Articles | Volume 17, issue 13
https://doi.org/10.5194/acp-17-8357-2017
© Author(s) 2017. This work is distributed under
the Creative Commons Attribution 3.0 License.
the Creative Commons Attribution 3.0 License.
https://doi.org/10.5194/acp-17-8357-2017
© Author(s) 2017. This work is distributed under
the Creative Commons Attribution 3.0 License.
the Creative Commons Attribution 3.0 License.
Research article
| 
10 Jul 2017
Research article |
| 10 Jul 2017
Comprehensive atmospheric modeling of reactive cyclic siloxanes and their oxidation products
Nathan J. Janechek
Department of Chemical and Biochemical Engineering, University of Iowa, Iowa City, IA 52242, USA
IIHR Hydroscience and Engineering, University of Iowa, Iowa City, IA 52242, USA
Kaj M. Hansen
Department of Environmental Science, Aarhus University, Roskilde, Denmark
Charles O. Stanier
CORRESPONDING AUTHOR
Department of Chemical and Biochemical Engineering, University of Iowa, Iowa City, IA 52242, USA
IIHR Hydroscience and Engineering, University of Iowa, Iowa City, IA 52242, USA
Related authors
Huanxin Zhang, Jun Wang, Nathan Janechek, Cui Ge, Meng Zhou, Lorena Castro García, Tong Sha, Yanyu Wang, Weizhi Deng, Zhixin Xue, Chengzhe Li, Lakhima Chutia, Yi Wang, Sebastian Val, James L. McDuffie, Sina Hasheminassab, Scott E. Gluck, David J. Diner, Peter R. Colarco, and Arlindo M. da Silva
EGUsphere, https://doi.org/10.5194/egusphere-2025-1360, https://doi.org/10.5194/egusphere-2025-1360, 2025
This preprint is open for discussion and under review for Geoscientific Model Development (GMD).
Short summary
Short summary
We present here the development of the Unified Inputs (of initial and boundary conditions) for WRF-Chem (UI-WRF-Chem) framework to support the Multi-Angle Imager for Aerosols (MAIA) satellite mission. Some of the major updates include improving dust size distribution in the chemical boundary conditions, updating land surface properties using timely satellite data and improvement of soil NOx emissions. We demonstrate subsequent model improvement over several of the MAIA target areas.
Nathan J. Janechek, Rachel F. Marek, Nathan Bryngelson, Ashish Singh, Robert L. Bullard, William H. Brune, and Charles O. Stanier
Atmos. Chem. Phys., 19, 1649–1664, https://doi.org/10.5194/acp-19-1649-2019, https://doi.org/10.5194/acp-19-1649-2019, 2019
Short summary
Short summary
Cyclic volatile methyl siloxanes (cVMSs) are widely used chemicals in personal care products which can undergo oxidation to generate secondary organic aerosol. In this work, cVMS oxidation aerosols were generated using a photochemical chamber and the physical properties characterized. The aerosol yield, volatility, hygroscopicity, morphology, elemental composition, and proposed parameters for treatment as secondary organic aerosol in atmospheric models are provided.
Huanxin Zhang, Jun Wang, Nathan Janechek, Cui Ge, Meng Zhou, Lorena Castro García, Tong Sha, Yanyu Wang, Weizhi Deng, Zhixin Xue, Chengzhe Li, Lakhima Chutia, Yi Wang, Sebastian Val, James L. McDuffie, Sina Hasheminassab, Scott E. Gluck, David J. Diner, Peter R. Colarco, and Arlindo M. da Silva
EGUsphere, https://doi.org/10.5194/egusphere-2025-1360, https://doi.org/10.5194/egusphere-2025-1360, 2025
This preprint is open for discussion and under review for Geoscientific Model Development (GMD).
Short summary
Short summary
We present here the development of the Unified Inputs (of initial and boundary conditions) for WRF-Chem (UI-WRF-Chem) framework to support the Multi-Angle Imager for Aerosols (MAIA) satellite mission. Some of the major updates include improving dust size distribution in the chemical boundary conditions, updating land surface properties using timely satellite data and improvement of soil NOx emissions. We demonstrate subsequent model improvement over several of the MAIA target areas.
Marc Guevara, Augustin Colette, Antoine Guion, Valentin Petiot, Mario Adani, Joaquim Arteta, Anna Benedictow, Robert Bergström, Andrea Bolignano, Paula Camps, Ana C. Carvalho, Jesper Heile Christensen, Florian Couvidat, Ilia D’Elia, Hugo Denier van der Gon, Gaël Descombes, John Douros, Hilde Fagerli, Yalda Fatahi, Elmar Friese, Lise Frohn, Michael Gauss, Camilla Geels, Risto Hänninen, Kaj Hansen, Oriol Jorba, Jacek W. Kaminski, Rostislav Kouznetsov, Richard Kranenburg, Jeroen Kuenen, Victor Lannuque, Frédérik Meleux, Agnes Nyíri, Yuliia Palamarchuk, Carlos Pérez García-Pando, Lennard Robertson, Felicita Russo, Arjo Segers, Mikhail Sofiev, Joanna Struzewska, Renske Timmermans, Andreas Uppstu, Alvaro Valdebenito, and Zhuyun Ye
EGUsphere, https://doi.org/10.5194/egusphere-2025-1287, https://doi.org/10.5194/egusphere-2025-1287, 2025
This preprint is open for discussion and under review for Atmospheric Chemistry and Physics (ACP).
Short summary
Short summary
Air quality models require hourly emissions to accurately represent dispersion and physico-chemical processes in the atmosphere. Since emission inventories are typically provided at the annual level, emissions are downscaled to a refined temporal resolution using temporal profiles. This study quantifies the impact of using new anthropogenic temporal profiles on the performance of an European air quality multi-model ensemble. Overall, the findings indicate an improvement of the modelling results.
Augustin Colette, Gaëlle Collin, François Besson, Etienne Blot, Vincent Guidard, Frederik Meleux, Adrien Royer, Valentin Petiot, Claire Miller, Oihana Fermond, Alizé Jeant, Mario Adani, Joaquim Arteta, Anna Benedictow, Robert Bergström, Dene Bowdalo, Jorgen Brandt, Gino Briganti, Ana C. Carvalho, Jesper Heile Christensen, Florian Couvidat, Ilia D’Elia, Massimo D’Isidoro, Hugo Denier van der Gon, Gaël Descombes, Enza Di Tomaso, John Douros, Jeronimo Escribano, Henk Eskes, Hilde Fagerli, Yalda Fatahi, Johannes Flemming, Elmar Friese, Lise Frohn, Michael Gauss, Camilla Geels, Guido Guarnieri, Marc Guevara, Antoine Guion, Jonathan Guth, Risto Hänninen, Kaj Hansen, Ulas Im, Ruud Janssen, Marine Jeoffrion, Mathieu Joly, Luke Jones, Oriol Jorba, Evgeni Kadantsev, Michael Kahnert, Jacek W. Kaminski, Rostislav Kouznetsov, Richard Kranenburg, Jeroen Kuenen, Anne Caroline Lange, Joachim Langner, Victor Lannuque, Francesca Macchia, Astrid Manders, Mihaela Mircea, Agnes Nyiri, Miriam Olid, Carlos Pérez García-Pando, Yuliia Palamarchuk, Antonio Piersanti, Blandine Raux, Miha Razinger, Lennard Robertson, Arjo Segers, Martijn Schaap, Pilvi Siljamo, David Simpson, Mikhail Sofiev, Anders Stangel, Joanna Struzewska, Carles Tena, Renske Timmermans, Thanos Tsikerdekis, Svetlana Tsyro, Svyatoslav Tyuryakov, Anthony Ung, Andreas Uppstu, Alvaro Valdebenito, Peter van Velthoven, Lina Vitali, Zhuyun Ye, Vincent-Henri Peuch, and Laurence Rouïl
EGUsphere, https://doi.org/10.5194/egusphere-2024-3744, https://doi.org/10.5194/egusphere-2024-3744, 2024
Short summary
Short summary
The Copernicus Atmosphere Monitoring Service – Regional Production delivers daily forecasts, analyses, and reanalyses of air quality in Europe. The Service relies on a distributed modelling production by eleven leading European modelling teams following stringent requirements with an operational design which has no equivalent in the world. All the products are full, free, open and quality assured and disseminated with a high level of reliability.
Shunliu Zhao, Matthew G. Russell, Amir Hakami, Shannon L. Capps, Matthew D. Turner, Daven K. Henze, Peter B. Percell, Jaroslav Resler, Huizhong Shen, Armistead G. Russell, Athanasios Nenes, Amanda J. Pappin, Sergey L. Napelenok, Jesse O. Bash, Kathleen M. Fahey, Gregory R. Carmichael, Charles O. Stanier, and Tianfeng Chai
Geosci. Model Dev., 13, 2925–2944, https://doi.org/10.5194/gmd-13-2925-2020, https://doi.org/10.5194/gmd-13-2925-2020, 2020
Nathan J. Janechek, Rachel F. Marek, Nathan Bryngelson, Ashish Singh, Robert L. Bullard, William H. Brune, and Charles O. Stanier
Atmos. Chem. Phys., 19, 1649–1664, https://doi.org/10.5194/acp-19-1649-2019, https://doi.org/10.5194/acp-19-1649-2019, 2019
Short summary
Short summary
Cyclic volatile methyl siloxanes (cVMSs) are widely used chemicals in personal care products which can undergo oxidation to generate secondary organic aerosol. In this work, cVMS oxidation aerosols were generated using a photochemical chamber and the physical properties characterized. The aerosol yield, volatility, hygroscopicity, morphology, elemental composition, and proposed parameters for treatment as secondary organic aerosol in atmospheric models are provided.
