Articles | Volume 16, issue 23
https://doi.org/10.5194/acp-16-15327-2016
© Author(s) 2016. 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-16-15327-2016
© Author(s) 2016. This work is distributed under
the Creative Commons Attribution 3.0 License.
the Creative Commons Attribution 3.0 License.
Research article
| 
09 Dec 2016
Research article |
| 09 Dec 2016
Evaluation of gas-particle partitioning in a regional air quality model for organic pollutants
Christos I. Efstathiou
CORRESPONDING AUTHOR
Masaryk University, Research Centre for Toxic Compounds in the
Environment, Kamenice 5, 62500 Brno, Czech Republic
Jana Matejovičová
Masaryk University, Research Centre for Toxic Compounds in the
Environment, Kamenice 5, 62500 Brno, Czech Republic
Slovak Hydrometeorological Institute, Jeséniova 17, 83315
Bratislava, Slovak Republic
Johannes Bieser
Institute of Coastal Research, Helmholtz-Zentrum Geesthacht,
Max-Planck-Str. 1, 21502 Geesthacht, Germany
German Aerospace Center (DLR), Oberpfaffenhofen, 82234 Weßling,
Germany
Gerhard Lammel
Masaryk University, Research Centre for Toxic Compounds in the
Environment, Kamenice 5, 62500 Brno, Czech Republic
Max Planck Institute for Chemistry, Multiphase Chemistry Department,
Hahn-Meitner-Weg 1, 55128 Mainz, Germany
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Céline Degrendele, Jake Wilson, Petr Kukučka, Jana Klánová, and Gerhard Lammel
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Franz Slemr, Andreas Weigelt, Ralf Ebinghaus, Johannes Bieser, Carl A. M. Brenninkmeijer, Armin Rauthe-Schöch, Markus Hermann, Bengt G. Martinsson, Peter van Velthoven, Harald Bönisch, Marco Neumaier, Andreas Zahn, and Helmut Ziereis
Atmos. Chem. Phys., 18, 12329–12343, https://doi.org/10.5194/acp-18-12329-2018, https://doi.org/10.5194/acp-18-12329-2018, 2018
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Gerhard Lammel, Céline Degrendele, Sachin S. Gunthe, Qing Mu, Akila Muthalagu, Ondřej Audy, Chelackal V. Biju, Petr Kukučka, Marie D. Mulder, Mega Octaviani, Petra Příbylová, Pourya Shahpoury, Irene Stemmler, and Aswathy E. Valsan
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Persistent organic pollutants that have accumulated in soils over decades can be remobilised by volatilisation. Clean air masses advected with the onset of the summer monsoon to India enhance revolatilisation of chemicals which have been banned for decades. During propagation of the monsoon northward across the subcontinent, the air is increasingly polluted by these secondary emissions. Remobilisation of some PCBs may even have reached a historical high, 40 years after peak emission.
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
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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
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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.
Stefano Galmarini, Ioannis Kioutsioukis, Efisio Solazzo, Ummugulsum Alyuz, Alessandra Balzarini, Roberto Bellasio, Anna M. K. Benedictow, Roberto Bianconi, Johannes Bieser, Joergen Brandt, Jesper H. Christensen, Augustin Colette, Gabriele Curci, Yanko Davila, Xinyi Dong, Johannes Flemming, Xavier Francis, Andrea Fraser, Joshua Fu, Daven K. Henze, Christian Hogrefe, Ulas Im, Marta Garcia Vivanco, Pedro Jiménez-Guerrero, Jan Eiof Jonson, Nutthida Kitwiroon, Astrid Manders, Rohit Mathur, Laura Palacios-Peña, Guido Pirovano, Luca Pozzoli, Marie Prank, Martin Schultz, Rajeet S. Sokhi, Kengo Sudo, Paolo Tuccella, Toshihiko Takemura, Takashi Sekiya, and Alper Unal
Atmos. Chem. Phys., 18, 8727–8744, https://doi.org/10.5194/acp-18-8727-2018, https://doi.org/10.5194/acp-18-8727-2018, 2018
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An ensemble of model results relating to ozone concentrations in Europe in 2010 has been produced and studied. The novelty consists in the fact that the ensemble is made of results of models working at two different scales (regional and global), therefore contributing in detail two different parts of the atmospheric spectrum. The ensemble defined as a hybrid has been studied in detail and shown to bring additional value to the assessment of air quality.
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
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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.
Qing Mu, Gerhard Lammel, Christian N. Gencarelli, Ian M. Hedgecock, Ying Chen, Petra Přibylová, Monique Teich, Yuxuan Zhang, Guangjie Zheng, Dominik van Pinxteren, Qiang Zhang, Hartmut Herrmann, Manabu Shiraiwa, Peter Spichtinger, Hang Su, Ulrich Pöschl, and Yafang Cheng
Atmos. Chem. Phys., 17, 12253–12267, https://doi.org/10.5194/acp-17-12253-2017, https://doi.org/10.5194/acp-17-12253-2017, 2017
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Polycyclic aromatic hydrocarbons (PAHs) are hazardous pollutants with the largest emissions in East Asia. The regional WRF-Chem-PAH model has been developed to reflect the state-of-the-art understanding of current PAHs studies with several new or updated features. It is able to reasonably well simulate the concentration levels and particulate mass fractions of PAHs near the sources and at a remote outflow region of East Asia, in high spatial and temporal resolutions.
Johannes Bieser, Franz Slemr, Jesse Ambrose, Carl Brenninkmeijer, Steve Brooks, Ashu Dastoor, Francesco DeSimone, Ralf Ebinghaus, Christian N. Gencarelli, Beate Geyer, Lynne E. Gratz, Ian M. Hedgecock, Daniel Jaffe, Paul Kelley, Che-Jen Lin, Lyatt Jaegle, Volker Matthias, Andrei Ryjkov, Noelle E. Selin, Shaojie Song, Oleg Travnikov, Andreas Weigelt, Winston Luke, Xinrong Ren, Andreas Zahn, Xin Yang, Yun Zhu, and Nicola Pirrone
Atmos. Chem. Phys., 17, 6925–6955, https://doi.org/10.5194/acp-17-6925-2017, https://doi.org/10.5194/acp-17-6925-2017, 2017
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We conducted a multi model study to investigate our ability to reproduce the vertical distribution of mercury in the atmosphere. For this, we used observational data from over 40 aircraft flights in EU and US. We compared observations to the results of seven chemistry transport models and found that the models are able to reproduce vertical gradients of total and elemental Hg. Finally, we found that different chemical reactions seem responsible for the oxidation of Hg depending on altitude.
Gerhard Lammel, Marie D. Mulder, Pourya Shahpoury, Petr Kukučka, Hana Lišková, Petra Přibylová, Roman Prokeš, and Gerhard Wotawa
Atmos. Chem. Phys., 17, 6257–6270, https://doi.org/10.5194/acp-17-6257-2017, https://doi.org/10.5194/acp-17-6257-2017, 2017
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Nitro-polycyclic aromatic hydrocarbons (NPAH) are ubiquitous and formed in polluted air, but little is known about their abundance in background air and long-range transport potential. We studied NPAHs in the gas and particulate phases of aerosols in the marine (Mediterranean) and continental (Gt. Hungarian Plain) environment in summer. The NPAH levels determined in the southeastern outflow of Europe are the lowest ever reported and confirm intercontinental transport potential.
Oleg Travnikov, Hélène Angot, Paulo Artaxo, Mariantonia Bencardino, Johannes Bieser, Francesco D'Amore, Ashu Dastoor, Francesco De Simone, María del Carmen Diéguez, Aurélien Dommergue, Ralf Ebinghaus, Xin Bin Feng, Christian N. Gencarelli, Ian M. Hedgecock, Olivier Magand, Lynwill Martin, Volker Matthias, Nikolay Mashyanov, Nicola Pirrone, Ramesh Ramachandran, Katie Alana Read, Andrei Ryjkov, Noelle E. Selin, Fabrizio Sena, Shaojie Song, Francesca Sprovieri, Dennis Wip, Ingvar Wängberg, and Xin Yang
Atmos. Chem. Phys., 17, 5271–5295, https://doi.org/10.5194/acp-17-5271-2017, https://doi.org/10.5194/acp-17-5271-2017, 2017
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The study provides a complex analysis of processes governing Hg fate in the atmosphere involving both measurement data and simulation results of chemical transport models. Evaluation of the model simulations and numerical experiments against observations allows explaining spatial and temporal variations of Hg concentration in the near-surface atmospheric layer and shows possibility of multiple pathways of Hg oxidation occurring concurrently in various parts of the atmosphere.
