Criegee intermediates and their impacts on the troposphere

Khan, M. A.  H.; Percival, C. J.; Caravan, R. L.; Taatjes, C. A.; Shallcross, D. E.

doi:10.1039/C7EM00585G

Title: Criegee intermediates and their impacts on the troposphere

Journal Article · Thu Feb 15 00:00:00 EST 2018 · Environmental Science: Processes & Impacts

DOI:https://doi.org/10.1039/C7EM00585G· OSTI ID:1426808

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University of Bristol (United Kingdom). School of Chemistry
California Inst. of Technology (CalTech), Pasadena, CA (United States). Jet Propulsion Laboratory
Sandia National Lab. (SNL-CA), Livermore, CA (United States). Combustion Research Facility

We report Criegee intermediates (CIs), carbonyl oxides formed in ozonolysis of alkenes, play key roles in the troposphere. The decomposition of CIs can be a significant source of OH to the tropospheric oxidation cycle especially during nighttime and winter months. A variety of model-measurement studies have estimated surface-level stabilized Criegee intermediate (sCI) concentrations on the order of 1 × 10⁴ cm^-3 to 1 × 10⁵ cm^-3, which makes a non-negligible contribution to the oxidising capacity in the terrestrial boundary layer. The reactions of sCI with the water monomer and the water dimer have been found to be the most important bimolecular reactions to the tropospheric sCI loss rate, at least for the smallest carbonyl oxides; the products from these reactions (e.g. hydroxymethyl hydroperoxide, HMHP) are also of importance to the atmospheric oxidation cycle. The sCI can oxidise SO₂ to form SO₃, which can go on to form a significant amount of H₂SO₄ which is a key atmospheric nucleation species and therefore vital to the formation of clouds. Lastly, the sCI can also react with carboxylic acids, carbonyl compounds, alcohols, peroxy radicals and hydroperoxides, and the products of these reactions are likely to be highly oxygenated species, with low vapour pressures, that can lead to nucleation and SOA formation over terrestrial regions.

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Research Organization:: Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences, and Biosciences Division; USDOE National Nuclear Security Administration (NNSA)

Grant/Contract Number:: AC04-94AL85000; NA0003525

OSTI ID:: 1426808

Report Number(s):: SAND-2018-1551J; ESPICZ; 660688

Journal Information:: Environmental Science: Processes & Impacts, Vol. 20, Issue 3; ISSN 2050-7887

Publisher:: Royal Society of ChemistryCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 130 works

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Multiphase reactivity of gaseous hydroperoxide oligomers produced from isoprene ozonolysis in the presence of acidified aerosols Riva, Matthieu; Budisulistiorini, Sri Hapsari; Zhang, Zhenfa Atmospheric Environment, Vol. 152 https://doi.org/10.1016/j.atmosenv.2016.12.040	journal	March 2017
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Detection and identification of Criegee intermediates from the ozonolysis of biogenic and anthropogenic VOCs: comparison between experimental measurements and theoretical calculations Giorio, Chiara; Campbell, Sj; Bruschi, M. Apollo - University of Cambridge Repository https://doi.org/10.17863/cam.9888	text	January 2017

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Rapid unimolecular reaction of stabilized Criegee intermediates and implications for atmospheric chemistry Long, Bo; Bao, Junwei Lucas; Truhlar, Donald G. Nature Communications, Vol. 10, Issue 1 https://doi.org/10.1038/s41467-019-09948-7	journal	May 2019
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Unimolecular decay dynamics of Criegee intermediates: Energy-resolved rates, thermal rates, and their atmospheric impact Stephenson, Thomas A.; Lester, Marsha I. International Reviews in Physical Chemistry, Vol. 39, Issue 1 https://doi.org/10.1080/0144235x.2020.1688530	journal	December 2019