The lowest doublet and quartet potential energy surfaces involved in the N(4S)+O2 reaction. II. Ab initio study of the C2v-symmetry insertion mechanism-Reference-Cited by-同舟云学术

The lowest doublet and quartet potential energy surfaces involved in the N(4S)+O2 reaction. II. Ab initio study of the C2v-symmetry insertion mechanism

Published:2002-07-08 Issue:2 Volume:117 Page:680-692
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

González Miguel,Oliva Carolina,Sayós R.

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.1484384

Reference43 articles.

1. The lowest doublet and quartet potential energy surfaces involved in the N(4S)+O2 reaction. I. Ab initio study of the Cs-symmetry (2A′, 4A′) abstraction and insertion mechanisms

2. Thermodynamic Properties of Key Organic Oxygen Compounds in the Carbon Range C1 to C4. Part 1. Properties of Condensed Phases

3. Abinitio MRD-CI study of NO2. 1. Multi-dimensional potential surfaces for the two lowest 2A′ states

4. Ab initiostudy of NO2

5. Abinitio study of NO2. V. Nonadiabatic vibronic states and levels of theX̃ 2A1/Ã 2B2conical intersection

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