scholarly journals Evaluated kinetic and photochemical data for atmospheric chemistry: Volume VII – Criegee intermediates

Author(s):  
R. Anthony Cox ◽  
Markus Ammann ◽  
John N. Crowley ◽  
Hartmut Herrmann ◽  
Michael E. Jenkin ◽  
...  

Abstract. This article, the seventh in the series, presents kinetic and photochemical data sheets evaluated by the IUPAC Task Group on Atmospheric Chemical Kinetic Data Evaluation. It covers an extension of the gas phase and photochemical reactions related to Criegee intermediates previously published in ACP in 2006, and implemented on the IUPAC website up to 2020. The article consists of an introduction, description of laboratory measurements, discussion of rate coefficients for reactions of O3 with alkenes producing Criegee intermediates, rate coefficients of unimolecular and bimolecular reactions and photochemical data for reactions of Criegee intermediates, and overview of the atmospheric chemistry of Criegee intermediates. Summary tables of the recommended kinetic and mechanistic parameters for the evaluated reactions are provided. Data sheets summarizing information upon which the recommendations are based are given in two files, provided as a Supplement to this article.

2020 ◽  
Vol 20 (21) ◽  
pp. 13497-13519
Author(s):  
R. Anthony Cox ◽  
Markus Ammann ◽  
John N. Crowley ◽  
Hartmut Herrmann ◽  
Michael E. Jenkin ◽  
...  

Abstract. This article, the seventh in the series, presents kinetic and photochemical data sheets evaluated by the IUPAC Task Group on Atmospheric Chemical Kinetic Data Evaluation. It covers an extension of the gas-phase and photochemical reactions related to Criegee intermediates previously published in Atmospheric Chemistry and Physics (ACP) in 2006 and implemented on the IUPAC website up to 2020. The article consists of an introduction, description of laboratory measurements, a discussion of rate coefficients for reactions of O3 with alkenes producing Criegee intermediates, rate coefficients of unimolecular and bimolecular reactions and photochemical data for reactions of Criegee intermediates, and an overview of the atmospheric chemistry of Criegee intermediates. Summary tables of the recommended kinetic and mechanistic parameters for the evaluated reactions are provided. Data sheets summarizing information upon which the recommendations are based are given in two files, provided as a Supplement to this article.


2020 ◽  
Author(s):  
Abdelwahid Mellouki ◽  
Markus Ammann ◽  
R. Anthony Cox ◽  
John N. Crowley ◽  
Hartmut Herrmann ◽  
...  

Abstract. This article, the eighth in the series, presents kinetic and photochemical datasheets evaluated by the IUPAC Task Group on Atmospheric Chemical Kinetic Data Evaluation. It covers the gas phase thermal and photochemical reactions of organic species with four, or more, carbon atoms (≥ C4) available on the IUPAC website in 2019, including thermal reactions of closed-shell organic species with HO and NO3 radicals, and their photolysis. The article consists of a summary table, containing the recommended kinetic parameters for the evaluated reactions, and a supplement containing the datasheets, which provide information upon which the recommendations are made.


2006 ◽  
Vol 6 (11) ◽  
pp. 3625-4055 ◽  
Author(s):  
R. Atkinson ◽  
D. L. Baulch ◽  
R. A. Cox ◽  
J. N. Crowley ◽  
R. F. Hampson ◽  
...  

Abstract. This article, the second in the series, presents kinetic and photochemical data evaluated by the IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry. It covers the gas phase and photochemical reactions of Organic species, which were last published in 1999, and were updated on the IUPAC website in late 2002, and subsequently during the preparation of this article. The article consists of a summary table of the recommended rate coefficients, containing the recommended kinetic parameters for the evaluated reactions, and eight appendices containing the data sheets, which provide information upon which the recommendations are made.


2005 ◽  
Vol 5 (4) ◽  
pp. 6295-7168 ◽  
Author(s):  
R. Atkinson ◽  
D. L. Baulch ◽  
R. A. Cox ◽  
J. N. Crowley ◽  
R. F. Hampson ◽  
...  

Abstract. This article, the second in the series, presents kinetic and photochemical data evaluated by the IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry. It covers the gas phase and photochemical reactions of Organic species, which were last published in 1999, and were updated on the IUPAC website in late 2002. The article consists of a summary sheet, containing the recommended kinetic parameters for the evaluated reactions, and eight appendices containing the data sheets, which provide information upon which the recommendations are made.


2007 ◽  
Vol 7 (4) ◽  
pp. 981-1191 ◽  
Author(s):  
R. Atkinson ◽  
D. L. Baulch ◽  
R. A. Cox ◽  
J. N. Crowley ◽  
R. F. Hampson ◽  
...  