Marta G. Vivanco, Mark R. Theobald, Héctor García-Gómez, Juan Luis Garrido, Marje Prank, Wenche Aas, Mario Adani, Ummugulsum Alyuz, Camilla Andersson, Roberto Bellasio, Bertrand Bessagnet, Roberto Bianconi, Johannes Bieser, Jørgen Brandt, Gino Briganti, Andrea Cappelletti, Gabriele Curci, Jesper H. Christensen, Augustin Colette, Florian Couvidat, Cornelis Cuvelier, Massimo D'Isidoro, Johannes Flemming, Andrea Fraser, Camilla Geels, Kaj M. Hansen, Christian Hogrefe, Ulas Im, Oriol Jorba, Nutthida Kitwiroon, Astrid Manders, Mihaela Mircea, Noelia Otero, Maria-Teresa Pay, Luca Pozzoli, Efisio Solazzo, Svetlana Tsyro, Alper Unal, Peter Wind, and Stefano Galmarini
Atmos. Chem. Phys., 18, 10199–10218, https://doi.org/10.5194/acp-18-10199-2018, https://doi.org/10.5194/acp-18-10199-2018, 2018
Short summary
Short summary
European wet and dry atmospheric deposition of N and S estimated by 14 air quality models was found to vary substantially. An ensemble of models meeting acceptability criteria was used to estimate the exceedances of the critical loads for N in habitats within the Natura 2000 network, as well as their lower and upper limits. Scenarios with 20 % emission reductions in different regions of the world showed that European emissions are responsible for most of the N and S deposition in Europe.
Ulas Im, Jesper Heile Christensen, Camilla Geels, Kaj Mantzius Hansen, Jørgen Brandt, Efisio Solazzo, Ummugulsum Alyuz, Alessandra Balzarini, Rocio Baro, Roberto Bellasio, Roberto Bianconi, Johannes Bieser, Augustin Colette, Gabriele Curci, Aidan Farrow, Johannes Flemming, Andrea Fraser, Pedro Jimenez-Guerrero, Nutthida Kitwiroon, Peng Liu, Uarporn Nopmongcol, Laura Palacios-Peña, Guido Pirovano, Luca Pozzoli, Marje Prank, Rebecca Rose, Ranjeet Sokhi, Paolo Tuccella, Alper Unal, Marta G. Vivanco, Greg Yarwood, Christian Hogrefe, and Stefano Galmarini
Atmos. Chem. Phys., 18, 8929–8952, https://doi.org/10.5194/acp-18-8929-2018, https://doi.org/10.5194/acp-18-8929-2018, 2018
Short summary
Short summary
We evaluate the impact of global and regional anthropogenic emission reductions on major air pollutant levels over Europe and North America, using a multi-model ensemble of regional chemistry and transport models. Results show that ozone levels are largely driven by long-range transport over both continents while other pollutants such as carbon monoxide or aerosols are mainly controlled by domestic sources. Use of multi-model ensembles can help to reduce the uncertainties in individual models.
Ulas Im, Jørgen Brandt, Camilla Geels, Kaj Mantzius Hansen, Jesper Heile Christensen, Mikael Skou Andersen, Efisio Solazzo, Ioannis Kioutsioukis, Ummugulsum Alyuz, Alessandra Balzarini, Rocio Baro, Roberto Bellasio, Roberto Bianconi, Johannes Bieser, Augustin Colette, Gabriele Curci, Aidan Farrow, Johannes Flemming, Andrea Fraser, Pedro Jimenez-Guerrero, Nutthida Kitwiroon, Ciao-Kai Liang, Uarporn Nopmongcol, Guido Pirovano, Luca Pozzoli, Marje Prank, Rebecca Rose, Ranjeet Sokhi, Paolo Tuccella, Alper Unal, Marta Garcia Vivanco, Jason West, Greg Yarwood, Christian Hogrefe, and Stefano Galmarini
Atmos. Chem. Phys., 18, 5967–5989, https://doi.org/10.5194/acp-18-5967-2018, https://doi.org/10.5194/acp-18-5967-2018, 2018
Short summary
Short summary
The impacts of air pollution on human health and their costs in Europe and the United States for the year 2010 ared modeled by a multi-model ensemble. In Europe, the number of premature deaths is calculated to be 414 000, while in the US it is estimated to be 160 000. Health impacts estimated by individual models can vary up to a factor of 3. Results show that the domestic emissions have the largest impact on premature deaths, compared to foreign sources.
K. M. Hansen, J. H. Christensen, C. Geels, J. D. Silver, and J. Brandt
Atmos. Chem. Phys., 15, 6549–6559, https://doi.org/10.5194/acp-15-6549-2015, https://doi.org/10.5194/acp-15-6549-2015, 2015
J. Brandt, J. D. Silver, J. H. Christensen, M. S. Andersen, J. H. Bønløkke, T. Sigsgaard, C. Geels, A. Gross, A. B. Hansen, K. M. Hansen, G. B. Hedegaard, E. Kaas, and L. M. Frohn
Atmos. Chem. Phys., 13, 7725–7746, https://doi.org/10.5194/acp-13-7725-2013, https://doi.org/10.5194/acp-13-7725-2013, 2013
J. Brandt, J. D. Silver, J. H. Christensen, M. S. Andersen, J. H. Bønløkke, T. Sigsgaard, C. Geels, A. Gross, A. B. Hansen, K. M. Hansen, G. B. Hedegaard, E. Kaas, and L. M. Frohn
Atmos. Chem. Phys., 13, 7747–7764, https://doi.org/10.5194/acp-13-7747-2013, https://doi.org/10.5194/acp-13-7747-2013, 2013
Related subject area
Subject: Gases | Research Activity: Atmospheric Modelling and Data Analysis | Altitude Range: Troposphere | Science Focus: Chemistry (chemical composition and reactions)
Sensitivity of climate effects of hydrogen to leakage size, location, and chemical background
Evaluating tropospheric nitrogen dioxide in UKCA using OMI satellite retrievals over south and east Asia
Technical note: A comparative study of chemistry schemes for volcanic sulfur dioxide in Lagrangian transport simulations – a case study of the 2019 Raikoke eruption
Revisiting the high tropospheric ozone over southern Africa: role of biomass burning and anthropogenic emissions
Monoterpene oxidation pathways initiated by acyl peroxy radical addition
Local and transboundary contributions to NOy loadings across East Asia using CMAQ-ISAM and a GEMS-informed emission inventory during the winter–spring transition
Estimating the variability in NOx emissions from Wuhan with TROPOMI NO2 data during 2018 to 2023
Enhanced understanding of atmospheric blocking modulation on ozone dynamics within a high-resolution Earth system model
Natural emissions of VOC and NOx over Africa constrained by TROPOMI HCHO and NO2 data using the MAGRITTEv1.1 model
Anthropogenic emission controls reduce summertime ozone–temperature sensitivity in the United States
Investigating the response of China's surface ozone concentration to the future changes of multiple factors
Assessing the relative impacts of satellite ozone and its precursor observations to improve global tropospheric ozone analysis using multiple chemical reanalysis systems
Evaluating present-day and future impacts of agricultural ammonia emissions on atmospheric chemistry and climate
Air-pollution-satellite-based CO2 emission inversion: system evaluation, sensitivity analysis, and future research direction
Insights into ozone pollution control in urban areas by decoupling meteorological factors based on machine learning
Quantification of regional net CO2 flux errors in the Orbiting Carbon Observatory-2 (OCO-2) v10 model intercomparison project (MIP) ensemble using airborne measurements
Reactive nitrogen in and around the northeastern and mid-Atlantic US: sources, sinks, and connections with ozone
Preindustrial-to-present-day changes in atmospheric carbon monoxide: agreement and gaps between ice archives and global model reconstructions
Investigating processes influencing simulation of local Arctic wintertime anthropogenic pollution in Fairbanks, Alaska, during ALPACA-2022
Urban ozone formation and sensitivities to volatile chemical products, cooking emissions, and NOx upwind of and within two Los Angeles Basin cities
Causes of growing middle-to-upper tropospheric ozone over the northwest Pacific region
Impact of introducing electric vehicles on ground-level O3 and PM2.5 in the Greater Tokyo Area: yearly trends and the importance of changes in the urban heat island effect
Modelling Arctic Lower Tropospheric Ozone: processes controlling seasonal variations
South Asia ammonia emission inversion through assimilating IASI observations
Constraining the budget of NOx and VOCs at a remote Tropical island using multi-platform observations and WRF-Chem model simulations
A CO2–Δ14CO2 inversion setup for estimating European fossil CO2 emissions
Maximum ozone concentrations in the southwestern US and Texas: implications of the growing predominance of the background contribution
Derivation of atmospheric reaction mechanisms for volatile organic compounds by the SAPRC mechanism generation system (MechGen)
Comparative ozone production sensitivity to NOx and VOCs in Quito, Ecuador and Santiago, Chile: implications for control strategies in times of climate action
Seasonal, regional, and vertical characteristics of high-carbon-monoxide plumes along with their associated ozone anomalies, as seen by IAGOS between 2002 and 2019
Tropospheric ozone trends and attributions over East and Southeast Asia in 1995–2019: An integrated assessment using statistical methods, machine learning models, and multiple chemical transport models
The potential of drone observations to improve air quality predictions by 4D-Var
Process analysis of elevated concentrations of organic acids at Whiteface Mountain, New York
Sensitivity of climate-chemistry model simulated atmospheric composition to lightning-produced NOx parameterizations based on lightning frequency
Ozone source attribution in polluted European areas during summer 2017 as simulated with MECO(n)
Surface ozone trend variability across the United States and the impact of heatwaves (1990–2023)
Characterization of reactive nitrogen in the global upper troposphere using recent and historical commercial and research aircraft campaigns and GEOS-Chem
Opinion: Challenges and needs of tropospheric chemical mechanism development
Decrease of the European NOx anthropogenic emissions between 2005 and 2019 as seen from the OMI and TROPOMI NO2 satellite observations
Tracking daily NOx emissions from an urban agglomeration based on TROPOMI NO2 and a local ensemble transform Kalman filter
The atmospheric oxidizing capacity in China – Part 2: Sensitivity to emissions of primary pollutants
Role of chemical production and depositional losses on formaldehyde in the Community Regional Atmospheric Chemistry Multiphase Mechanism (CRACMM)
Review of source analyses of ambient volatile organic compounds considering reactive losses: methods of reducing loss effects, impacts of losses, and sources
Interpreting summertime hourly variation of NO2 columns with implications for geostationary satellite applications
An investigation into atmospheric nitrous acid (HONO) processes in South Korea
Soil Deposition of Atmospheric Hydrogen Constrained using Planetary Scale Observations
Performance evaluation of UKESM1 for surface ozone across the pan-tropics
Constraining light dependency in modeled emissions through comparison to observed biogenic volatile organic compound (BVOC) concentrations in a southeastern US forest
A global re-analysis of regionally resolved emissions and atmospheric mole fractions of SF6 for the period 2005–2021
Tropospheric ozone precursors: global and regional distributions, trends, and variability
Ragnhild Bieltvedt Skeie, Marit Sandstad, Srinath Krishnan, Gunnar Myhre, and Maria Sand
Atmos. Chem. Phys., 25, 4929–4942, https://doi.org/10.5194/acp-25-4929-2025, https://doi.org/10.5194/acp-25-4929-2025, 2025
Short summary
Short summary
Hydrogen leakages can alter the amount of climate gases in the atmosphere and hence have a climate impact. In this study we investigate, using an atmospheric chemistry model, how this indirect climate effect differs with different amounts of leakages and with where the hydrogen leaks and if this effect changes in the future. The effect is largest for emissions far from areas where hydrogen is removed from the atmosphere by the soil, but these are not relevant locations for a future hydrogen economy.