Efisio Solazzo, Roberto Bianconi, Christian Hogrefe, Gabriele Curci, Paolo Tuccella, Ummugulsum Alyuz, Alessandra Balzarini, Rocío Baró, Roberto Bellasio, Johannes Bieser, Jørgen Brandt, Jesper H. Christensen, Augistin Colette, Xavier Francis, Andrea Fraser, Marta Garcia Vivanco, Pedro Jiménez-Guerrero, Ulas Im, Astrid Manders, Uarporn Nopmongcol, Nutthida Kitwiroon, Guido Pirovano, Luca Pozzoli, Marje Prank, Ranjeet S. Sokhi, Alper Unal, Greg Yarwood, and Stefano Galmarini
Atmos. Chem. Phys., 17, 3001–3054, https://doi.org/10.5194/acp-17-3001-2017, https://doi.org/10.5194/acp-17-3001-2017, 2017
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As part of the third phase of AQMEII, this study uses timescale analysis to apportion error to the responsible processes, detect causes of model error, and identify the processes and scales that require dedicated investigations. The analysis tackles model performance gauging through measurement-to-model comparison, error decomposition, and time series analysis of model biases for ozone, CO, SO2, NO, NO2, PM10, PM2.5, wind speed, and temperature over Europe and North America.
Christian N. Gencarelli, Johannes Bieser, Francesco Carbone, Francesco De Simone, Ian M. Hedgecock, Volker Matthias, Oleg Travnikov, Xin Yang, and Nicola Pirrone
Atmos. Chem. Phys., 17, 627–643, https://doi.org/10.5194/acp-17-627-2017, https://doi.org/10.5194/acp-17-627-2017, 2017
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Atmospheric deposition is an important pathway by which Hg reaches marine ecosystems, where it can be methylated and enter the base of food chain. High resolution numerical experiments has been performed in order to investigate the contributions (sensitivity) of the Hg anthtropogenic emissions, speciation and atmospherical chemical reactions on Hg depositions over Europe. The comparison of wet deposition fluxes and concentrations measured on 28 monitioring sites were used to support the analysis.
Andreas Weigelt, Franz Slemr, Ralf Ebinghaus, Nicola Pirrone, Johannes Bieser, Jan Bödewadt, Giulio Esposito, and Peter F. J. van Velthoven
Atmos. Chem. Phys., 16, 13653–13668, https://doi.org/10.5194/acp-16-13653-2016, https://doi.org/10.5194/acp-16-13653-2016, 2016
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Hg ∕ SO2, Hg ∕ CO, and NOx ∕ SO2 emission ratios (ERs) in the plume of the coal-fired power plant (CFPP), Lippendorf, near Leipzig in Germany, were determined in August 2013. GOM fraction of mercury emissions was also assessed. Measured Hg ∕ SO2 and Hg ∕ CO ERs were consistent with the ratios calculated from annual emissions in 2013 reported by the CFPP operator. The NOx ∕ SO2 ER was somewhat lower. GOM fractions of ~ 40 % of CFPP mercury emissions in current emission inventories are overestimated.
Bertrand Bessagnet, Guido Pirovano, Mihaela Mircea, Cornelius Cuvelier, Armin Aulinger, Giuseppe Calori, Giancarlo Ciarelli, Astrid Manders, Rainer Stern, Svetlana Tsyro, Marta García Vivanco, Philippe Thunis, Maria-Teresa Pay, Augustin Colette, Florian Couvidat, Frédérik Meleux, Laurence Rouïl, Anthony Ung, Sebnem Aksoyoglu, José María Baldasano, Johannes Bieser, Gino Briganti, Andrea Cappelletti, Massimo D'Isidoro, Sandro Finardi, Richard Kranenburg, Camillo Silibello, Claudio Carnevale, Wenche Aas, Jean-Charles Dupont, Hilde Fagerli, Lucia Gonzalez, Laurent Menut, André S. H. Prévôt, Pete Roberts, and Les White
Atmos. Chem. Phys., 16, 12667–12701, https://doi.org/10.5194/acp-16-12667-2016, https://doi.org/10.5194/acp-16-12667-2016, 2016
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The EURODELTA III exercise allows a very comprehensive intercomparison and evaluation of air quality models' performance. On average, the models provide a rather good picture of the particulate matter (PM) concentrations over Europe even if the highest concentrations are underestimated. The meteorology is responsible for model discrepancies, while the lack of emissions, particularly in winter, is mentioned as the main reason for the underestimations of PM.
Daniel Neumann, Volker Matthias, Johannes Bieser, Armin Aulinger, and Markus Quante
Atmos. Chem. Phys., 16, 9905–9933, https://doi.org/10.5194/acp-16-9905-2016, https://doi.org/10.5194/acp-16-9905-2016, 2016
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Atmospheric sea salt particles provide surface area for the condensation of gaseous substances and, thus, impact these substances' atmospheric residence time and chemical reactions. The number and size of sea salt particles govern the strength of these impacts. Therefore, these parameters should be reflected accurately in chemistry transport models. In this study, three different sea salt emission functions are compared in order to evaluate which one is best suited for the given model setup.
Gerhard Lammel, Franz X. Meixner, Branislav Vrana, Christos I. Efstathiou, Jiři Kohoutek, Petr Kukučka, Marie D. Mulder, Petra Přibylová, Roman Prokeš, Tatsiana P. Rusina, Guo-Zheng Song, and Manolis Tsapakis
Atmos. Chem. Phys., 16, 6381–6393, https://doi.org/10.5194/acp-16-6381-2016, https://doi.org/10.5194/acp-16-6381-2016, 2016
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As a consequence of long-range transported pollution air–sea exchange can become a major source of anthropogenic organic pollutants. Fluxes were studied at a remote coastal site in the Mediterranean, based on gradient measurements in air, measurements in surface seawater and eddy covariance. Night-time maxima in air are explained by volatilisation from the sea surface. Fluctuation of the direction of air–sea exchange indicate that long-term observations are needed.
Andreas Weigelt, Ralf Ebinghaus, Nicola Pirrone, Johannes Bieser, Jan Bödewadt, Giulio Esposito, Franz Slemr, Peter F. J. van Velthoven, Andreas Zahn, and Helmut Ziereis
Atmos. Chem. Phys., 16, 4135–4146, https://doi.org/10.5194/acp-16-4135-2016, https://doi.org/10.5194/acp-16-4135-2016, 2016
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We show the first mercury profile measurements over Europe since 1996. Besides gaseous elemental mercury (GEM) and total gaseous mercury (TGM), the gases CO, SO2, NOx, and O3 were measured from aboard a research aircraft over four European locations. Compared to the boundary layer, the concentration of GEM and TGM in the free troposphere was 10–30% lower. Inside the individual layers no vertical gradient was apparent. Combined with CARIBIC data, a unique profile from 0.4 to 10.5 km is provided.
Daniel Neumann, Volker Matthias, Johannes Bieser, Armin Aulinger, and Markus Quante
Atmos. Chem. Phys., 16, 2921–2942, https://doi.org/10.5194/acp-16-2921-2016, https://doi.org/10.5194/acp-16-2921-2016, 2016
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Sea salt emissions were updated to be dependent on salinity which improved sodium predictions in the Baltic Sea region. The impact of sea salt on atmospheric nitrate and ammonium concentrations and on nitrogen deposition in the North and Baltic Sea region is assessed. Sea salt has a low effect on nitrate concentrations but does not improve them. 3 to 7 % of the nitrogen deposition into the North Sea is accounted to the presence of sea salt. In the Baltic Sea, the contribution is negligible.
V. Matthias, A. Aulinger, A. Backes, J. Bieser, B. Geyer, M. Quante, and M. Zeretzke
Atmos. Chem. Phys., 16, 759–776, https://doi.org/10.5194/acp-16-759-2016, https://doi.org/10.5194/acp-16-759-2016, 2016
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Scenarios for future shipping emissions in the North Sea were developed. Compared to today, the contribution of shipping to the nitrogen dioxide and ozone concentrations will increase due to the expected enhanced traffic by more than 20 % and 5 %, respectively, by 2030 if no regulation for further emission reductions is implemented. PM2.5 will decrease slightly because the sulfur content in ship fuels will be reduced.
A. Aulinger, V. Matthias, M. Zeretzke, J. Bieser, M. Quante, and A. Backes
Atmos. Chem. Phys., 16, 739–758, https://doi.org/10.5194/acp-16-739-2016, https://doi.org/10.5194/acp-16-739-2016, 2016
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A multi-model approach consisting of a bottom-up ship emissions model and a chemistry transport model was used to evaluate the impact of shipping on air quality in North Sea bordering countries. As an example, the results of the simulations indicated that the relative contribution of ships to NO2 concentration levels ashore close to the sea can reach up to 25 % in summer and 15 % in winter. Some hundred kilometers away from the sea, the contribution was about 6 % in summer and 4 % in winter.
J. Zhu, T. Wang, J. Bieser, and V. Matthias
Atmos. Chem. Phys., 15, 8767–8779, https://doi.org/10.5194/acp-15-8767-2015, https://doi.org/10.5194/acp-15-8767-2015, 2015
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This study estimated the contributions to mercury concentration and deposition in easter China from seven categories of emission sources by CMAQ-Hg. Also, this study focuses on diagnostic and process analyses for atmospheric mercury pollution formation and on identification of the dominant atmospheric processes for mercury.
