Articles | Volume 22, issue 9
https://doi.org/10.5194/acp-22-6167-2022
© Author(s) 2022. This work is distributed under
the Creative Commons Attribution 4.0 License.
the Creative Commons Attribution 4.0 License.
https://doi.org/10.5194/acp-22-6167-2022
© Author(s) 2022. This work is distributed under
the Creative Commons Attribution 4.0 License.
the Creative Commons Attribution 4.0 License.
Estimation of mechanistic parameters in the gas-phase reactions of ozone with alkenes for use in automated mechanism construction
Mike J. Newland
CORRESPONDING AUTHOR
Wolfson Atmospheric Chemistry Laboratories, Department of Chemistry, University of York, York, UK
now at: ICARE-CNRS, 1 C Av. de la Recherche Scientifique, 45071 Orléans CEDEX 2, France
Camille Mouchel-Vallon
Wolfson Atmospheric Chemistry Laboratories, Department of Chemistry, University of York, York, UK
now at: Laboratoire d'Aérologie, Université de Toulouse, CNRS, UPS, Toulouse, France
Richard Valorso
Univ Paris Est Creteil and Université de Paris, CNRS, LISA, 94010 Créteil, France
Bernard Aumont
Univ Paris Est Creteil and Université de Paris, CNRS, LISA, 94010 Créteil, France
Luc Vereecken
Forschungszentrum Jülich GmbH, Institute for Energy and Climate, IEK-8 Troposphere, 52428 Jülich, Germany
Michael E. Jenkin
Atmospheric Chemistry Services, Okehampton, Devon, EX20 4QB, UK
Andrew R. Rickard
Wolfson Atmospheric Chemistry Laboratories, Department of Chemistry, University of York, York, UK
National Centre for Atmospheric Science, Wolfson Atmospheric Chemistry Laboratories, University of York, York, UK
Viewed
Total article views: 3,532 (including HTML, PDF, and XML)
Cumulative views and downloads
(calculated since 03 Jan 2022)
HTML | XML | Total | Supplement | BibTeX | EndNote | |
---|---|---|---|---|---|---|
2,532 | 920 | 80 | 3,532 | 185 | 66 | 94 |
- HTML: 2,532
- PDF: 920
- XML: 80
- Total: 3,532
- Supplement: 185
- BibTeX: 66
- EndNote: 94
Total article views: 2,645 (including HTML, PDF, and XML)
Cumulative views and downloads
(calculated since 11 May 2022)
HTML | XML | Total | Supplement | BibTeX | EndNote | |
---|---|---|---|---|---|---|
2,034 | 556 | 55 | 2,645 | 96 | 59 | 81 |
- HTML: 2,034
- PDF: 556
- XML: 55
- Total: 2,645
- Supplement: 96
- BibTeX: 59
- EndNote: 81
Total article views: 887 (including HTML, PDF, and XML)
Cumulative views and downloads
(calculated since 03 Jan 2022)
HTML | XML | Total | Supplement | BibTeX | EndNote | |
---|---|---|---|---|---|---|
498 | 364 | 25 | 887 | 89 | 7 | 13 |
- HTML: 498
- PDF: 364
- XML: 25
- Total: 887
- Supplement: 89
- BibTeX: 7
- EndNote: 13
Viewed (geographical distribution)
Total article views: 3,532 (including HTML, PDF, and XML)
Thereof 3,522 with geography defined
and 10 with unknown origin.
Total article views: 2,645 (including HTML, PDF, and XML)
Thereof 2,622 with geography defined
and 23 with unknown origin.
Total article views: 887 (including HTML, PDF, and XML)
Thereof 887 with geography defined
and 0 with unknown origin.
Country | # | Views | % |
---|
Country | # | Views | % |
---|
Country | # | Views | % |
---|
Total: | 0 |
HTML: | 0 |
PDF: | 0 |
XML: | 0 |
- 1
1
Total: | 0 |
HTML: | 0 |
PDF: | 0 |
XML: | 0 |
- 1
1
Total: | 0 |
HTML: | 0 |
PDF: | 0 |
XML: | 0 |
- 1
1
Cited
11 citations as recorded by crossref.