Alok K. Pandey, David S. Stevenson, Alcide Zhao, Richard J. Pope, Ryan Hossaini, Krishan Kumar, and Martyn P. Chipperfield
Atmos. Chem. Phys., 25, 4785–4802, https://doi.org/10.5194/acp-25-4785-2025, https://doi.org/10.5194/acp-25-4785-2025, 2025
Short summary
Short summary
Nitrogen dioxide is an air pollutant largely controlled by human activity that affects ozone, methane, and aerosols. Satellite instruments can quantify column NO2 and, by carefully matching the time and location of measurements, enable evaluation of model simulations. NO2 over south and east Asia is assessed, showing that the model captures not only many features of the measurements, but also important differences that suggest model deficiencies in representing several aspects of the atmospheric chemistry of NO2.
Mingzhao Liu, Lars Hoffmann, Jens-Uwe Grooß, Zhongyin Cai, Sabine Grießbach, and Yi Heng
Atmos. Chem. Phys., 25, 4403–4418, https://doi.org/10.5194/acp-25-4403-2025, https://doi.org/10.5194/acp-25-4403-2025, 2025
Short summary
Short summary
We studied the transport and chemical decomposition of volcanic SO2, focusing on the 2019 Raikoke event. By comparing two different chemistry modeling schemes, we found that including complex chemical reactions leads to a more accurate prediction of how long SO2 stays in the atmosphere. This research helps improve our understanding of volcanic pollution and its impact on air quality and climate, providing better tools for scientists to track and predict the movement of these pollutants.
Yufen Wang, Ke Li, Xi Chen, Zhenjiang Yang, Minglong Tang, Pascoal M. D. Campos, Yang Yang, Xu Yue, and Hong Liao
Atmos. Chem. Phys., 25, 4455–4475, https://doi.org/10.5194/acp-25-4455-2025, https://doi.org/10.5194/acp-25-4455-2025, 2025
Short summary
Short summary
The impacts of biomass burning and anthropogenic emissions on high tropospheric ozone levels are not well studied in southern Africa. We combined model simulations with recent observations at the surface and from space to quantify tropospheric ozone and its drivers in southern Africa. Our work focuses on the impact of emissions from different sources at different spatial scales, contributing to a comprehensive understanding of air pollution drivers and their uncertainties in southern Africa.
Dominika Pasik, Thomas Golin Almeida, Emelda Ahongshangbam, Siddharth Iyer, and Nanna Myllys
Atmos. Chem. Phys., 25, 4313–4331, https://doi.org/10.5194/acp-25-4313-2025, https://doi.org/10.5194/acp-25-4313-2025, 2025
Short summary
Short summary
We used quantum chemistry methods to investigate the oxidation mechanisms of acyl peroxy radicals (APRs) with various monoterpenes. Our findings reveal unique oxidation pathways for different monoterpenes, leading to either chain-terminating products or highly reactive intermediates that can contribute to particle formation in the atmosphere. This research highlights APRs as potentially significant but underexplored atmospheric oxidants that may influence future approaches to modelling climate.
Jincheol Park, Yunsoo Choi, and Sagun Kayastha
Atmos. Chem. Phys., 25, 4291–4311, https://doi.org/10.5194/acp-25-4291-2025, https://doi.org/10.5194/acp-25-4291-2025, 2025
Short summary
Short summary
We investigated NOx emission contributions to NOy loadings across five regions of East Asia during the 2022 winter–spring transition through chemical transport modeling informed by satellite data. As seasons progress, local contributions within each region to its NOy budget decreased from 32 %–43 % to 23 %–30 %, while transboundary contributions increased from 16 %–33 % to 27 %–37 %, driven by a shift in synoptic settings that allowed pollutants to spread more broadly across the regions.
Qianqian Zhang, K. Folkert Boersma, Chiel van der Laan, Alba Mols, Bin Zhao, Shengyue Li, and Yuepeng Pan
Atmos. Chem. Phys., 25, 3313–3326, https://doi.org/10.5194/acp-25-3313-2025, https://doi.org/10.5194/acp-25-3313-2025, 2025
Short summary
Short summary
Accurate NOx emission estimates are required to better understand air pollution. This study investigates and demonstrates the ability of the superposition column model in combination with TROPOMI tropospheric NO2 column data to estimate city-scale NOx emissions and lifetimes and their variabilities. The results of this work nevertheless confirm the strength of the superposition column model in estimating urban NOx emissions with reasonable accuracy.
Wenbin Kou, Yang Gao, Dan Tong, Xiaojie Guo, Xiadong An, Wenyu Liu, Mengshi Cui, Xiuwen Guo, Shaoqing Zhang, Huiwang Gao, and Lixin Wu
Atmos. Chem. Phys., 25, 3029–3048, https://doi.org/10.5194/acp-25-3029-2025, https://doi.org/10.5194/acp-25-3029-2025, 2025
Short summary
Short summary
Unlike traditional numerical studies, we apply a high-resolution Earth system model, improving simulations of surface ozone and large-scale circulations such as atmospheric blocking. Besides local heat waves, we quantify the impact of atmospheric blocking on downstream ozone concentrations, which is closely associated with the blocking position. We identify three major pathways of Rossby wave propagation, stressing the critical role of large-scale circulation in regional air quality.
Beata Opacka, Trissevgeni Stavrakou, Jean-François Müller, Isabelle De Smedt, Jos van Geffen, Eloise A. Marais, Rebekah P. Horner, Dylan B. Millet, Kelly C. Wells, and Alex B. Guenther
Atmos. Chem. Phys., 25, 2863–2894, https://doi.org/10.5194/acp-25-2863-2025, https://doi.org/10.5194/acp-25-2863-2025, 2025
Short summary
Short summary
Vegetation releases biogenic volatile organic compounds, while soils and lightning contribute to the natural emissions of nitrogen oxides into the atmosphere. These gases interact in complex ways. Using satellite data and models, we developed a new method to simultaneously optimize these natural emissions over Africa in 2019. Our approach resulted in an increase in natural emissions, supported by independent data indicating that current estimates are underestimated.
Shuai Li, Haolin Wang, and Xiao Lu
Atmos. Chem. Phys., 25, 2725–2743, https://doi.org/10.5194/acp-25-2725-2025, https://doi.org/10.5194/acp-25-2725-2025, 2025
Short summary
Short summary
Summertime ozone–temperature sensitivity has decreased by 50 % from 3.0 ppbv per K in 1990 to 1.5 ppb per K in 2021 in the US. GEOS-Chem simulations show that anthropogenic nitrogen oxide emission reduction is the dominant driver of ozone–temperature sensitivity decline by influencing both temperature direct and temperature indirect processes. Reduced ozone–temperature sensitivity has decreased ozone enhancement from low to high temperatures by an average of 6.8 ppbv across the US.
Jinya Yang, Yutong Wang, Lei Zhang, and Yu Zhao
Atmos. Chem. Phys., 25, 2649–2666, https://doi.org/10.5194/acp-25-2649-2025, https://doi.org/10.5194/acp-25-2649-2025, 2025
Short summary
Short summary
We develop a modeling framework to predict future ozone concentrations (till the 2060s) in China following an IPCC scenario. We evaluate the contributions of climatic, anthropogenic, and biogenic factors by season and region. We find persistent emission controls will alter the nonlinear response of ozone to its precursors and dominate the declining ozone level. The outcomes highlight the importance of human actions, even with a climate penalty on air quality.
Takashi Sekiya, Emanuele Emili, Kazuyuki Miyazaki, Antje Inness, Zhen Qu, R. Bradley Pierce, Dylan Jones, Helen Worden, William Y. Y. Cheng, Vincent Huijnen, and Gerbrand Koren
Atmos. Chem. Phys., 25, 2243–2268, https://doi.org/10.5194/acp-25-2243-2025, https://doi.org/10.5194/acp-25-2243-2025, 2025
Short summary
Short summary
Five global chemical reanalysis datasets were used to assess the relative impacts of assimilating satellite ozone and its precursor measurements on tropospheric ozone analyses for 2010. The multiple reanalysis system comparison allows an evaluation of the dependency of the impacts on different reanalysis systems. The results suggested the importance of satellite ozone and its precursor measurements for improving ozone analysis in the whole troposphere, with varying magnitudes among the systems.
Maureen Beaudor, Didier Hauglustaine, Juliette Lathière, Martin Van Damme, Lieven Clarisse, and Nicolas Vuichard
Atmos. Chem. Phys., 25, 2017–2046, https://doi.org/10.5194/acp-25-2017-2025, https://doi.org/10.5194/acp-25-2017-2025, 2025
Short summary
Short summary
Agriculture is the biggest ammonia (NH3) source, impacting air quality, climate, and ecosystems. Because of food demand, NH3 emissions are projected to rise by 2100. Using a global model, we analyzed the impact of present and future NH3 emissions generated from a land model. Our results show improved ammonia patterns compared to a reference inventory. Future scenarios predict up to 70 % increase in global NH3 burden, with significant changes in radiative forcing that can greatly elevate N2O.