P. Shahpoury, G. Lammel, A. Holubová Šmejkalová, J. Klánová, P. Přibylová, and M. Váňa
Atmos. Chem. Phys., 15, 1795–1805, https://doi.org/10.5194/acp-15-1795-2015, https://doi.org/10.5194/acp-15-1795-2015, 2015
M. D. Mulder, A. Heil, P. Kukučka, J. Klánová, J. Kuta, R. Prokeš, F. Sprovieri, and G. Lammel
Atmos. Chem. Phys., 14, 8905–8915, https://doi.org/10.5194/acp-14-8905-2014, https://doi.org/10.5194/acp-14-8905-2014, 2014
Related subject area
Subject: Aerosols | Research Activity: Atmospheric Modelling and Data Analysis | Altitude Range: Troposphere | Science Focus: Chemistry (chemical composition and reactions)
Dimethyl sulfide chemistry over the industrial era: comparison of key oxidation mechanisms and long-term observations
Driving factors of aerosol acidity: a new hierarchical quantitative analysis framework and its application in Changzhou, China
Understanding the long-term trend of organic aerosol and the influences from anthropogenic emission and regional climate change in China
Population exposure to outdoor NO2, black carbon, and ultrafine and fine particles over Paris with multi-scale modelling down to the street scale
Predicted impacts of heterogeneous chemical pathways on particulate sulfur over Fairbanks (Alaska), the Northern Hemisphere, and the Contiguous United States
Critical load exceedances for North America and Europe using an ensemble of models and an investigation of causes of environmental impact estimate variability: an AQMEII4 study
Impacts of meteorology and emission reductions on haze pollution during the lockdown in the North China Plain
Impact of mineral dust on the global nitrate aerosol direct and indirect radiative effect
The surface tension and cloud condensation nuclei (CCN) activation of sea spray aerosol particles
Exploring the processes controlling secondary inorganic aerosol: evaluating the global GEOS-Chem simulation using a suite of aircraft campaigns
Influence of land cover change on atmospheric organic gases, aerosols, and radiative effects
Quantifying the impacts of marine aerosols over the southeast Atlantic Ocean using a chemical transport model: implications for aerosol–cloud interactions
Quantifying the impact of global nitrate aerosol on tropospheric composition fields and its production from lightning NOx
Rapid oxidation of phenolic compounds by O3 and HO●: effects of the air–water interface and mineral dust in tropospheric chemical processes
Uncertainties in the effects of organic aerosol coatings on polycyclic aromatic hydrocarbon concentrations and their estimated health effects
Modeling the contribution of leads to sea spray aerosol in the high Arctic
Trends and Drivers of Soluble Iron Deposition from East Asian Dust to the Northwest Pacific: A Springtime Analysis (2001–2017)
Impacts of Sea Ice Leads on Sea Salt Aerosols and Atmospheric Chemistry in the Arctic
Implications of Reduced-Complexity Aerosol Thermodynamics on Organic Aerosol Mass Concentration and Composition over North America
Importance of aerosol composition and aerosol vertical profiles in global spatial variation in the relationship between PM2.5 and aerosol optical depth
The co-benefits of a low-carbon future for PM2.5 and O3 air pollution in Europe
Assessing the effectiveness of SO2, NOx, and NH3 emission reductions in mitigating winter PM2.5 in Taiwan using CMAQ
Modelling of atmospheric concentrations of fungal spores: a 2-year simulation over France using CHIMERE
Cluster-dynamics-based parameterization for sulfuric acid–dimethylamine nucleation: comparison and selection through box and three-dimensional modeling
A Comprehensive Global Modelling Assessment of Nitrate Heterogeneous Formation on Desert Dust
Modelling of atmospheric variability of gas and aerosols during the ACROSS campaign 2022 in the greater Paris area: evaluation of the meteorology, dynamics and chemistry
Observed and CMIP6-model-simulated organic aerosol response to drought in the contiguous United States during summertime
Long-term trends in aerosol properties derived from AERONET measurements
Cooling radiative forcing effect enhancement of atmospheric amines and mineral particles caused by heterogeneous uptake and oxidation
Source-resolved atmospheric metal emissions, concentrations, and deposition fluxes into the East Asian seas
Analysis of secondary inorganic aerosols over the greater Athens area using the EPISODE–CityChem source dispersion and photochemistry model
Global estimates of ambient reactive nitrogen components during 2000–2100 based on the multi-stage model
The role of naphthalene and its derivatives in the formation of secondary organic aerosol in the Yangtze River Delta region, China
Unveiling the optimal regression model for source apportionment of the oxidative potential of PM10
AERO-MAP: A data compilation and modelling approach to understand spatial variability in fine and coarse mode aerosol composition
Investigating the contribution of grown new particles to cloud condensation nuclei with largely varying preexisting particles – Part 2: Modeling chemical drivers and 3-D new particle formation occurrence
Technical note: Influence of different averaging metrics and temporal resolutions on the aerosol pH calculated by thermodynamic modeling
Dual roles of the inorganic aqueous phase on secondary organic aerosol growth from benzene and phenol
Global source apportionment of aerosols into major emission regions and sectors over 1850–2017
Modeling atmospheric brown carbon in the GISS ModelE Earth system model
Observation-constrained kinetic modeling of isoprene SOA formation in the atmosphere
Significant impact of urban tree biogenic emissions on air quality estimated by a bottom-up inventory and chemistry transport modeling
Secondary organic aerosols derived from intermediate-volatility n-alkanes adopt low-viscous phase state
Spatial-temporal patterns of anthropogenic and biomass burning contributions on air pollution and mortality burden changes in India from 1995 to 2014
Modeling the drivers of fine PM pollution over Central Europe: impacts and contributions of emissions from different sources
Reaction of SO3 with H2SO4 and its implications for aerosol particle formation in the gas phase and at the air–water interface
Weakened aerosol–radiation interaction exacerbating ozone pollution in eastern China since China's clean air actions
Uncertainties from biomass burning aerosols in air quality models obscure public health impacts in Southeast Asia
Oxidative potential apportionment of atmospheric PM1: a new approach combining high-sensitive online analysers for chemical composition and offline OP measurement technique
Aqueous-phase chemistry of glyoxal with multifunctional reduced nitrogen compounds: a potential missing route for secondary brown carbon
Ursula A. Jongebloed, Jacob I. Chalif, Linia Tashmim, William C. Porter, Kelvin H. Bates, Qianjie Chen, Erich C. Osterberg, Bess G. Koffman, Jihong Cole-Dai, Dominic A. Winski, David G. Ferris, Karl J. Kreutz, Cameron P. Wake, and Becky Alexander
Atmos. Chem. Phys., 25, 4083–4106, https://doi.org/10.5194/acp-25-4083-2025, https://doi.org/10.5194/acp-25-4083-2025, 2025
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Marine phytoplankton emit dimethyl sulfide (DMS), which forms methanesulfonic acid (MSA) and sulfate. MSA concentrations in ice cores decreased over the industrial era, which has been attributed to pollution-driven changes in DMS chemistry. We use a model to investigate DMS chemistry compared to observations of DMS, MSA, and sulfate. We find that modeled DMS, MSA, and sulfate are influenced by pollution-sensitive oxidant concentrations, characterization of DMS chemistry, and other variables.
Xiaolin Duan, Guangjie Zheng, Chuchu Chen, Qiang Zhang, and Kebin He
Atmos. Chem. Phys., 25, 3919–3928, https://doi.org/10.5194/acp-25-3919-2025, https://doi.org/10.5194/acp-25-3919-2025, 2025
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Aerosol acidity is an important parameter in atmospheric chemistry, while its driving factors, especially chemical profiles versus meteorological conditions, are not yet fully understood. Here, we established a hierarchical quantitative analysis framework to understand the driving factors of aerosol acidity on different timescales. Its application in Changzhou, China, revealed distinct driving factors and corresponding mechanisms of aerosol acidity from annual trends to random residuals.
Wenxin Zhang, Yaman Liu, Man Yue, Xinyi Dong, Kan Huang, and Minghuai Wang
Atmos. Chem. Phys., 25, 3857–3872, https://doi.org/10.5194/acp-25-3857-2025, https://doi.org/10.5194/acp-25-3857-2025, 2025
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Understanding long-term organic aerosol (OA) trends and their driving factors is important for air quality management. Our modeling revealed that OA in China increased by 5.6 % from 1990 to 2019, primarily due to a 32.3 % increase in secondary organic aerosols (SOAs) and an 8.1 % decrease in primary organic aerosols (POAs), both largely driven by changes in anthropogenic emissions. Biogenic SOA increased due to warming but showed little response to changes in anthropogenic nitrogen oxide emissions.
