue:8 Volume:133 Page:
ISSN:1432-881X
Container-title:Theoretical Chemistry Accounts
language:en
Short-container-title:Theor Chem Acc

Author:

Zhang Meiling,Hao Yanjun,Guo Yundong,Xie Yaoming,Schaefer Henry F.

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry

Link

http://link.springer.com/content/pdf/10.1007/s00214-014-1513-6.pdf

Reference43 articles.

1. Sander SP, Friedl RR, Barker JR, Golden DM, Kurylo MJ, Wine PH, Abbatt J, Burkholder JB, Kolb CE, Moortgat GK, Huie RE, Orkin VL (2009) Chemical kinetics and photochemical data for use in stratospheric studies evaluation number 16. NASA, Jet Propulsion Laboratory, California Institute of Technology, Pasadena, CA

2. Holloway AM, Wayne RP (2010) Atmospheric chemistry. RSC Publishing, Cambridge

3. Clark DR, Simmons RF, Smith DA (1970) Trans Faraday Soc 66:1423–1435

4. Sims IR, Smith IWM, Clary DC, Bocherel P, Rowe BR (1994) J Chem Phys 101:1748–1751

5. Clary DC, Nyman G, Hernandez R (1994) J Chem Phys 101:3704–3714

Cited by 10 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. The reaction between the bromine atom and the water trimer: high level theoretical studies;Physical Chemistry Chemical Physics;2022

2. The Role of Zero-Point Vibration and Reactant Attraction in Exothermic Bimolecular Reactions with Submerged Potential Barriers: Theoretical Studies of the R + HBr → RH + Br (R = CH3, HO) Systems;The Journal of Physical Chemistry A;2021-09-20

3. First-Principles Molecular Dynamics and Computed Rate Constants for the Series of OH-HX Reactions (X = H or the Halogens): Non-Arrhenius Kinetics, Stereodynamics and Quantum Tunnel;Computational Science and Its Applications – ICCSA 2018;2018

4. Theoretical Kinetic and Mechanistic Studies on the Reactions of CF3CBrCH2 (2-BTP) with OH and H Radicals;Molecules;2017-12-06

5. A novel assessment of the role of the methyl radical and water formation channel in the CH3OH + H reaction;Physical Chemistry Chemical Physics;2017