Hui Li, Jiaxin Qiu, and Bo Zheng
Atmos. Chem. Phys., 25, 1949–1963, https://doi.org/10.5194/acp-25-1949-2025, https://doi.org/10.5194/acp-25-1949-2025, 2025
Short summary
Short summary
We conduct a sensitivity analysis with 31 tests on various factors including prior emissions, model resolution, satellite constraint, and other system configurations to assess the vulnerability of emission estimates across temporal, sectoral, and regional dimensions. This reveals the robustness of emissions estimated by this air-pollution-satellite-based CO2 emission inversion system, with relative change between tests and base inversion below 4.0 % for national annual NOx and CO2 emissions.
Yuqing Qiu, Xin Li, Wenxuan Chai, Yi Liu, Mengdi Song, Xudong Tian, Qiaoli Zou, Wenjun Lou, Wangyao Zhang, Juan Li, and Yuanhang Zhang
Atmos. Chem. Phys., 25, 1749–1763, https://doi.org/10.5194/acp-25-1749-2025, https://doi.org/10.5194/acp-25-1749-2025, 2025
Short summary
Short summary
The chemical reactions of ozone (O3) formation are related to meteorology and local emissions. Here, a random forest approach was used to eliminate the effects of meteorological factors (dispersion or transport) on O3 and its precursors. Variations in the sensitivity of O3 formation and the apportionment of emission sources were revealed after meteorological normalization. Our results suggest that meteorological variations should be considered when diagnosing O3 formation.
Jeongmin Yun, Junjie Liu, Brendan Byrne, Brad Weir, Lesley E. Ott, Kathryn McKain, Bianca C. Baier, Luciana V. Gatti, and Sebastien C. Biraud
Atmos. Chem. Phys., 25, 1725–1748, https://doi.org/10.5194/acp-25-1725-2025, https://doi.org/10.5194/acp-25-1725-2025, 2025
Short summary
Short summary
This study quantifies errors in regional net surface–atmosphere CO2 flux estimates from an inverse model ensemble using airborne CO2 measurements. Our results show that flux error estimates based on observations significantly exceed those computed from the ensemble spread of flux estimates in regions with high fossil fuel emissions. This finding suggests the presence of systematic biases in the inversion estimates, associated with errors in the fossil fuel emissions common to all models.
Min Huang, Gregory R. Carmichael, Kevin W. Bowman, Isabelle De Smedt, Andreas Colliander, Michael H. Cosh, Sujay V. Kumar, Alex B. Guenther, Scott J. Janz, Ryan M. Stauffer, Anne M. Thompson, Niko M. Fedkin, Robert J. Swap, John D. Bolten, and Alicia T. Joseph
Atmos. Chem. Phys., 25, 1449–1476, https://doi.org/10.5194/acp-25-1449-2025, https://doi.org/10.5194/acp-25-1449-2025, 2025
Short summary
Short summary
We use model simulations along with multiplatform, multidisciplinary observations and a range of analysis methods to estimate and understand the distributions, temporal changes, and impacts of reactive nitrogen and ozone over the most populous US region that has undergone significant environmental changes. Deposition, biogenic emissions, and extra-regional sources have been playing increasingly important roles in controlling pollutant budgets in this area as local anthropogenic emissions drop.
Xavier Faïn, Sophie Szopa, Vaishali Naïk, Patricia Martinerie, David M. Etheridge, Rachael H. Rhodes, Cathy M. Trudinger, Vasilii V. Petrenko, Kévin Fourteau, and Philip Place
Atmos. Chem. Phys., 25, 1105–1119, https://doi.org/10.5194/acp-25-1105-2025, https://doi.org/10.5194/acp-25-1105-2025, 2025
Short summary
Short summary
Carbon monoxide (CO) plays a crucial role in the atmosphere's oxidizing capacity. In this study, we analyse how historical (1850–2014) [CO] outputs from state-of-the-art global chemistry–climate models over Greenland and Antarctica are able to capture both absolute values and trends recorded in multi-site ice archives. A disparity in [CO] growth rates emerges in the Northern Hemisphere between models and observations from 1920–1975 CE, possibly linked to uncertainties in CO emission factors.
Natalie Brett, Kathy S. Law, Steve R. Arnold, Javier G. Fochesatto, Jean-Christophe Raut, Tatsuo Onishi, Robert Gilliam, Kathleen Fahey, Deanna Huff, George Pouliot, Brice Barret, Elsa Dieudonné, Roman Pohorsky, Julia Schmale, Andrea Baccarini, Slimane Bekki, Gianluca Pappaccogli, Federico Scoto, Stefano Decesari, Antonio Donateo, Meeta Cesler-Maloney, William Simpson, Patrice Medina, Barbara D'Anna, Brice Temime-Roussel, Joel Savarino, Sarah Albertin, Jingqiu Mao, Becky Alexander, Allison Moon, Peter F. DeCarlo, Vanessa Selimovic, Robert Yokelson, and Ellis S. Robinson
Atmos. Chem. Phys., 25, 1063–1104, https://doi.org/10.5194/acp-25-1063-2025, https://doi.org/10.5194/acp-25-1063-2025, 2025
Short summary
Short summary
Processes influencing dispersion of local anthropogenic pollution in Arctic wintertime are investigated with Lagrangian dispersion modelling. Simulated power plant plume rise that considers temperature inversion layers improves results compared to observations (interior Alaska). Modelled surface concentrations are improved by representation of vertical mixing and emission estimates. Large increases in diesel vehicle emissions at temperatures reaching −35°C are required to reproduce observed NOx.
Chelsea E. Stockwell, Matthew M. Coggon, Rebecca H. Schwantes, Colin Harkins, Bert Verreyken, Congmeng Lyu, Qindan Zhu, Lu Xu, Jessica B. Gilman, Aaron Lamplugh, Jeff Peischl, Michael A. Robinson, Patrick R. Veres, Meng Li, Andrew W. Rollins, Kristen Zuraski, Sunil Baidar, Shang Liu, Toshihiro Kuwayama, Steven S. Brown, Brian C. McDonald, and Carsten Warneke
Atmos. Chem. Phys., 25, 1121–1143, https://doi.org/10.5194/acp-25-1121-2025, https://doi.org/10.5194/acp-25-1121-2025, 2025
Short summary
Short summary
In urban areas, emissions from everyday products like paints, cleaners, and personal care products, along with non-traditional sources such as cooking, are increasingly important and impact air quality. This study uses a box model to evaluate how these emissions impact ozone in the Los Angeles Basin and quantifies the impact of gaseous cooking emissions. Accurate representation of these and other anthropogenic sources in inventories is crucial for informing effective air quality policies.
Xiaodan Ma, Jianping Huang, Michaela I. Hegglin, Patrick Jöckel, and Tianliang Zhao
Atmos. Chem. Phys., 25, 943–958, https://doi.org/10.5194/acp-25-943-2025, https://doi.org/10.5194/acp-25-943-2025, 2025
Short summary
Short summary
Our research explored changes in ozone levels in the northwest Pacific region over 30 years, revealing a significant increase in the middle-to-upper troposphere, especially during spring and summer. This rise is influenced by both stratospheric and tropospheric sources, which affect climate and air quality in East Asia. This work underscores the need for continued study to understand underlying mechanisms.
Hiroo Hata, Norifumi Mizushima, and Tomohiko Ihara
Atmos. Chem. Phys., 25, 1037–1061, https://doi.org/10.5194/acp-25-1037-2025, https://doi.org/10.5194/acp-25-1037-2025, 2025
Short summary
Short summary
The introduction of battery electric vehicles (BEVs) is expected to reduce the primary air pollutants from vehicular exhaust and evaporative emissions while reducing the anthropogenic heat produced by vehicles, ultimately mitigating the urban heat island (UHI) effect. This study revealed the impact of introducing BEVs on the decrease in the UHI effect and the impact of BEVs on the formation of tropospheric ozone and fine particulate matter in the Greater Tokyo Area of Japan.
Wanmin Gong, Stephen R. Beagley, Kenjiro Toyota, Henrik Skov, Jesper Heile Christensen, Alexandru Lupu, Diane Pendlebury, Junhua Zhang, Ulas Im, Yugo Kanaya, Alfonso Saiz-Lopez, Roberto Sommariva, Peter Effertz, John W. Halfacre, Nis Jepsen, Rigel Kivi, Theodore K. Koenig, Katrin Müller, Claus Nordstrøm, Irina Petropavlovskikh, Paul B. Shepson, William R. Simpson, Sverre Solberg, Ralf M. Staebler, David W. Tarasick, Roeland Van Malderen, and Mika Vestenius
EGUsphere, https://doi.org/10.5194/egusphere-2024-3750, https://doi.org/10.5194/egusphere-2024-3750, 2025
Short summary
Short summary
This study showed that the springtime O3 depletion plays a critical role in driving the surface O3 seasonal cycle in Central Arctic. The O3 depletion events, while occurring most notably within the lowest few hundred metres above the Arctic Ocean, can induce a 5–7 % of loss in the pan-Arctic tropospheric O3 burden during springtime. The study also found an enhancement in O3 and NOy (mostly PAN) concentrations in the Arctic due to northern boreal wildfires, particularly at altitudes.
Ji Xia, Yi Zhou, Li Fang, Yingfei Qi, Dehao Li, Hong Liao, and Jianbing Jin
EGUsphere, https://doi.org/10.5194/egusphere-2024-3938, https://doi.org/10.5194/egusphere-2024-3938, 2025
Short summary
Short summary
This study established an ammonia emission inventory in South Asia via assimilation-based inversion system. The posterior emissions, calculated by integrating the CEDS inventory and IASI satellite observations, showed significant improvement over the prior. Validation against various measurements all support our posterior emission. It offers valuable insights of ammonia emissions for policymakers and researchers aiming to develop air quality management and mitigation strategies there.