Soo-Jin Park, Lya Lugon, Oscar Jacquot, Youngseob Kim, Alexia Baudic, Barbara D'Anna, Ludovico Di Antonio, Claudia Di Biagio, Fabrice Dugay, Olivier Favez, Véronique Ghersi, Aline Gratien, Julien Kammer, Jean-Eudes Petit, Olivier Sanchez, Myrto Valari, Jérémy Vigneron, and Karine Sartelet
Atmos. Chem. Phys., 25, 3363–3387, https://doi.org/10.5194/acp-25-3363-2025, https://doi.org/10.5194/acp-25-3363-2025, 2025
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To accurately represent the population exposure to outdoor concentrations of pollutants of interest to health (NO2, PM2.5, black carbon, and ultrafine particles), multi-scale modelling down to the street scale is set up and evaluated using measurements from field campaigns. An exposure scaling factor is defined, allowing regional-scale simulations to be corrected to evaluate population exposure. Urban heterogeneities strongly influence NO2, black carbon, and ultrafine particles but less strongly PM2.5.
Sara L. Farrell, Havala O. T. Pye, Robert Gilliam, George Pouliot, Deanna Huff, Golam Sarwar, William Vizuete, Nicole Briggs, Fengkui Duan, Tao Ma, Shuping Zhang, and Kathleen Fahey
Atmos. Chem. Phys., 25, 3287–3312, https://doi.org/10.5194/acp-25-3287-2025, https://doi.org/10.5194/acp-25-3287-2025, 2025
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In this work we implement heterogeneous sulfur chemistry into the Community Multiscale Air Quality (CMAQ) model. This new chemistry accounts for the formation of sulfate via aqueous oxidation of SO2 in aerosol liquid water and the formation of hydroxymethanesulfonate (HMS) – often confused by measurement techniques as sulfate. Model performance in predicting sulfur PM2.5 in Fairbanks, Alaska, and other places that experience dark and cold winters is improved.
Paul A. Makar, Philip Cheung, Christian Hogrefe, Ayodeji Akingunola, Ummugulsum Alyuz, Jesse O. Bash, Michael D. Bell, Roberto Bellasio, Roberto Bianconi, Tim Butler, Hazel Cathcart, Olivia E. Clifton, Alma Hodzic, Ioannis Kioutsioukis, Richard Kranenburg, Aurelia Lupascu, Jason A. Lynch, Kester Momoh, Juan L. Perez-Camanyo, Jonathan Pleim, Young-Hee Ryu, Roberto San Jose, Donna Schwede, Thomas Scheuschner, Mark W. Shephard, Ranjeet S. Sokhi, and Stefano Galmarini
Atmos. Chem. Phys., 25, 3049–3107, https://doi.org/10.5194/acp-25-3049-2025, https://doi.org/10.5194/acp-25-3049-2025, 2025
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The large range of sulfur and nitrogen deposition estimates from air quality models results in a large range of predicted impacts. We used models and deposition diagnostics to identify the processes controlling atmospheric sulfur and nitrogen deposition variability. Controlling factors included the uptake of gases and aerosols by hydrometeors, aerosol inorganic chemistry, particle dry deposition, ammonia bidirectional fluxes, gas deposition via plant cuticles and soil, and land use data.
Lang Liu, Xin Long, Yi Li, Zengliang Zang, Fengwen Wang, Yan Han, Zhier Bao, Yang Chen, Tian Feng, and Jinxin Yang
Atmos. Chem. Phys., 25, 1569–1585, https://doi.org/10.5194/acp-25-1569-2025, https://doi.org/10.5194/acp-25-1569-2025, 2025
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This study uses WRF-Chem to assess how meteorological conditions and emission reductions affected fine particulate matter (PM2.5) in the North China Plain (NCP). It highlights regional disparities: in the northern NCP, adverse weather negated emission reduction effects. In contrast, the southern NCP featured a PM2.5 decrease due to favorable weather and emission reductions. The research highlighted the interaction between emissions, meteorology, and PM2.5.
Alexandros Milousis, Klaus Klingmüller, Alexandra P. Tsimpidi, Jasper F. Kok, Maria Kanakidou, Athanasios Nenes, and Vlassis A. Karydis
Atmos. Chem. Phys., 25, 1333–1351, https://doi.org/10.5194/acp-25-1333-2025, https://doi.org/10.5194/acp-25-1333-2025, 2025
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This study investigates the impact of dust on the global radiative effect of nitrate aerosols. The results indicate both positive and negative regional shortwave and longwave radiative effects due to aerosol–radiation interactions and cloud adjustments. The global average net REari and REaci of nitrate aerosols are −0.11 and +0.17 W m−2, respectively, mainly affecting the shortwave spectrum. Sensitivity simulations evaluated the influence of mineral dust composition and emissions on the results.
Judith Kleinheins, Nadia Shardt, Ulrike Lohmann, and Claudia Marcolli
Atmos. Chem. Phys., 25, 881–903, https://doi.org/10.5194/acp-25-881-2025, https://doi.org/10.5194/acp-25-881-2025, 2025
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We model the cloud condensation nuclei (CCN) activation of sea spray aerosol particles with classical Köhler theory and with a new model approach that takes surface tension lowering into account. We categorize organic compounds into weak, intermediate, and strong surfactants, and we outline for which composition surface tension lowering is important. The results suggest that surface tension lowering allows sea spray aerosol particles in the Aitken mode to be a source of CCN in marine updraughts.
Olivia G. Norman, Colette L. Heald, Solomon Bililign, Pedro Campuzano-Jost, Hugh Coe, Marc N. Fiddler, Jaime R. Green, Jose L. Jimenez, Katharina Kaiser, Jin Liao, Ann M. Middlebrook, Benjamin A. Nault, John B. Nowak, Johannes Schneider, and André Welti
Atmos. Chem. Phys., 25, 771–795, https://doi.org/10.5194/acp-25-771-2025, https://doi.org/10.5194/acp-25-771-2025, 2025
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This study finds that one component of secondary inorganic aerosols, nitrate, is greatly overestimated by a global atmospheric chemistry model compared to observations from 11 flight campaigns. None of the loss and production pathways explored can explain the nitrate bias alone. The model’s inability to capture the variability in the observations remains and requires future investigation to avoid biases in policy-related studies (i.e., air quality, health, climate impacts of these aerosols).
Ryan Vella, Matthew Forrest, Andrea Pozzer, Alexandra P. Tsimpidi, Thomas Hickler, Jos Lelieveld, and Holger Tost
Atmos. Chem. Phys., 25, 243–262, https://doi.org/10.5194/acp-25-243-2025, https://doi.org/10.5194/acp-25-243-2025, 2025
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This study examines how land cover changes influence biogenic volatile organic compound (BVOC) emissions and atmospheric states. Using a coupled chemistry–climate–vegetation model, we compare present-day land cover (deforested for crops and grazing) with natural vegetation and an extreme reforestation scenario. We find that vegetation changes significantly impact global BVOC emissions and organic aerosols but have a relatively small effect on total aerosols, clouds, and radiative effects.
Mashiat Hossain, Rebecca M. Garland, and Hannah M. Horowitz
Atmos. Chem. Phys., 24, 14123–14143, https://doi.org/10.5194/acp-24-14123-2024, https://doi.org/10.5194/acp-24-14123-2024, 2024
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Our research examines aerosol dynamics over the southeast Atlantic, a region with significant uncertainties in aerosol radiative forcings. Using the GEOS-Chem model, we find that at cloud altitudes, organic aerosols dominate during the biomass burning season, while sulfate aerosols, driven by marine emissions, prevail during peak primary production. These findings highlight the need for accurate representation of marine aerosols in models to improve climate predictions and reduce uncertainties.
Ashok K. Luhar, Anthony C. Jones, and Jonathan M. Wilkinson
Atmos. Chem. Phys., 24, 14005–14028, https://doi.org/10.5194/acp-24-14005-2024, https://doi.org/10.5194/acp-24-14005-2024, 2024
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Nitrate aerosol is often omitted in global chemistry–climate models, partly due to the chemical complexity of its formation process. Using a global model, we show that including nitrate aerosol significantly impacts tropospheric composition fields, such as ozone, and radiation. Additionally, lightning-generated oxides of nitrogen influence both nitrate aerosol mass concentrations and aerosol size distribution, which has important implications for radiative fluxes and indirect aerosol effects.
Yanru Huo, Mingxue Li, Xueyu Wang, Jianfei Sun, Yuxin Zhou, Yuhui Ma, and Maoxia He
Atmos. Chem. Phys., 24, 12409–12423, https://doi.org/10.5194/acp-24-12409-2024, https://doi.org/10.5194/acp-24-12409-2024, 2024
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This work found that the air–water (A–W) interface and TiO2 clusters promote the oxidation of phenolic compounds (PhCs) to varying degrees compared with the gas phase and bulk water. Some byproducts are more harmful than their parent compounds. This work provides important evidence for the rapid oxidation observed in O3/HO• + PhC experiments at the A–W interface and in mineral dust.
