Study of the H+O2 reaction by means of quantum mechanical and statistical approaches: The dynamics on two different potential energy surfaces-Reference-Cited by-同舟云学术

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Study of the H+O2 reaction by means of quantum mechanical and statistical approaches: The dynamics on two different potential energy surfaces

Published:2008-06-28 Issue:24 Volume:128 Page:244308
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Bargueño Pedro,González-Lezana Tomás,Larrégaray Pascal,Bonnet Laurent,Rayez Jean-Claude,Hankel Marlies,Smith Sean C.,Meijer Anthony J. H. M.

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.2944246

Reference93 articles.

1. A new ab initio potential-energy surface of HO2(X2A″) and quantum studies of HO2 vibrational spectrum and rate constants for the H+O2↔O+OH reactions

2. Rate constant for OH(Π2)+O(P3)→H(S2)+O2(Σg−3) reaction on an improved ab initio potential energy surface and implications for the interstellar oxygen problem

3. Quantum Dynamics of the H + O2 → O + OH Reaction on an Accurate ab Initio Potential Energy Surface

4. Revelation of non-statistical behavior in HO2 vibration by a newab initiopotential energy surface

5. Fully Coriolis-Coupled Quantum Studies of the H + O2 (υi = 0−2, ji = 0,1) → OH + O Reaction on an Accurate Potential Energy Surface: Integral Cross Sections and Rate Constants

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3. Statistical properties of quantum probability fluctuations in complex-forming chemical reactions;The Journal of Chemical Physics;2020-02-28

4. Molecular Dynamics of Combustion Reactions in Supercritical Carbon Dioxide. 6. Computational Kinetics of Reactions between Hydrogen Atom and Oxygen Molecule H + O2 ⇌ HO + O and H + O2 ⇌ HO2;The Journal of Physical Chemistry A;2019-12-10

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