Catalina Poraicu, Jean-François Müller, Trissevgeni Stavrakou, Crist Amelynck, Bert W. D. Verreyken, Niels Schoon, Corinne Vigouroux, Nicolas Kumps, Jérôme Brioude, Pierre Tulet, and Camille Mouchel-Vallon
EGUsphere, https://doi.org/10.5194/egusphere-2024-3555, https://doi.org/10.5194/egusphere-2024-3555, 2025
Short summary
Short summary
We investigated the sources and impacts of nitrogen oxides and organic compounds over a remote tropical island. High-resolution WRF-Chem simulations were evaluated using in situ, FTIR and satellite measurements. This work highlights gaps in current models, like missing sources of key organic compounds and inaccuracies in emission inventories, emphasizing the importance of improving chemical and dynamical processes in atmospheric modelling for budget estimates in tropical regions.
Carlos Gómez-Ortiz, Guillaume Monteil, Sourish Basu, and Marko Scholze
Atmos. Chem. Phys., 25, 397–424, https://doi.org/10.5194/acp-25-397-2025, https://doi.org/10.5194/acp-25-397-2025, 2025
Short summary
Short summary
In this paper, we test new implementations of our inverse modeling tool to estimate the weekly and regional CO2 emissions from fossil fuels in Europe. We use synthetic atmospheric observations of CO2 and radiocarbon (14CO2) to trace emissions to their sources, while separating the natural and fossil CO2. Our tool accurately estimates fossil CO2 emissions in densely monitored regions like western/central Europe. This approach aids in developing strategies for reducing CO2 emissions.
David D. Parrish, Ian C. Faloona, and Richard G. Derwent
Atmos. Chem. Phys., 25, 263–289, https://doi.org/10.5194/acp-25-263-2025, https://doi.org/10.5194/acp-25-263-2025, 2025
Short summary
Short summary
Observation-based estimates of contributions to maximum ozone (O3) concentrations show that background O3 can exceed the air quality standard of 70 ppb in the southwestern US, precluding standard attainment. Over the past 4 decades, US anthropogenic O3 has decreased by a factor of ~ 6.3, while wildfire contributions have increased, so that the background now dominates maximum concentrations, even in Los Angeles, and the occurrence of maximum O3 has shifted from the eastern to the western US.
William P. L. Carter, Jia Jiang, John J. Orlando, and Kelley C. Barsanti
Atmos. Chem. Phys., 25, 199–242, https://doi.org/10.5194/acp-25-199-2025, https://doi.org/10.5194/acp-25-199-2025, 2025
Short summary
Short summary
This paper describes the scientific basis for gas-phase atmospheric chemical mechanisms derived using the SAPRC mechanism generation system, MechGen. It can derive mechanisms for most organic compounds with C, H, O, or N atoms, including initial reactions of organics with OH, O3, NO3, and O3P or by photolysis, as well as the reactions of the various types of intermediates that are formed. The paper includes a description of areas of uncertainty where additional research and updates are needed.
María Cazorla, Melissa Trujillo, Rodrigo Seguel, and Laura Gallardo
EGUsphere, https://doi.org/10.5194/egusphere-2024-3720, https://doi.org/10.5194/egusphere-2024-3720, 2024
Short summary
Short summary
The current climate emergency imposes the need to take actions in cities to curb ozone as a pollutant and a climate forcer. In this work we analyze how reducing the levels of ozone precursor would affect photochemical smog in Quito, Ecuador and Santiago, Chile. Results show that if environmental policy were implemented to reduce only nitrogen oxides, the production of ozone would increase substantially for which more integral solutions are needed.
Thibaut Lebourgeois, Bastien Sauvage, Pawel Wolff, Béatrice Josse, Virginie Marécal, Yasmine Bennouna, Romain Blot, Damien Boulanger, Hannah Clark, Jean-Marc Cousin, Philippe Nedelec, and Valérie Thouret
Atmos. Chem. Phys., 24, 13975–14004, https://doi.org/10.5194/acp-24-13975-2024, https://doi.org/10.5194/acp-24-13975-2024, 2024
Short summary
Short summary
Our study examines intense-carbon-monoxide (CO) pollution events measured by commercial aircraft from the In-service Aircraft for a Global Observing System (IAGOS) research infrastructure. We combine these measurements with the SOFT-IO model to trace the origin of the observed CO. A comprehensive analysis of the geographical origin, source type, seasonal variation, and ozone levels of these pollution events is provided.
Xiao Lu, Yiming Liu, Jiayin Su, Xiang Weng, Tabish Ansari, Yuqiang Zhang, Guowen He, Yuqi Zhu, Haolin Wang, Ganquan Zeng, Jingyu Li, Cheng He, Shuai Li, Teerachai Amnuaylojaroen, Tim Butler, Qi Fan, Shaojia Fan, Grant L. Forster, Meng Gao, Jianlin Hu, Yugo Kanaya, Mohd Talib Latif, Keding Lu, Philippe Nédélec, Peer Nowack, Bastien Sauvage, Xiaobin Xu, Lin Zhang, Ke Li, Ja-Ho Koo, and Tatsuya Nagashima
EGUsphere, https://doi.org/10.5194/egusphere-2024-3702, https://doi.org/10.5194/egusphere-2024-3702, 2024
Short summary
Short summary
This study analyzes summertime ozone trends in East and Southeast Asia derived from a comprehensive observational database spanning from 1995 to 2019, incorporating aircraft observations, ozonesonde data, and measurements from 2500 surface sites. Multiple models are applied to attribute to changes in anthropogenic emissions and climate. The results highlight increases in anthropogenic emission are the primary driver of ozone increases both in the free troposphere and at the surface.
Hassnae Erraji, Philipp Franke, Astrid Lampert, Tobias Schuldt, Ralf Tillmann, Andreas Wahner, and Anne Caroline Lange
Atmos. Chem. Phys., 24, 13913–13934, https://doi.org/10.5194/acp-24-13913-2024, https://doi.org/10.5194/acp-24-13913-2024, 2024
Short summary
Short summary
Four-dimensional variational data assimilation allows for the simultaneous optimisation of initial values and emission rates by using trace-gas profiles from drone observations in a regional air quality model. Assimilated profiles positively impact the representation of air pollutants in the model by improving their vertical distribution and ground-level concentrations. This case study highlights the potential of drone data to enhance air quality analyses including local emission evaluation.
Christopher Lawrence, Mary Barth, John Orlando, Paul Casson, Richard Brandt, Daniel Kelting, Elizabeth Yerger, and Sara Lance
Atmos. Chem. Phys., 24, 13693–13713, https://doi.org/10.5194/acp-24-13693-2024, https://doi.org/10.5194/acp-24-13693-2024, 2024
Short summary
Short summary
This work uses chemical transport and box modeling to study the gas- and aqueous-phase production of organic acid concentrations measured in cloud water at the summit of Whiteface Mountain on 1 July 2018. Isoprene was the major source of formic, acetic, and oxalic acid. Gas-phase chemistry greatly underestimated formic and acetic acid, indicating missing sources, while cloud chemistry was a key source of oxalic acid. More studies of organic acids are required to better constrain their sources.
Francisco J. Pérez-Invernón, Francisco J. Gordillo-Vázquez, Heidi Huntrieser, Patrick Jöckel, and Eric J. Bucsela
EGUsphere, https://doi.org/10.5194/egusphere-2024-3348, https://doi.org/10.5194/egusphere-2024-3348, 2024
Short summary
Short summary
Lightning plays a significant role in tropospheric chemistry by producing substantial amounts of nitrogen oxides. According to recent estimates, thunderstorms that produce a higher lightning frequency rate also produce less nitrogen oxide per flash. We implemented the dependency of nitrogen oxide production per flash on lightning flash frequency in a chemical atmospheric model.
Markus Kilian, Volker Grewe, Patrick Jöckel, Astrid Kerkweg, Mariano Mertens, Andreas Zahn, and Helmut Ziereis
Atmos. Chem. Phys., 24, 13503–13523, https://doi.org/10.5194/acp-24-13503-2024, https://doi.org/10.5194/acp-24-13503-2024, 2024
Short summary
Short summary
Anthropogenic emissions are a major source of precursors of tropospheric ozone. As ozone formation is highly non-linear, we apply a global–regional chemistry–climate model with a source attribution method (tagging) to quantify the contribution of anthropogenic emissions to ozone. Our analysis shows that the contribution of European anthropogenic emissions largely increases during large ozone periods, indicating that emissions from these sectors drive ozone values.
Kai-Lan Chang, Brian C. McDonald, and Owen R. Cooper
EGUsphere, https://doi.org/10.5194/egusphere-2024-3674, https://doi.org/10.5194/egusphere-2024-3674, 2024
Short summary
Short summary
Exposure to high levels of ozone can be harmful to human health. This study shows consistent and robust evidence of decreasing ozone extremes across much of the United States over 1990–2023, previously attributed to ozone precursor emission controls. Nevertheless, we also show that the increasing heatwave frequencies are likely to contribute to additional ozone exceedances, slowing the progress of decreasing the frequency of ozone exceedances.
Nana Wei, Eloise A. Marais, Gongda Lu, Robert G. Ryan, and Bastien Sauvage
EGUsphere, https://doi.org/10.5194/egusphere-2024-3388, https://doi.org/10.5194/egusphere-2024-3388, 2024
Short summary
Short summary
This study uses reactive nitrogen observations from NASA DC-8 research aircraft and The In-service Aircraft for a Global Observing System (IAGOS) campaigns to characterise reactive nitrogen seasonality and composition in the global upper troposphere and to diagnose the greatest knowledge gaps from comparison to a state-of-science model GEOS-Chem that need to be resolved for climate, nitrogen cycle and air pollution assessments.
Barbara Ervens, Andrew Rickard, Bernard Aumont, William P. L. Carter, Max McGillen, Abdelwahid Mellouki, John Orlando, Bénédicte Picquet-Varrault, Paul Seakins, William R. Stockwell, Luc Vereecken, and Timothy J. Wallington
Atmos. Chem. Phys., 24, 13317–13339, https://doi.org/10.5194/acp-24-13317-2024, https://doi.org/10.5194/acp-24-13317-2024, 2024
Short summary
Short summary
Chemical mechanisms describe the chemical processes in atmospheric models that are used to describe the changes in the atmospheric composition. Therefore, accurate chemical mechanisms are necessary to predict the evolution of air pollution and climate change. The article describes all steps that are needed to build chemical mechanisms and discusses the advances and needs of experimental and theoretical research activities needed to build reliable chemical mechanisms.