Sijia Lou, Manish Shrivastava, Alexandre Albinet, Sophie Tomaz, Deepchandra Srivastava, Olivier Favez, Huizhong Shen, and Aijun Ding
EGUsphere, https://doi.org/10.5194/egusphere-2024-3269, https://doi.org/10.5194/egusphere-2024-3269, 2024
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PAHs, emitted from incomplete combustion, pose serious health risks due to their carcinogenic properties. This research demonstrates that viscous organic aerosol coatings significantly hinder PAH oxidation, with spatial distributions sensitive to the degradation modelling approach. Our findings underscore the importance of accurately modelling these processes for risk assessments, highlighting the need to consider both fresh and oxidized PAHs in evaluating human exposure and health risks.
Rémy Lapere, Louis Marelle, Pierre Rampal, Laurent Brodeau, Christian Melsheimer, Gunnar Spreen, and Jennie L. Thomas
Atmos. Chem. Phys., 24, 12107–12132, https://doi.org/10.5194/acp-24-12107-2024, https://doi.org/10.5194/acp-24-12107-2024, 2024
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Elongated open-water areas in sea ice, called leads, can release marine aerosols into the atmosphere. In the Arctic, this source of atmospheric particles could play an important role for climate. However, the amount, seasonality and spatial distribution of such emissions are all mostly unknown. Here, we propose a first parameterization for sea spray aerosols emitted through leads in sea ice and quantify their impact on aerosol populations in the high Arctic.
Hanzheng Zhu, Yaman Liu, Man Yue, Shihui Feng, Pingqing Fu, Kan Huang, Xinyi Dong, and Minghuai Wang
EGUsphere, https://doi.org/10.5194/egusphere-2024-2293, https://doi.org/10.5194/egusphere-2024-2293, 2024
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Dust soluble iron deposition from East Asia plays an important role in the marine ecology of the Northwest Pacific. Using the developed model, our findings highlight a dual trend: a decrease in the overall deposition of soluble iron from dust, but an increase in the solubility of the iron itself due to the enhanced atmospheric processing. It underscores the critical roles of both dust emission and atmospheric processing in soluble iron deposition and marine ecology.
Erin Emme and Hannah Horowitz
EGUsphere, https://doi.org/10.5194/egusphere-2024-3147, https://doi.org/10.5194/egusphere-2024-3147, 2024
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There is uncertainty in the sources of Arctic cold season (November-April) sea salt aerosols. Using a chemical transport model and satellite observations, we quantify Arctic-wide sea salt aerosol emissions from fractures in sea ice, called open sea ice leads, and their atmospheric chemistry impacts for the cold season. We show sea ice leads contribute to Arctic sea salt aerosols and bromine, especially in under-observed regions.
Camilo Serrano Damha, Kyle Gorkowski, and Andreas Zuend
EGUsphere, https://doi.org/10.5194/egusphere-2024-2712, https://doi.org/10.5194/egusphere-2024-2712, 2024
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Organic aerosol water content impacts the gas–particle partitioning of semivolatile organics. We used an aerosol thermodynamic model in the GEOS-Chem chemical transport model to efficiently account for organic aerosol water uptake and nonideal mixing. This led to a substantial enhancement in mean organic aerosol mass concentration with respect to GEOS-Chem's most advanced scheme. The water-sensitive scheme could be a valuable tool for reconciling model estimations and field measurements.
Haihui Zhu, Randall V. Martin, Aaron van Donkelaar, Melanie S. Hammer, Chi Li, Jun Meng, Christopher R. Oxford, Xuan Liu, Yanshun Li, Dandan Zhang, Inderjeet Singh, and Alexei Lyapustin
Atmos. Chem. Phys., 24, 11565–11584, https://doi.org/10.5194/acp-24-11565-2024, https://doi.org/10.5194/acp-24-11565-2024, 2024
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Ambient fine particulate matter (PM2.5) contributes to 4 million deaths globally each year. Satellite remote sensing of aerosol optical depth (AOD), coupled with a simulated PM2.5–AOD relationship (η), can provide global PM2.5 estimations. This study aims to understand the spatial patterns and driving factors of η to guide future measurement and modeling efforts. We quantified η globally and regionally and found that its spatial variation is strongly influenced by aerosol composition.
Connor J. Clayton, Daniel R. Marsh, Steven T. Turnock, Ailish M. Graham, Kirsty J. Pringle, Carly L. Reddington, Rajesh Kumar, and James B. McQuaid
Atmos. Chem. Phys., 24, 10717–10740, https://doi.org/10.5194/acp-24-10717-2024, https://doi.org/10.5194/acp-24-10717-2024, 2024
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We demonstrate that strong climate mitigation could improve air quality in Europe; however, less ambitious mitigation does not result in these co-benefits. We use a high-resolution atmospheric chemistry model. This allows us to demonstrate how this varies across European countries and analyse the underlying chemistry. This may help policy-facing researchers understand which sectors and regions need to be prioritised to achieve strong air quality co-benefits of climate mitigation.
Ping-Chieh Huang, Hui-Ming Hung, Hsin-Chih Lai, and Charles C.-K. Chou
Atmos. Chem. Phys., 24, 10759–10772, https://doi.org/10.5194/acp-24-10759-2024, https://doi.org/10.5194/acp-24-10759-2024, 2024
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Models were used to study ways to reduce particulate matter (PM) pollution in Taiwan during winter. After considering various factors, such as physical processes and chemical reactions, we found that reducing NOx or NH3 emissions is more effective at mitigating PM2.5 than reducing SO2 emissions. When considering both efficiency and cost, reducing NH3 emissions seems to be a more suitable policy for the studied environment in Taiwan.
Matthieu Vida, Gilles Foret, Guillaume Siour, Florian Couvidat, Olivier Favez, Gaelle Uzu, Arineh Cholakian, Sébastien Conil, Matthias Beekmann, and Jean-Luc Jaffrezo
Atmos. Chem. Phys., 24, 10601–10615, https://doi.org/10.5194/acp-24-10601-2024, https://doi.org/10.5194/acp-24-10601-2024, 2024
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We simulate 2 years of atmospheric fungal spores over France and use observations of polyols and primary biogenic factors from positive matrix factorisation. The representation of emissions taking into account a proxy for vegetation surface and specific humidity enables us to reproduce very accurately the seasonal cycle of fungal spores. Furthermore, we estimate that fungal spores can account for 20 % of PM10 and 40 % of the organic fraction of PM10 over vegetated areas in summer.
Jiewen Shen, Bin Zhao, Shuxiao Wang, An Ning, Yuyang Li, Runlong Cai, Da Gao, Biwu Chu, Yang Gao, Manish Shrivastava, Jingkun Jiang, Xiuhui Zhang, and Hong He
Atmos. Chem. Phys., 24, 10261–10278, https://doi.org/10.5194/acp-24-10261-2024, https://doi.org/10.5194/acp-24-10261-2024, 2024
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We extensively compare various cluster-dynamics-based parameterizations for sulfuric acid–dimethylamine nucleation and identify a newly developed parameterization derived from Atmospheric Cluster Dynamic Code (ACDC) simulations as being the most reliable one. This study offers a valuable reference for developing parameterizations of other nucleation systems and is meaningful for the accurate quantification of the environmental and climate impacts of new particle formation.
Rubén Soussé-Villa, Oriol Jorba, María Gonçalves Ageitos, Dene Bowdalo, Marc Guevara, and Carlos Pérez García-Pando
EGUsphere, https://doi.org/10.5194/egusphere-2024-2310, https://doi.org/10.5194/egusphere-2024-2310, 2024
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Desert dust forms nitrate coatings as it travels through the atmosphere. However, current models that predict this process vary greatly due to different methods and inaccuracies. We examined how nitrate forms in a global model, focusing on how gases condense on dust, the lifespan of different particles, and the impact of alkalinity. Our findings show that models work best when they consider reversible gas condensation with alkalinity. This should lead to better estimates of climate impacts.
Ludovico Di Antonio, Matthias Beekmann, Guillaume Siour, Vincent Michoud, Christopher Cantrell, Astrid Bauville, Antonin Bergé, Mathieu Cazaunau, Servanne Chevaillier, Manuela Cirtog, Joel F. de Brito, Paola Formenti, Cecile Gaimoz, Olivier Garret, Aline Gratien, Valérie Gros, Martial Haeffelin, Lelia N. Hawkins, Simone Kotthaus, Gael Noyalet, Diana Pereira, Jean-Eudes Petit, Eva Drew Pronovost, Véronique Riffault, Chenjie Yu, Gilles Foret, Jean-François Doussin, and Claudia Di Biagio
EGUsphere, https://doi.org/10.5194/egusphere-2024-2175, https://doi.org/10.5194/egusphere-2024-2175, 2024
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Summer 2022 has been considered a proxy for future climate scenarios, given the registered hot and dry conditions. In this paper, we used the measurements from the ACROSS campaign, occurred over the Paris area in June–July 2022, in addition to observations from existing networks, to evaluate the WRF–CHIMERE model simulation over France and the Ile-de-France regions. Results over the Ile–de–France show to be satisfactory, allowing to explain the gas and aerosol variability at the ACROSS sites.