- Quantifying the impact of relative humidity on human exposure to gas phase squalene ozonolysis products P. Lakey et al. 10.1039/D2EA00112H
- Tropospheric alkene ozonolysis chemistry: an extended computational chemistry assessment of structural effects N. Watson et al. 10.1039/D4VA00298A
- Implementation of a parallel reduction algorithm in the GENerator of reduced Organic Aerosol mechanisms (GENOA v2.0): Application to multiple monoterpene aerosol precursors Z. Wang et al. 10.1016/j.jaerosci.2023.106248
- Tracking the reaction networks of acetaldehyde oxide and glyoxal oxide Criegee intermediates in the ozone-assisted oxidation reaction of crotonaldehyde A. DeCecco et al. 10.1039/D4CP01942C
- Investigating the Atmospheric Fate of the Ozonolysis of 3-Methyl-2-butene-1-thiol J. Nascimento et al. 10.1021/acsestair.5c00087
- Average Cloud Droplet Size and Composition: Good Assumptions for Predicting Oxidants in the Atmospheric Aqueous Phase? B. Ervens 10.1021/acs.jpca.2c05527
- Unimolecular Reactions of E -Glycolaldehyde Oxide and Its Reactions with One and Two Water Molecules Y. Sun et al. 10.34133/research.0143
- Spiers Memorial Lecture: Theory of unimolecular reactions S. Klippenstein 10.1039/D2FD00125J
- Ether and ester formation from peroxy radical recombination: a qualitative reaction channel analysis L. Franzon et al. 10.5194/acp-24-11679-2024
- O3 chemistry of 2,5-dimethylfuran: mechanism development N. Illmann & V. Rösgen 10.1039/D4EA00045E
- Unimolecular and water reactions of oxygenated and unsaturated Criegee intermediates under atmospheric conditions L. Vereecken et al. 10.1039/D1CP05877K
10 citations as recorded by crossref.
- Quantifying the impact of relative humidity on human exposure to gas phase squalene ozonolysis products P. Lakey et al. 10.1039/D2EA00112H
- Tropospheric alkene ozonolysis chemistry: an extended computational chemistry assessment of structural effects N. Watson et al. 10.1039/D4VA00298A
- Implementation of a parallel reduction algorithm in the GENerator of reduced Organic Aerosol mechanisms (GENOA v2.0): Application to multiple monoterpene aerosol precursors Z. Wang et al. 10.1016/j.jaerosci.2023.106248
- Tracking the reaction networks of acetaldehyde oxide and glyoxal oxide Criegee intermediates in the ozone-assisted oxidation reaction of crotonaldehyde A. DeCecco et al. 10.1039/D4CP01942C
- Investigating the Atmospheric Fate of the Ozonolysis of 3-Methyl-2-butene-1-thiol J. Nascimento et al. 10.1021/acsestair.5c00087
- Average Cloud Droplet Size and Composition: Good Assumptions for Predicting Oxidants in the Atmospheric Aqueous Phase? B. Ervens 10.1021/acs.jpca.2c05527
- Unimolecular Reactions of E -Glycolaldehyde Oxide and Its Reactions with One and Two Water Molecules Y. Sun et al. 10.34133/research.0143
- Spiers Memorial Lecture: Theory of unimolecular reactions S. Klippenstein 10.1039/D2FD00125J
- Ether and ester formation from peroxy radical recombination: a qualitative reaction channel analysis L. Franzon et al. 10.5194/acp-24-11679-2024
- O3 chemistry of 2,5-dimethylfuran: mechanism development N. Illmann & V. Rösgen 10.1039/D4EA00045E
Latest update: 18 Jun 2025
Short summary
Alkene ozonolysis produces Criegee intermediates, which can act as oxidants or decompose to give a range of closed-shell and radical products, including OH. Therefore it is essential to accurately represent the chemistry of Criegee intermediates in atmospheric models in order to understand their impacts on atmospheric composition. Here we provide a mechanism construction protocol by which the central features of alkene ozonolysis chemistry can be included in an automatic mechanism generator.
Alkene ozonolysis produces Criegee intermediates, which can act as oxidants or decompose to give...
Altmetrics
Final-revised paper
Preprint