State-to-State Quantum Dynamics Calculations of the C + OH Reaction on the Second Excited Potential Energy Surface-Reference-Cited by-同舟云学术

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State-to-State Quantum Dynamics Calculations of the C + OH Reaction on the Second Excited Potential Energy Surface

Published:2011-07-26 Issue:32 Volume:115 Page:8791-8796
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Jorfi M.¹,Honvault P.²³

Affiliation:

1. LOMC, FRE 3102 CNRS/Université du Havre, 76058 Le Havre Cedex, France

2. Laboratoire Interdisciplinaire Carnot de Bourgogne, UMR CNRS 5209, Université de Bourgogne, 21078 Dijon Cedex, France

3. Institut UTINAM, UMR 6213 CNRS, Université de Franche-Comté, 25030 Besançon Cedex, France

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp202879n

Reference24 articles.

1. Study of the C(3P) + OH(X2Π) → CO(XΣg+) + H(2S) Reaction: A Fully Global ab Initio Potential Energy Surface of the XA‘ State

2. Cross sections and rate constants for the C(P3)+OH(XΠ2)→CO(XΣ+1)+H(S2) reaction using a quasiclassical trajectory method

3. Differential cross sections and product energy distributions for the C(P3)+OH(XΠ2)→CO(XΣ+1)+H(S2) reaction using a quasiclassical trajectory method

4. Study of the C(3P) + OH(X2Π) → CO(a3Π) + H(2S) reaction: fully global ab initio potential energy surfaces of the 12A″ and 14A″ excited states and non adiabatic couplings

5. Quantum dynamics of C(3P)+OH(X2Π)→H(2S)+CO(X1Σ+) reaction

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. Quantum and quasi-classical dynamics of the C(³P) + O₂(³Σ−g) → CO(¹Σ⁺) + O(¹D) reaction on its electronic ground state;Physical Chemistry Chemical Physics;2022

2. The Study of Stability and Structure of the Interaction Between β-Carotene Compounds with Methanol, Ethanol, Acetone, Chloroform, Carbon Tetrachloride, Cyclohexane, and N-Hexane using the Hartree-Fock and the Density Functional Theory Method;Journal of Physics: Conference Series;2021-03-01

3. A theoretical study on the C + OH reaction dynamics and product energy disposal with vibrationally excited reagent;The European Physical Journal D;2018-12

4. Effect of internal excitations of reagent diatom on initial state-selected dynamics of C + OH reaction on its second excited (14A″) electronic state;Molecular Physics;2017-03-08

5. Time-Dependent Quantum Wave Packet Dynamics of S + OH Reaction on Its Electronic Ground State;The Journal of Physical Chemistry A;2014-07-23

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