Audrey Fortems-Cheiney, Grégoire Broquet, Robin Plauchu, Elise Potier, Antoine Berchet, Isabelle Pison, Adrien Martinez, Rimal Abeed, Gaelle Dufour, Adriana Coman, Dilek Savas, Guillaume Siour, Henk Eskes, Hugo A. C. Denier van der Gon, and Stijn N. C. Dellaert
EGUsphere, https://doi.org/10.5194/egusphere-2024-3679, https://doi.org/10.5194/egusphere-2024-3679, 2024
Short summary
Short summary
This study assesses the potential of the OMI and TROPOMI satellite observations to inform about the evolution of NOx anthropogenic emissions between year 2005 and year 2019 at the regional to national scales in Europe. Both the OMI and TROPOMI inversions show decreases in European NOx anthropogenic emission budgets between 2005 and 2019, but with different magnitudes.
Yawen Kong, Bo Zheng, and Yuxi Liu
EGUsphere, https://doi.org/10.5194/egusphere-2024-2996, https://doi.org/10.5194/egusphere-2024-2996, 2024
Short summary
Short summary
Current high-resolution satellite remote sensing technologies provide a unique opportunity to derive timely, high-resolution emission data. We developed an emission inversion system to assimilate satellite NO2 data to obtain daily, kilometer-scale NOx emission inventories. Our results enhance inventory accuracy, allowing us to capture the effects of pollution control policies on daily emissions (e.g., during COVID-19 lockdown) and improve fine-scale air quality modeling.
Jianing Dai, Guy P. Brasseur, Mihalis Vrekoussis, Maria Kanakidou, Kun Qu, Yijuan Zhang, Hongliang Zhang, and Tao Wang
Atmos. Chem. Phys., 24, 12943–12962, https://doi.org/10.5194/acp-24-12943-2024, https://doi.org/10.5194/acp-24-12943-2024, 2024
Short summary
Short summary
This paper employs a regional chemical transport model to quantify the sensitivity of air pollutants and photochemical parameters to specified emission reductions in China for representative winter and summer conditions. The study provides insights into further air quality control in China with reduced primary emissions.
T. Nash Skipper, Emma L. D'Ambro, Forwood C. Wiser, V. Faye McNeill, Rebecca H. Schwantes, Barron H. Henderson, Ivan R. Piletic, Colleen B. Baublitz, Jesse O. Bash, Andrew R. Whitehill, Lukas C. Valin, Asher P. Mouat, Jennifer Kaiser, Glenn M. Wolfe, Jason M. St. Clair, Thomas F. Hanisco, Alan Fried, Bryan K. Place, and Havala O.T. Pye
Atmos. Chem. Phys., 24, 12903–12924, https://doi.org/10.5194/acp-24-12903-2024, https://doi.org/10.5194/acp-24-12903-2024, 2024
Short summary
Short summary
We develop the Community Regional Atmospheric Chemistry Multiphase Mechanism (CRACMM) version 2 to improve predictions of formaldehyde in ambient air compared to satellite-, aircraft-, and ground-based observations. With the updated chemistry, we estimate the cancer risk from inhalation exposure to ambient formaldehyde across the contiguous USA and predict that 40 % of this risk is controllable through reductions in anthropogenic emissions of nitrogen oxides and reactive organic carbon.
Baoshuang Liu, Yao Gu, Yutong Wu, Qili Dai, Shaojie Song, Yinchang Feng, and Philip K. Hopke
Atmos. Chem. Phys., 24, 12861–12879, https://doi.org/10.5194/acp-24-12861-2024, https://doi.org/10.5194/acp-24-12861-2024, 2024
Short summary
Short summary
Reactive loss of volatile organic compounds (VOCs) is a long-term issue yet to be resolved in VOC source analyses. We assess common methods of, and existing issues in, reducing losses, impacts of losses, and sources in current source analyses. We offer a potential supporting role for solving issues of VOC conversion. Source analyses of consumed VOCs that reacted to produce ozone and secondary organic aerosols can play an important role in the effective control of secondary pollution in air.
Deepangsu Chatterjee, Randall V. Martin, Chi Li, Dandan Zhang, Haihui Zhu, Daven K. Henze, James H. Crawford, Ronald C. Cohen, Lok N. Lamsal, and Alexander M. Cede
Atmos. Chem. Phys., 24, 12687–12706, https://doi.org/10.5194/acp-24-12687-2024, https://doi.org/10.5194/acp-24-12687-2024, 2024
Short summary
Short summary
We investigate the hourly variation of NO2 columns and surface concentrations by applying the GEOS-Chem model to interpret aircraft and ground-based measurements over the US and Pandora sun photometer measurements over the US, Europe, and Asia. Corrections to the Pandora columns and finer model resolution improve the modeled representation of the summertime hourly variation of total NO2 columns to explain the weaker hourly variation in NO2 columns than at the surface.
Kiyeon Kim, Kyung Man Han, Chul Han Song, Hyojun Lee, Ross Beardsley, Jinhyeok Yu, Greg Yarwood, Bonyoung Koo, Jasper Madalipay, Jung-Hun Woo, and Seogju Cho
Atmos. Chem. Phys., 24, 12575–12593, https://doi.org/10.5194/acp-24-12575-2024, https://doi.org/10.5194/acp-24-12575-2024, 2024
Short summary
Short summary
We incorporated each HONO process into the current CMAQ modeling framework to enhance the accuracy of HONO mixing ratio predictions. These results expand our understanding of HONO photochemistry and identify crucial sources of HONO that impact the total HONO budget in Seoul, South Korea. Through this investigation, we contribute to resolving discrepancies in understanding chemical transport models, with implications for better air quality management and environmental protection in the region.
Alexander Karim Tardito Chaudhri and David S. Stevenson
EGUsphere, https://doi.org/10.5194/egusphere-2024-3247, https://doi.org/10.5194/egusphere-2024-3247, 2024
Short summary
Short summary
There remains a large uncertainty in the global warming potential of atmospheric hydrogen due to poor constraints on its soil deposition, and therefore its lifetime. A new analysis of the latitudinal variation in the observed seasonality of hydrogen is used to constrain its surface fluxes. This is complemented with a simple latitude-height model where surface fluxes are adjusted from a prototype deposition scheme.
Flossie Brown, Gerd Folberth, Stephen Sitch, Paulo Artaxo, Marijn Bauters, Pascal Boeckx, Alexander W. Cheesman, Matteo Detto, Ninong Komala, Luciana Rizzo, Nestor Rojas, Ines dos Santos Vieira, Steven Turnock, Hans Verbeeck, and Alfonso Zambrano
Atmos. Chem. Phys., 24, 12537–12555, https://doi.org/10.5194/acp-24-12537-2024, https://doi.org/10.5194/acp-24-12537-2024, 2024
Short summary
Short summary
Ozone is a pollutant that is detrimental to human and plant health. Ozone monitoring sites in the tropics are limited, so models are often used to understand ozone exposure. We use measurements from the tropics to evaluate ozone from the UK Earth system model, UKESM1. UKESM1 is able to capture the pattern of ozone in the tropics, except in southeast Asia, although it systematically overestimates it at all sites. This work highlights that UKESM1 can capture seasonal and hourly variability.
Namrata Shanmukh Panji, Deborah F. McGlynn, Laura E. R. Barry, Todd M. Scanlon, Manuel T. Lerdau, Sally E. Pusede, and Gabriel Isaacman-VanWertz
Atmos. Chem. Phys., 24, 12495–12507, https://doi.org/10.5194/acp-24-12495-2024, https://doi.org/10.5194/acp-24-12495-2024, 2024
Short summary
Short summary
Climate change will bring about changes in parameters that are currently used in global-scale models to calculate biogenic emissions. This study seeks to understand the factors driving these models by comparing long-term datasets of biogenic compounds to modeled emissions. We note that the light-dependent fractions currently used in models do not accurately represent regional observations. We provide evidence for the time-dependent variation in this parameter for future modifications to models.
Martin Vojta, Andreas Plach, Saurabh Annadate, Sunyoung Park, Gawon Lee, Pallav Purohit, Florian Lindl, Xin Lan, Jens Mühle, Rona L. Thompson, and Andreas Stohl
Atmos. Chem. Phys., 24, 12465–12493, https://doi.org/10.5194/acp-24-12465-2024, https://doi.org/10.5194/acp-24-12465-2024, 2024
Short summary
Short summary
We constrain the global emissions of the very potent greenhouse gas sulfur hexafluoride (SF6) between 2005 and 2021. We show that SF6 emissions are decreasing in the USA and in the EU, while they are substantially growing in China, leading overall to an increasing global emission trend. The national reports for the USA, EU, and China all underestimated their SF6 emissions. However, stringent mitigation measures can successfully reduce SF6 emissions, as can be seen in the EU emission trend.
Yasin Elshorbany, Jerald R. Ziemke, Sarah Strode, Hervé Petetin, Kazuyuki Miyazaki, Isabelle De Smedt, Kenneth Pickering, Rodrigo J. Seguel, Helen Worden, Tamara Emmerichs, Domenico Taraborrelli, Maria Cazorla, Suvarna Fadnavis, Rebecca R. Buchholz, Benjamin Gaubert, Néstor Y. Rojas, Thiago Nogueira, Thérèse Salameh, and Min Huang
Atmos. Chem. Phys., 24, 12225–12257, https://doi.org/10.5194/acp-24-12225-2024, https://doi.org/10.5194/acp-24-12225-2024, 2024
Short summary
Short summary
We investigated tropospheric ozone spatial variability and trends from 2005 to 2019 and related those to ozone precursors on global and regional scales. We also investigate the spatiotemporal characteristics of the ozone formation regime in relation to ozone chemical sources and sinks. Our analysis is based on remote sensing products of the tropospheric column of ozone and its precursors, nitrogen dioxide, formaldehyde, and total column CO, as well as ozonesonde data and model simulations.