Abstract. This article, the third in the series, presents kinetic and photochemical data evaluated by the IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry. It covers the gas phase and photochemical reactions of inorganic halogen species, which were last published in J. Phys. Chem. Ref. Data, in 2000 (Atkinson et al., 2000), were updated on the IUPAC website in 2003 and are updated again in the present evaluation. The article consists of a summary sheet, containing the recommended kinetic parameters for the evaluated reactions, and five appendices containing the data sheets, which provide information upon which the recommendations were made.


2007 ◽  
Vol 7 (6) ◽  
pp. 16349-17067 ◽  
Author(s):  
R. Atkinson ◽  
D. L. Baulch ◽  
R. A. Cox ◽  
J. N. Crowley ◽  
R. F. Hampson ◽  
...  

Abstract. This article, the fourth in the series, presents kinetic and photochemical data sheets evaluated by the IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry. It covers the gas phase and photochemical reactions of organic halogen species, which were last published in 1997, and were updated on the IUPAC website in 2006. The article consists of a summary sheet, containing the recommended kinetic parameters for the evaluated reactions, and four appendices containing the data sheets, which provide information upon which the recommendations are made.


2003 ◽  
Vol 3 (6) ◽  
pp. 6179-6699 ◽  
Author(s):  
R. Atkinson ◽  
D. L. Baulch ◽  
R. A. Cox ◽  
J. N. Crowley ◽  
R. F. Hampson ◽  
...  

Abstract. This article, the first in the series, presents kinetic and photochemical data evaluated by the IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry. It covers the gas phase and photochemical reactions of Ox, HOx, NOx and SOx species, which were last published in 1997, and were updated on the IUPAC website in late 2001. The article consists of a summary sheet, containing the recommended kinetic parameters for the evaluated reactions, and five appendices containing the data sheets, which provide information upon which the recommendations are made.


2006 ◽  
Vol 6 (2) ◽  
pp. 2281-2702 ◽  
Author(s):  
R. Atkinson ◽  
D. L. Baulch ◽  
R. A. Cox ◽  
J. N. Crowley ◽  
R. F. Hampson ◽  
...  

Abstract. This article, the third in the series, presents kinetic and photochemical data evaluated by the IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry. It covers the gas phase and photochemical reactions of inorganic halogen species, which were last published in J. Phys. Chem. Ref. Data in 2000 (Atkinson et al., 2000), and were updated on the IUPAC website in 2003. The article consists of a summary sheet, containing the recommended kinetic parameters for the evaluated reactions, and five appendices containing the data sheets, which provide information upon which the recommendations are made.


2018 ◽  
Vol 40 (4) ◽  
pp. 10-13
Author(s):  
R. Anthony Cox ◽  
Markus Ammann ◽  
John N. Crowley ◽  
Hartmut Herrmann ◽  
Michael E. Jenkin ◽  
...  

Abstract As we approach the end of the second decade of the 21st century, changes in atmospheric chemical composition due to anthropogenic pollution continue to challenge the well-being of society. The IUPAC effort in atmospheric chemistry data evaluation can be traced back over 40 years. Global concerns over potentially catastrophic stratospheric ozone depletion resulting from emissions of chlorofluorocarbons (CFCs) led to the creation of the CODATA Task Group on Chemical Kinetics in 1977. The task of the CODATA group was to provide the evaluated kinetic data for atmospheric reactions needed to assess the threat to stratospheric ozone. In 1989, sponsorship of the data evaluation effort was transferred to IUPAC, leading to the formation of the IUPAC Task Group on Atmospheric Chemical Kinetic Data Evaluation.


2021 ◽  
Vol 21 (6) ◽  
pp. 4797-4808
Author(s):  
Abdelwahid Mellouki ◽  
Markus Ammann ◽  
R. Anthony Cox ◽  
John N. Crowley ◽  
Hartmut Herrmann ◽  
...  

Abstract. This article, the eighth in the series, presents kinetic and photochemical data sheets evaluated by the IUPAC Task Group on Atmospheric Chemical Kinetic Data Evaluation. It covers the gas-phase thermal and photochemical reactions of organic species with four, or more, carbon atoms (≥ C4) available on the IUPAC website in 2021, including thermal reactions of closed-shell organic species with HO and NO3 radicals and their photolysis. The present work is a continuation of volume II (Atkinson et al., 2006), with new reactions and updated data sheets for reactions of HO (77 reactions) and NO3 (36 reactions) with ≥ C4 organics, including alkanes, alkenes, dienes, aromatics, oxygenated, organic nitrates and nitro compounds in addition to photochemical processes for nine species. The article consists of a summary table (Table 1), containing the recommended kinetic parameters for the evaluated reactions, and a supplement containing the data sheets, which provide information upon which recommendations are made.


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