Wei Li and Yuxuan Wang
Atmos. Chem. Phys., 24, 9339–9353, https://doi.org/10.5194/acp-24-9339-2024, https://doi.org/10.5194/acp-24-9339-2024, 2024
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Droughts immensely increased organic aerosol (OA) in the contiguous United States in summer (1998–2019), notably in the Pacific Northwest (PNW) and Southeast (SEUS). The OA rise in the SEUS is driven by the enhanced formation of epoxydiol-derived secondary organic aerosol due to the increase in biogenic volatile organic compounds and sulfate, while in the PNW, it is caused by wildfires. A total of 10 climate models captured the OA increase in the PNW yet greatly underestimated it in the SEUS.
Zhenyu Zhang, Jing Li, Huizheng Che, Yueming Dong, Oleg Dubovik, Thomas Eck, Pawan Gupta, Brent Holben, Jhoon Kim, Elena Lind, Trailokya Saud, Sachchida Nand Tripathi, and Tong Ying
EGUsphere, https://doi.org/10.5194/egusphere-2024-2533, https://doi.org/10.5194/egusphere-2024-2533, 2024
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We used ground-based remote sensing data from the Aerosol Robotic Network to examine long-term trends in aerosol characteristics. We found aerosol loadings generally decreased globally, and aerosols became more scattering. These changes are closely related to variations in aerosol compositions, such as decreased anthropogenic emissions over East Asia, Europe, and North America, increased anthropogenic source over North India, increased dust activities over the Arabian Peninsula, etc.
Weina Zhang, Jianhua Mai, Zhichao Fan, Yongpeng Ji, Yuemeng Ji, Guiying Li, Yanpeng Gao, and Taicheng An
Atmos. Chem. Phys., 24, 9019–9030, https://doi.org/10.5194/acp-24-9019-2024, https://doi.org/10.5194/acp-24-9019-2024, 2024
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This study reveals heterogeneous oxidation causes further radiative forcing effect (RFE) enhancement of amine–mineral mixed particles. Note that RFE increment is higher under clean conditions than that under polluted conditions, which is contributed to high-oxygen-content products. The enhanced RFE of amine–mineral particles caused by heterogenous oxidation is expected to alleviate warming effects.
Shenglan Jiang, Yan Zhang, Guangyuan Yu, Zimin Han, Junri Zhao, Tianle Zhang, and Mei Zheng
Atmos. Chem. Phys., 24, 8363–8381, https://doi.org/10.5194/acp-24-8363-2024, https://doi.org/10.5194/acp-24-8363-2024, 2024
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This study aims to provide gridded data on sea-wide concentrations, deposition fluxes, and soluble deposition fluxes with detailed source categories of metals using the modified CMAQ model. We developed a monthly emission inventory of six metals – Fe, Al, V, Ni, Zn, and Cu – from terrestrial anthropogenic, ship, and dust sources in East Asia in 2017. Our results reveal the contribution of each source to the emissions, concentrations, and deposition fluxes of metals in the East Asian seas.
Stelios Myriokefalitakis, Matthias Karl, Kim A. Weiss, Dimitris Karagiannis, Eleni Athanasopoulou, Anastasia Kakouri, Aikaterini Bougiatioti, Eleni Liakakou, Iasonas Stavroulas, Georgios Papangelis, Georgios Grivas, Despina Paraskevopoulou, Orestis Speyer, Nikolaos Mihalopoulos, and Evangelos Gerasopoulos
Atmos. Chem. Phys., 24, 7815–7835, https://doi.org/10.5194/acp-24-7815-2024, https://doi.org/10.5194/acp-24-7815-2024, 2024
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A state-of-the-art thermodynamic model has been coupled with the city-scale chemistry transport model EPISODE–CityChem to investigate the equilibrium between the inorganic gas and aerosol phases over the greater Athens area, Greece. The simulations indicate that the formation of nitrates in an urban environment is significantly affected by local nitrogen oxide emissions, as well as ambient temperature, relative humidity, photochemical activity, and the presence of non-volatile cations.
Rui Li, Yining Gao, Lijia Zhang, Yubing Shen, Tianzhao Xu, Wenwen Sun, and Gehui Wang
Atmos. Chem. Phys., 24, 7623–7636, https://doi.org/10.5194/acp-24-7623-2024, https://doi.org/10.5194/acp-24-7623-2024, 2024
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A three-stage model was developed to obtain the global maps of reactive nitrogen components during 2000–2100. The results implied that cross-validation R2 values of four species showed satisfactory performance (R2 > 0.55). Most reactive nitrogen components, except NH3, in China showed increases during 2000–2013. In the future scenarios, SSP3-7.0 (traditional-energy scenario) and SSP1-2.6 (carbon neutrality scenario) showed the highest and lowest reactive nitrogen component concentrations.
Fei Ye, Jingyi Li, Yaqin Gao, Hongli Wang, Jingyu An, Cheng Huang, Song Guo, Keding Lu, Kangjia Gong, Haowen Zhang, Momei Qin, and Jianlin Hu
Atmos. Chem. Phys., 24, 7467–7479, https://doi.org/10.5194/acp-24-7467-2024, https://doi.org/10.5194/acp-24-7467-2024, 2024
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Naphthalene (Nap) and methylnaphthalene (MN) are key precursors of secondary organic aerosol (SOA), yet their sources and sinks are often inadequately represented in air quality models. In this study, we incorporated detailed emissions, gas-phase chemistry, and SOA parameterization of Nap and MN into CMAQ to address this issue. The findings revealed remarkably high SOA formation potentials for these compounds despite their low emissions in the Yangtze River Delta region during summer.
Vy Dinh Ngoc Thuy, Jean-Luc Jaffrezo, Ian Hough, Pamela A. Dominutti, Guillaume Salque Moreton, Grégory Gille, Florie Francony, Arabelle Patron-Anquez, Olivier Favez, and Gaëlle Uzu
Atmos. Chem. Phys., 24, 7261–7282, https://doi.org/10.5194/acp-24-7261-2024, https://doi.org/10.5194/acp-24-7261-2024, 2024
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The capacity of particulate matter (PM) to generate reactive oxygen species in vivo is represented by oxidative potential (OP). This study focuses on finding the appropriate model to evaluate the oxidative character of PM sources in six sites using the PM sources and OP. Eight regression techniques are introduced to assess the OP of PM. The study highlights the importance of selecting a model according to the input data characteristics and establishes some recommendations for the procedure.
Natalie M. Mahowald, Longlei Li, Julius Vira, Marje Prank, Douglas S. Hamilton, Hitoshi Matsui, Ron L. Miller, Louis Lu, Ezgi Akyuz, Daphne Meidan, Peter G. Hess, Heikki Lihavainen, Christine Wiedinmyer, Jenny Hand, Maria Grazia Alaimo, Célia Alves, Andres Alastuey, Paulo Artaxo, Africa Barreto, Francisco Barraza, Silvia Becagli, Giulia Calzolai, Shankararaman Chellam, Ying Chen, Patrick Chuang, David D. Cohen, Cristina Colombi, Evangelia Diapouli, Gaetano Dongarra, Konstantinos Eleftheriadis, Johann Engelbrecht, Corinne Galy-Lacaux, Cassandra Gaston, Dario Gomez, Yenny González Ramos, Roy M. Harrison, Chris Heyes, Barak Herut, Philip Hopke, Christoph Hüglin, Maria Kanakidou, Zsofia Kertesz, Zbigniew Klimont, Katriina Kyllönen, Fabrice Lambert, Xiaohong Liu, Remi Losno, Franco Lucarelli, Willy Maenhaut, Beatrice Marticorena, Randall V. Martin, Nikolaos Mihalopoulos, Yasser Morera-Gomez, Adina Paytan, Joseph Prospero, Sergio Rodríguez, Patricia Smichowski, Daniela Varrica, Brenna Walsh, Crystal Weagle, and Xi Zhao
EGUsphere, https://doi.org/10.5194/egusphere-2024-1617, https://doi.org/10.5194/egusphere-2024-1617, 2024
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Aerosol particles are an important part of the Earth system, but their concentrations are spatially and temporally heterogeneous, as well as variable in size and composition. Here we present a new compilation of PM2.5 and PM10 aerosol observations, focusing on the spatial variability across different observational stations, including composition, and demonstrate a method for comparing the datasets to model output.