Cited articles
Ahrens, L., Harner, T., and Shoeib, M.: Temporal variations of cyclic and linear volatile methylsiloxanes in the atmosphere using passive samplers and high-volume air samplers, Environ. Sci. Technol., 48, 9374–9381, https://doi.org/10.1021/es502081j, 2014.
Atkinson, R.: Kinetics of the Gas-Phase Reactions of a Series of Organosilicon Compounds with OH and NO3 Radicals and O3 at 297 +/−2 K, Environ. Sci. Technol., 25, 863–866, https://doi.org/10.1021/es00017a005, 1991.
Brooke, D., Crookes, M., Gray, D., and Robertson, S.: Environmental Risk Assessment Report: Dodecamethylcyclohexasiloxane, Environment Agency of England and Wales, Bristol, UK, 2009a.
Brooke, D., Crookes, M., Gray, D., and Robertson, S.: Environmental Risk Assessment Report: Decamethylcyclopentasiloxane, Environment Agency of England and Wales, Bristol, UK, 2009b.
Brooke, D., Crookes, M., Gray, D., and Robertson, S.: Environmental Risk Assessment Report: Octamethylcyclotetrasiloxane, Environment Agency of England and Wales, Bristol, UK, 2009c.
Buser, A. M., Kierkegaard, A., Bogdal, C., MacLeod, M., Scheringer, M., and Hungerbuhler, K.: Concentrations in Ambient Air and Emissions of Cyclic Volatile Methylsiloxanes in Zurich, Switzerland, Environ. Sci. Technol., 47, 7045–7051, https://doi.org/10.1021/es3046586, 2013a.
Buser, A. M., Schenker, S., Scheringer, M., and Hungerbühler, K.: Comparing the Performance of Computational Estimation Methods for Physicochemical Properties of Dimethylsiloxanes and Selected Siloxanols, J. Chem. Eng. Data, 58, 3170–3178, https://doi.org/10.1021/je400633h, 2013b.
Buser, A. M., Bogdal, C., MacLeod, M., and Scheringer, M.: Emissions of decamethylcyclopentasiloxane from Chicago, Chemosphere, 107, 473–475, https://doi.org/10.1016/j.chemosphere.2013.12.034, 2014.
Byun, D. and Schere, K. L.: Review of the governing equations, computational algorithms, and other components of the models-3 Community Multiscale Air Quality (CMAQ) modeling system, Appl. Mech. Rev., 59, 51–77, https://doi.org/10.1115/1.2128636, 2006.
Byun, D. W., Pleim, J. E., Tang, R. T., and Bourgeois, A.: Chapter 12: Meteorology-Chemistry Interface Processor (MCIP) for Models-3 Community Multiscale Air Quality (CMAQ) Modeling System, in: Science Algorithms of the EPA Models-3 Community Multiscale Air Quality (CMAQ) Modeling System, United States Environmental Protection Agency, Washington, DC, 1999.
Bzdek, B. R., Horan, A. J., Pennington, M. R., Janechek, N. J., Baek, J., Stanier, C. O., and Johnston, M. V.: Silicon is a Frequent Component of Atmospheric Nanoparticles, Environ. Sci. Technol., 48, 11137–11145, https://doi.org/10.1021/es5026933, 2014.
Capela, D., Alves, A., Homem, V., and Santos, L.: From the shop to the drain – Volatile methylsiloxanes in cosmetics and personal care products, Environ. Int., 92–93, 50–62, https://doi.org/10.1016/j.envint.2016.03.016, 2016.
Chandramouli, B. and Kamens, R. M.: The photochemical formation and gas-particle partitioning of oxidation products of decamethyl cyclopentasiloxane and decamethyl tetrasiloxane in the atmosphere, Atmos. Environ., 35, 87–95, https://doi.org/10.1016/s1352-2310(00)00289-2, 2001.
Cheng, Y., Shoeib, M., Ahrens, L., Harner, T., and Ma, J.: Wastewater treatment plants and landfills emit volatile methyl siloxanes (VMSs) to the atmosphere: Investigations using a new passive air sampler, Environ. Pollut., 159, 2380–2386, https://doi.org/10.1016/j.envpol.2011.07.002, 2011.
Companioni-Damas, E. Y., Santos, F. J., and Galceran, M. T.: Linear and cyclic methylsiloxanes in air by concurrent solvent recondensation-large volume injection-gas chromatography-mass spectrometry, Talanta, 118, 245–252, https://doi.org/10.1016/j.talanta.2013.10.020, 2014.
Dudzina, T., von Goetz, N., Bogdal, C., Biesterbos, J. W. H., and Hungerbuhler, K.: Concentrations of cyclic volatile methylsiloxanes in European cosmetics and personal care products: Prerequisite for human and environmental exposure assessment, Environ. Int., 62, 86–94, https://doi.org/10.1016/j.envint.2013.10.002, 2014.
ECHA: Annex XV Restriction Report Proposal for a Restriction (D4 and D5), Health & Safety Executive, Bootle, UK, 2015.
Environment Canada and Health Canada: Screening Assessment for the Challenge Octamethylcyclotetrasiloxane (D4), 2008a.
Environment Canada and Health Canada: Screening Assessment for the Challenge Decamethylcyclopentasiloxane (D5), 2008b.
Environment Canada and Health Canada: Screening Assessment for the Challenge Dodecamethylcyclohexasiloxane (D6), 2008c.
EPA: Estimation Programs Interface Suite for Microsoft Windows, v 4.11, United States Environmental Protection Agency, Washington, DC, USA, 2012.
Fairbrother, A., Burton, G. A., Klaine, S. J., Powell, D. E., Staples, C. A., Mihaich, E. M., Woodburn, K. B., and Gobas, F. A. P. C.: Characterization of ecological risks from environmental releases of decamethylcyclopentasiloxane (D5), Environ. Toxicol. Chem., 34, 2715–2722, https://doi.org/10.1002/etc.3041, 2015.
Genualdi, S., Harner, T., Cheng, Y., MacLeod, M., Hansen, K. M., van Egmond, R., Shoeib, M., and Lee, S. C.: Global Distribution of Linear and Cyclic Volatile Methyl Siloxanes in Air, Environ. Sci. Technol., 45, 3349–3354, https://doi.org/10.1021/es200301j, 2011.
Gobas, F. A. P. C., Powell, D. E., Woodburn, K. B., Springer, T., and Huggett, D. B.: Bioaccumulation of decamethylpentacyclosiloxane (D5): A review, Environ. Toxicol. Chem., 34, 2703–2714, https://doi.org/10.1002/etc.3242, 2015a.
Gobas, F. A. P. C., Xu, S., Kozerski, G., Powell, D. E., Woodburn, K. B., Mackay, D., and Fairbrother, A.: Fugacity and activity analysis of the bioaccumulation and environmental risks of decamethylcyclopentasiloxane (D5), Environ. Toxicol. Chem., 34, 2723–2731, https://doi.org/10.1002/etc.2942, 2015b.
Gouin, T., van Egmond, R., Sparham, C., Hastie, C., and Chowdhury, N.: Simulated use and wash-off release of decamethylcyclopentasiloxane used in anti-perspirants, Chemosphere, 93, 726–734, https://doi.org/10.1016/j.chemosphere.2012.10.042, 2013.
Hansen, K. M., Christensen, J. H., Brandt, J., Frohn, L. M., Geels, C., Skjoth, C. A., and Li, Y.-F.: Modeling short-term variability of alpha-hexachlorocyclohexane in Northern Hemispheric air, J. Geophys. Res., 113, D02310, https://doi.org/10.1029/2007jd008492, 2008.
Horii, Y. and Kannan, K.: Survey of organosilicone compounds, including cyclic and linear siloxanes, in personal-care and household products, Arch. Environ. Con. Tox., 55, 701–710, https://doi.org/10.1007/s00244-008-9172-z, 2008.
Janechek, N., Stanier, C., and Hansen, K.: Data in support of Comprehensive Atmospheric Modeling of Reactive Cyclic Siloxanes and Their Oxidation Products, Harvard Dataverse, https://doi.org/10.7910/DVN/68FO9B, 2017.
Kierkegaard, A. and McLachlan, M. S.: Determination of linear and cyclic volatile methylsiloxanes in air at a regional background site in Sweden, Atmos. Environ., 80, 322–329, https://doi.org/10.1016/j.atmosenv.2013.08.001, 2013.
Kim, J. and Xu, S.: Sorption and desorption kinetics and isotherms of volatile methylsiloxanes with atmospheric aerosols, Chemosphere, 144, 555–563, https://doi.org/10.1016/j.chemosphere.2015.09.033, 2016.
Krogseth, I. S., Kierkegaard, A., McLachlan, M. S., Breivik, K., Hansen, K. M., and Schlabach, M.: Occurrence and Seasonality of Cyclic Volatile Methyl Siloxanes in Arctic Air, Environ. Sci. Technol., 47, 502–509, https://doi.org/10.1021/es3040208, 2013a.
Krogseth, I. S., Zhang, X. M., Lei, Y. D., Wania, F., and Breivik, K.: Calibration and Application of a Passive Air Sampler (XAD-PAS) for Volatile Methyl Siloxanes, Environ. Sci. Technol., 47, 4463–4470, https://doi.org/10.1021/es400427h, 2013b.
Latimer, H. K., Kamens, R. M., and Chandra, G.: The Atmospheric Partitioning of Decamethylcylcopentasiloxane (D5) and 1-Hydroxynonomethylcyclopentasiloxane (D4TOH) on Different Types of Atmospheric Particles, Chemosphere, 36, 2401–2414, https://doi.org/10.1016/S0045-6535(97)10209-0, 1998.
Lei, Y. D., Wania, F., and Mathers, D.: Temperature-Dependent Vapor Pressure of Selected Cyclic and Linear Polydimethylsiloxane Oligomers, J. Chem. Eng. Data, 55, 5868–5873, https://doi.org/10.1021/je100835n, 2010.
Lu, Y., Yuan, T., Wang, W., and Kannan, K.: Concentrations and assessment of exposure to siloxanes and synthetic musks in personal care products from China, Environ. Pollut., 159, 3522–3528, https://doi.org/10.1016/j.envpol.2011.08.015, 2011.