Ming Chu, Xing Wei, Shangfei Hai, Yang Gao, Huiwang Gao, Yujiao Zhu, Biwu Chu, Nan Ma, Juan Hong, Yele Sun, and Xiaohong Yao
Atmos. Chem. Phys., 24, 6769–6786, https://doi.org/10.5194/acp-24-6769-2024, https://doi.org/10.5194/acp-24-6769-2024, 2024
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We used a 20-bin WRF-Chem model to simulate NPF events in the NCP during a three-week observational period in the summer of 2019. The model was able to reproduce the observations during June 29–July 6, which was characterized by a high frequency of NPF occurrence.
Haoqi Wang, Xiao Tian, Wanting Zhao, Jiacheng Li, Haoyu Yu, Yinchang Feng, and Shaojie Song
Atmos. Chem. Phys., 24, 6583–6592, https://doi.org/10.5194/acp-24-6583-2024, https://doi.org/10.5194/acp-24-6583-2024, 2024
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pH is a key property of ambient aerosols, which affect many atmospheric processes. As aerosol pH is a non-conservative parameter, diverse averaging metrics and temporal resolutions may influence the pH values calculated by thermodynamic models. This technical note seeks to quantitatively evaluate the average pH using varied metrics and resolutions. The ultimate goal is to establish standardized reporting practices in future research endeavors.
Jiwon Choi, Myoseon Jang, and Spencer Blau
Atmos. Chem. Phys., 24, 6567–6582, https://doi.org/10.5194/acp-24-6567-2024, https://doi.org/10.5194/acp-24-6567-2024, 2024
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Persistent phenoxy radical (PPR), formed by phenol gas oxidation and its aqueous reaction, catalytically destroys O3 and retards secondary organic aerosol (SOA) growth. Explicit gas mechanisms including the formation of PPR and low-volatility products from the oxidation of phenol or benzene are applied to the UNIPAR model to predict SOA mass via multiphase reactions of precursors. Aqueous reactions of reactive organics increase SOA mass but retard SOA growth via heterogeneously formed PPR.
Yang Yang, Shaoxuan Mou, Hailong Wang, Pinya Wang, Baojie Li, and Hong Liao
Atmos. Chem. Phys., 24, 6509–6523, https://doi.org/10.5194/acp-24-6509-2024, https://doi.org/10.5194/acp-24-6509-2024, 2024
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The variations in anthropogenic aerosol concentrations and source contributions and their subsequent radiative impact in major emission regions during historical periods are quantified based on an aerosol-tagging system in E3SMv1. Due to the industrial development and implementation of economic policies, sources of anthropogenic aerosols show different variations, which has important implications for pollution prevention and control measures and decision-making for global collaboration.
Maegan A. DeLessio, Kostas Tsigaridis, Susanne E. Bauer, Jacek Chowdhary, and Gregory L. Schuster
Atmos. Chem. Phys., 24, 6275–6304, https://doi.org/10.5194/acp-24-6275-2024, https://doi.org/10.5194/acp-24-6275-2024, 2024
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This study presents the first explicit representation of brown carbon aerosols in the GISS ModelE Earth system model (ESM). Model sensitivity to a range of brown carbon parameters and model performance compared to AERONET and MODIS retrievals of total aerosol properties were assessed. A summary of best practices for incorporating brown carbon into ModelE is also included.
Chuanyang Shen, Xiaoyan Yang, Joel Thornton, John Shilling, Chenyang Bi, Gabriel Isaacman-VanWertz, and Haofei Zhang
Atmos. Chem. Phys., 24, 6153–6175, https://doi.org/10.5194/acp-24-6153-2024, https://doi.org/10.5194/acp-24-6153-2024, 2024
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In this work, a condensed multiphase isoprene oxidation mechanism was developed to simulate isoprene SOA formation from chamber and field studies. Our results show that the measured isoprene SOA mass concentrations can be reasonably reproduced. The simulation results indicate that multifunctional low-volatility products contribute significantly to total isoprene SOA. Our findings emphasize that the pathways to produce these low-volatility species should be considered in models.
Alice Maison, Lya Lugon, Soo-Jin Park, Alexia Baudic, Christopher Cantrell, Florian Couvidat, Barbara D'Anna, Claudia Di Biagio, Aline Gratien, Valérie Gros, Carmen Kalalian, Julien Kammer, Vincent Michoud, Jean-Eudes Petit, Marwa Shahin, Leila Simon, Myrto Valari, Jérémy Vigneron, Andrée Tuzet, and Karine Sartelet
Atmos. Chem. Phys., 24, 6011–6046, https://doi.org/10.5194/acp-24-6011-2024, https://doi.org/10.5194/acp-24-6011-2024, 2024
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This study presents the development of a bottom-up inventory of urban tree biogenic emissions. Emissions are computed for each tree based on their location and characteristics and are integrated in the regional air quality model WRF-CHIMERE. The impact of these biogenic emissions on air quality is quantified for June–July 2022. Over Paris city, urban trees increase the concentrations of particulate organic matter by 4.6 %, of PM2.5 by 0.6 %, and of ozone by 1.0 % on average over 2 months.
Tommaso Galeazzo, Bernard Aumont, Marie Camredon, Richard Valorso, Yong B. Lim, Paul J. Ziemann, and Manabu Shiraiwa
Atmos. Chem. Phys., 24, 5549–5565, https://doi.org/10.5194/acp-24-5549-2024, https://doi.org/10.5194/acp-24-5549-2024, 2024
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Secondary organic aerosol (SOA) derived from n-alkanes is a major component of anthropogenic particulate matter. We provide an analysis of n-alkane SOA by chemistry modeling, machine learning, and laboratory experiments, showing that n-alkane SOA adopts low-viscous semi-solid or liquid states. Our results indicate few kinetic limitations of mass accommodation in SOA formation, supporting the application of equilibrium partitioning for simulating n-alkane SOA in large-scale atmospheric models.
Bin Luo, Yuqiang Zhang, Tao Tang, Hongliang Zhang, Jianlin Hu, Jiangshan Mu, Wenxing Wang, and Likun Xue
EGUsphere, https://doi.org/10.5194/egusphere-2024-974, https://doi.org/10.5194/egusphere-2024-974, 2024
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India is facing a severe air pollution crisis that poses significant health risks, particularly from PM2.5 and O3. Our study reveals rising levels of both pollutants from 1995 to 2014, leading to increased premature mortality. While anthropogenic emissions play a significant role, biomass burning also impacts air quality, in particular seasons and regions in India. This study highlights the urgent need for localized policies to protect public health amid escalating environmental challenges.
Lukáš Bartík, Peter Huszár, Jan Karlický, Ondřej Vlček, and Kryštof Eben
Atmos. Chem. Phys., 24, 4347–4387, https://doi.org/10.5194/acp-24-4347-2024, https://doi.org/10.5194/acp-24-4347-2024, 2024
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The presented study deals with the attribution of fine particulate matter (PM2.5) concentrations to anthropogenic emissions over Central Europe using regional-scale models. It calculates the present-day contributions of different emissions sectors to concentrations of PM2.5 and its secondary components. Moreover, the study investigates the effect of chemical nonlinearities by using multiple source attribution methods and secondary organic aerosol calculation methods.
Rui Wang, Yang Cheng, Shasha Chen, Rongrong Li, Yue Hu, Xiaokai Guo, Tianlei Zhang, Fengmin Song, and Hao Li
Atmos. Chem. Phys., 24, 4029–4046, https://doi.org/10.5194/acp-24-4029-2024, https://doi.org/10.5194/acp-24-4029-2024, 2024
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We used quantum chemical calculations, Born–Oppenheimer molecular dynamics simulations, and the ACDC kinetic model to characterize SO3–H2SO4 interaction in the gas phase and at the air–water interface and to study the effect of H2S2O7 on H2SO4–NH3-based clusters. The work expands our understanding of new pathways for the loss of SO3 in acidic polluted areas and helps reveal some missing sources of NPF in metropolitan industrial regions and understand the atmospheric organic–sulfur cycle better.
Hao Yang, Lei Chen, Hong Liao, Jia Zhu, Wenjie Wang, and Xin Li
Atmos. Chem. Phys., 24, 4001–4015, https://doi.org/10.5194/acp-24-4001-2024, https://doi.org/10.5194/acp-24-4001-2024, 2024
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The present study quantifies the response of aerosol–radiation interaction (ARI) to anthropogenic emission reduction from 2013 to 2017, with the main focus on the contribution to changed O3 concentrations over eastern China both in summer and winter using the WRF-Chem model. The weakened ARI due to decreased anthropogenic emission aggravates the summer (winter) O3 pollution by +0.81 ppb (+0.63 ppb), averaged over eastern China.