Lyman, W. J., Reehl, W. F., and Rosenblatt, D. H.: Handbook of Chemical Property Estimation Methods: Environmental Behavior of Organic Compounds, McGraw-Hill, New York City, 1982.
Mackay, D., Cowan-Ellsberry, C. E., Powell, D. E., Woodburn, K. B., Xu, S., Kozerski, G. E., and Kim, J.: Decamethylcyclopentasiloxane (D5) environmental sources, fate, transport, and routes of exposure, Environ. Toxicol. Chem., 34, 2689–2702, https://doi.org/10.1002/etc.2941, 2015.
MacLeod, M., von Waldow, H., Tay, P., Armitage, J. M., Wohrnschimmel, H., Riley, W. J., McKone, T. E., and Hungerbuhler, K.: BETR global – A geographically-explicit global-scale multimedia contaminant fate model, Environ. Pollut., 159, 1442–1445, https://doi.org/10.1016/j.envpol.2011.01.038, 2011.
McLachlan, M. S., Kierkegaard, A., Hansen, K. M., van Egmond, R., Christensen, J. H., and Skjoth, C. A.: Concentrations and Fate of Decamethylcyclopentasiloxane (D-5) in the Atmosphere, Environ. Sci. Technol., 44, 5365–5370, https://doi.org/10.1021/es100411w, 2010.
Montemayor, B. P., Price, B. B., and van Egmond, R. A.: Accounting for intended use application in characterizing the contributions of cyclopentasiloxane (D5) to aquatic loadings following personal care product use: antiperspirants, skin care products and hair care products, Chemosphere, 93, 735–740, https://doi.org/10.1016/j.chemosphere.2012.10.043, 2013.
Navea, J. G., Xu, S., Stanier, C. O., Young, M. A., and Grassian, V. H.: Effect of Ozone and Relative Humidity on the Heterogeneous Uptake of Octamethylcyclotetrasiloxane and Decamethylcyclopentasiloxane on Model Mineral Dust Aerosol Components, J. Phys. Chem. A, 113, 7030–7038, https://doi.org/10.1021/jp902192b, 2009a.
Navea, J. G., Xu, S. H., Stanier, C. O., Young, M. A., and Grassian, V. H.: Heterogeneous uptake of octamethylcyclotetrasiloxane (D-4) and decamethylcyclopentasiloxane (D-5) onto mineral dust aerosol under variable RH conditions, Atmos. Environ., 43, 4060–4069, https://doi.org/10.1016/j.atmosenv.2009.05.012, 2009b.
Navea, J. G., Young, M. A., Xu, S., Grassian, V. H., and Stanier, C. O.: The atmospheric lifetimes and concentrations of cyclic methylsiloxanes octamethylcyclotetrasiloxane (D(4)) and decamethylcyclopentasiloxane (D(5)) and the influence of heterogeneous uptake, Atmos. Environ., 45, 3181–3191, https://doi.org/10.1016/j.atmosenv.2011.02.038, 2011.
OECD Environment Directorate: The 2004 OECD List of High Production Volume Chemicals, 2004.
Pieri, F., Katsoyiannis, A., Martellini, T., Hughes, D., Jones, K. C., and Cincinelli, A.: Occurrence of linear and cyclic volatile methyl siloxanes in indoor air samples (UK and Italy) and their isotopic characterization, Environ. Int., 59, 363–371, https://doi.org/10.1016/j.envint.2013.06.006, 2013.
Roselle, S. J. and Binkowski, F. S.: Chapter 11: Cloud Dynamics and Chemistry, in: Science Algorithms of the EPA Models-3 Community Multiscale Air Quality (CMAQ) Modeling System, United States Environmental Protection Agency, Washington, DC, 1999.
Rucker, C. and Kummerer, K.: Environmental chemistry of organosiloxanes, Chem. Rev., 115, 466–524, https://doi.org/10.1021/cr500319v, 2015.
Shoeib, M. and Harner, T.: Using measured octanol-air partition coefficients to explain environmental partitioning of organochlorine pesticides, Environ. Toxicol. Chem., 21, 984–990, https://doi.org/10.1002/etc.5620210513, 2002.
Slowik, J. G., Brook, J., Chang, R. Y.-W., Evans, G. J., Hayden, K., Jeong, C.-H., Li, S.-M., Liggio, J., Liu, P. S. K., McGuire, M., Mihele, C., Sjostedt, S., Vlasenko, A., and Abbatt, J. P. D.: Photochemical processing of organic aerosol at nearby continental sites: contrast between urban plumes and regional aerosol, Atmos. Chem. Phys., 11, 2991–3006, https://doi.org/10.5194/acp-11-2991-2011, 2011.
Sommerlade, R., Parlar, H., Wrobel, D., and Kochs, P.: Product Analysis and Kinetics of the Gas-Phase Reactions of Selected Organosilicon Compounds with OH Radicals Using a Smog Chamber – Mass Spectrometer System, Environ. Sci. Technol., 27, 2435–2440, https://doi.org/10.1021/es00048a019, 1993.
Spak, S., Baek, J., Carlson, J., Carmichael, G. R., Kim, Y. J., Riemer, N., and Stanier, C.: Episodic Air Pollution in Wisconsin (LADCO Winter Nitrate Study) and Georgia (SEARCH Network) During Jan–Mar 2009, Phase II Report, Three Dimensional Modeling, Process Analysis, and Emissions Sensitivity, Lake Michigan Air Directors Consortium, Rosemont, IL, 2012.
Spivakovsky, C. M., Logan, J. A., Montzka, S. A., Balkanski, Y. J., Foreman-Fowler, M., Jones, D. B. A., Horowitz, L. W., Fusco, A. C., Brenninkmeijer, C. A. M., Prather, M. J., Wofsy, S. C., and McElroy, M. B.: Three-dimensional climatological distribution of tropospheric OH: Update and evaluation, J. Geophys. Res., 105, 8931–8980, https://doi.org/10.1029/1999jd901006, 2000.
Tang, X., Misztal, P. K., Nazaroff, W. W., and Goldstein, A. H.: Siloxanes Are the Most Abundant Volatile Organic Compound Emitted from Engineering Students in a Classroom, Environ. Sci. Tech. Let., 2, 303–307, https://doi.org/10.1021/acs.estlett.5b00256, 2015.
Tri Manh, T. and Kannan, K.: Occurrence of cyclic and linear siloxanes in indoor air from Albany, New York, USA, and its implications for inhalation exposure, Sci. Total Environ., 511, 138–144, https://doi.org/10.1016/j.scitotenv.2014.12.022, 2015.
Tri Manh, T., Abualnaja, K. O., Asimakopoulos, A. G., Covaci, A., Gevao, B., Johnson-Restrepo, B., Kumosani, T. A., Malarvannan, G., Tu Binh, M., Moon, H.-B., Nakata, H., Sinha, R. K., and Kannan, K.: A survey of cyclic and linear siloxanes in indoor dust and their implications for human exposures in twelve countries, Environ. Int., 78, 39-44, https://doi.org/10.1016/j.envint.2015.02.011, 2015.
Wang, D. G., Norwood, W., Alaee, M., Byer, J. D., and Brimble, S.: Review of recent advances in research on the toxicity, detection, occurrence and fate of cyclic volatile methyl siloxanes in the environment, Chemosphere, 93, 711–725, https://doi.org/10.1016/j.chemosphere.2012.10.041, 2013.
Wang, R., Moody, R. P., Koniecki, D., and Zhu, J.: Low molecular weight cyclic volatile methylsiloxanes in cosmetic products sold in Canada: implication for dermal exposure, Environ. Int., 35, 900–904, https://doi.org/10.1016/j.envint.2009.03.009, 2009.
Wang, X. M., Lee, S. C., Sheng, G. Y., Chan, L. Y., Fu, J. M., Li, X. D., Min, Y. S., and Chan, C. Y.: Cyclic organosilicon compounds in ambient air in Guangzhou, Macau and Nanhai, Pearl River Delta, Appl. Geochem., 16, 1447–1454, https://doi.org/10.1016/S0883-2927(01)00044-0, 2001.
Wania, F.: Assessing the potential of persistent organic chemicals for long-range transport and accumulation in polar regions, Environ. Sci. Technol., 37, 1344–1351, https://doi.org/10.1021/es026019e, 2003.
Whelan, M. J., Estrada, E., and van Egmond, R.: A modelling assessment of the atmospheric fate of volatile methyl siloxanes and their reaction products, Chemosphere, 57, 1427–1437, https://doi.org/10.1016/j.chemosphere.2004.08.100, 2004.
Wu, Y. and Johnston, M. V.: Molecular Characterization of Secondary Aerosol from Oxidation of Cyclic Methylsiloxanes, J. Am. Soc. Mass. Spectr., 27, 402–409, https://doi.org/10.1007/s13361-015-1300-1, 2016.
Xu, S. and Kropscott, B.: Method for simultaneous determination of partition coefficients for cyclic volatile methylsiloxanes and dimethylsilanediol, Anal. Chem., 84, 1948–1955, https://doi.org/10.1021/ac202953t, 2012.
Xu, S. and Wania, F.: Chemical fate, latitudinal distribution and long-range transport of cyclic volatile methylsiloxanes in the global environment: a modeling assessment, Chemosphere, 93, 835–843, https://doi.org/10.1016/j.chemosphere.2012.10.056, 2013.
Yucuis, R. A., Stanier, C. O., and Hornbuckle, K. C.: Cyclic siloxanes in air, including identification of high levels in Chicago and distinct diurnal variation, Chemosphere, 92, 905–910, https://doi.org/10.1016/j.chemosphere.2013.02.051, 2013.
Short summary
Gas-phase cyclic volatile methyl siloxanes and their oxidation products, which are likely precursors to secondary organic aerosol, were modeled using an atmospheric transport model over North America. Typical concentrations, spatial patterns, seasonal variability, and vertical profiles were quantified. Urban parent compound concentrations were sensitive to transport factors, while rural parent and oxidized product concentrations were sensitive to large-scale seasonal variability in OH.
Gas-phase cyclic volatile methyl siloxanes and their oxidation products, which are likely...
Altmetrics
Final-revised paper
Preprint