Margaret R. Marvin, Paul I. Palmer, Fei Yao, Mohd Talib Latif, and Md Firoz Khan
Atmos. Chem. Phys., 24, 3699–3715, https://doi.org/10.5194/acp-24-3699-2024, https://doi.org/10.5194/acp-24-3699-2024, 2024
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We use an atmospheric chemistry model to investigate aerosols emitted from fire activity across Southeast Asia. We find that the limited nature of measurements in this region leads to large uncertainties that significantly hinder the model representation of these aerosols and their impacts on air quality. As a result, the number of monthly attributable deaths is underestimated by as many as 4500, particularly in March at the peak of the mainland burning season.
Julie Camman, Benjamin Chazeau, Nicolas Marchand, Amandine Durand, Grégory Gille, Ludovic Lanzi, Jean-Luc Jaffrezo, Henri Wortham, and Gaëlle Uzu
Atmos. Chem. Phys., 24, 3257–3278, https://doi.org/10.5194/acp-24-3257-2024, https://doi.org/10.5194/acp-24-3257-2024, 2024
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Fine particle (PM1) pollution is a major health issue in the city of Marseille, which is subject to numerous pollution sources. Sampling carried out during the summer enabled a fine characterization of the PM1 sources and their oxidative potential, a promising new metric as a proxy for health impact. PM1 came mainly from combustion sources, secondary ammonium sulfate, and organic nitrate, while the oxidative potential of PM1 came from these sources and from resuspended dust in the atmosphere.
Yuemeng Ji, Zhang Shi, Wenjian Li, Jiaxin Wang, Qiuju Shi, Yixin Li, Lei Gao, Ruize Ma, Weijun Lu, Lulu Xu, Yanpeng Gao, Guiying Li, and Taicheng An
Atmos. Chem. Phys., 24, 3079–3091, https://doi.org/10.5194/acp-24-3079-2024, https://doi.org/10.5194/acp-24-3079-2024, 2024
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The formation mechanisms for secondary brown carbon (SBrC) contributed by multifunctional reduced nitrogen compounds (RNCs) remain unclear. Hence, from combined laboratory experiments and quantum chemical calculations, we investigated the heterogeneous reactions of glyoxal (GL) with multifunctional RNCs, which are driven by four-step indirect nucleophilic addition reactions. Our results show a possible missing source for SBrC formation on urban, regional, and global scales.
Cited articles
Aas, W. and Breivik, K.: Heavy metals and POP measurements, 2010, EMEP/CCC, Kjeller, 2012.
Andersson, J. T. and Achten, C.: Time to say goodbye to the 16 EPA PAHs? Toward an up-to-date use of PACs for environmental purposes, Polycycl. Aromat. Comp., 35, 330–354, https://doi.org/10.1080/10406638.2014.991042, 2015.
Atkinson, R. and Arey, J.: Atmospheric chemistry of gas-phase polycyclic aromatic hydrocarbons: formation of atmospheric mutagens, Environ. Health Persp., 102, 117–126, 1994.
Aulinger, A., Matthias, V., and Quante, M.: Introducing a partitioning mechanism for PAHs into the Community Multiscale Air Quality Modeling System and its application to simulating the transport of benzo(a)pyrene over Europe, J. Appl. Meteor. Climatol., 46, 1718–1730, https://doi.org/10.1175/2007JAMC1395.1, 2007.
Aulinger, A., Matthias, V., and Quante, M.: An approach to temporally disaggregate benzo(a)pyrene emissions and their application to a 3D Eulerian atmospheric chemistry transport model, Water Air Soil Pollut., 216, 1–13, https://doi.org/10.1007/s11270-010-0559-x, 2011.
Bärring, H., Bucheli, T. D., Broman, D., and Gustafsson, Ö.: Soot–water distribution coefficients for polychlorinated dibenzo-p-dioxins, polychlorinated dibenzofurans and polybrominated diphenylethers determined with the soot cosolvency-column method, Chemosphere, 49, 515–523, https://doi.org/10.1016/s0045-6535(02)00389-2, 2002.
Bewersdorff, I., Aulinger, A., Matthias, V., and Quante, M.: The effect of temporal resolution of PAH emission data on transport and deposition patterns simulated with the Community Multiscale Air Quality modelling system (CMAQ), Meteorol. Z., 18, 41–53, https://doi.org/10.1127/0941-2948/2009/351, 2009.
Beyer, A., Mackay, D., Matthies, M., Wania, F., and Webster, E.: Assessing long-range transport potential of persistent organic pollutants, Environ. Sci. Technol., 34, 699–703, https://doi.org/10.1021/es990207w, 2000.
Bieser, J., Aulinger, A., Matthias, V., Quante, M., and Builtjes, P.: SMOKE for Europe – adaptation, modification and evaluation of a comprehensive emission model for Europe, Geosci. Model. Dev., 4, 47–68, https://doi.org/10.5194/gmd-4-47-2011, 2011.
Bieser, J., Aulinger, A., Matthias, V., and Quante, M.: Impact of emission reductions between 1980 and 2020 on atmospheric benzo[a]pyrene concentrations over Europe, Water Air Soil Pollut., 223, 1393–1414, https://doi.org/10.1007/s11270-011-0953-z, 2012.
Binkowski, F. S.: Models-3 Community Multiscale Air Quality (CMAQ) model aerosol component, 1. Model description, J. Geophys. Res., 108, 4183, https://doi.org/10.1029/2001JD001409, 2003.
Bond, T. C. and Bergstrom, R. W.: Light absorption by carbonaceous particles: An investigative review, Aerosol. Sci. Tech., 40, 27–67, https://doi.org/10.1080/02786820500421521, 2006.
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, 2006.
Byun, D. W.: Dynamically consistent formulations in meteorological and air quality models for multiscale atmospheric studies, Part II: Mass conservation issues, J. Atmos. Sci., 56, 3789–3807, https://doi.org/10.1175/1520-0469(1999)056<3789:DCFIMA>2.0.CO;2, 1999a.
Byun, D. W.: Dynamically consistent formulations in meteorological and air quality models for multiscale atmospheric studies, Part II: Mass conservation issues, J. Atmos. Sci., 56, 3808–3820, https://doi.org/10.1175/1520-0469(1999)056<3808:DCFIMA>2.0.CO;2, 1999b.
Byun, D. W. and Ching, J.: Science algorithms of the EPA Models-3 community multiscale air quality (CMAQ) modeling system, US Environmental Protection Agency, Office of Research and Development Washington, DC, USA, Washington, DC 20460., 1999.
Carslaw, D. C. and Ropkins, K.: openair – An R package for air quality data analysis, Environ. Model. Softw., 27/28, 52–61, https://doi.org/10.1016/j.envsoft.2011.09.008, 2012.
Chang, J., Middleton, P., Stockwell, W., Pleim, J. E., Lansford, H., Binkowski, F. S., Seaman, N., Staufer, D., and Madronic, S.: The regional acid deposition model and engineering model, in: Acid Deposition State of Science and Technology, 1986.
Cooter, E. J. and Hutzell, W. T.: A regional atmospheric fate and transport model for atrazine, 1. Development and implementation, Environ. Sci. Technol., 36, 4091–4098, https://doi.org/10.1021/es011371y, 2002.
Dachs, J. and Eisenreich, S. J.: Adsorption onto aerosol soot carbon dominates gas-particle partitioning of polycyclic aromatic hydrocarbons, Environ. Sci. Technol., 34, 3690–3697, https://doi.org/10.1021/es991201, 2000.
Dachs, J., Ribes, S., van Drooge, B., Grimalt, J., Eisenreich, S. J., and Gustafsson, Ö.: Response to the comment on “Influence of soot carbon on the soil-air partitioning of polycyclic aromatic hydrocarbons”, Environ. Sci. Technol., 38, 1624–1625, https://doi.org/10.1021/es0307118, 2004.
de Maagd, P., Hulscher, Ten, D., Van den Heuvel, H., Opperhuizen, A., and Sijm, D.: Physicochemical properties of polycyclic aromatic hydrocarbons: Aqueous solubilities, n-octanol/water partition coefficients, and Henry's law constants, Environ. Toxicol. Chem., 17, 251–257, 1998.
Denier van der Gon, H. A. C., Visschedijk, A. J. H., and Bolscher, M. V. H.: Study to the effectiveness of the UNECE Persistent Organic Pollutants (POP), Protocol and cost of additional measures, Phase II: Estimated emission reduction and cost of options for a possible revision of the POP Protocol, TNO, 2006.
de Smet, P., Horálek, J., Coňková, M., Kurfürst, P., de Leeuw, F., and Denby, B.: European air quality maps of ozone and PM10 for 2006 and their uncertainty analysis, ETAC/ACC Technical Paper 2008/8, 2009.
DETR: Polycyclic Aromatic Hydrocarbons, Department of the Environment, Transport and the Regions Expert Panel on Air Quality Standards, Stationery Office, London, 2009.
Diamond, M. L. and Hodge, E.: Urban Contaminant Dynamics: From Source to Effect, Environ. Sci. Technol., 41, 3796–3800, https://doi.org/10.1021/es072542n, 2007.
EC: Directive 2004/107/EC of the European Parliament and of the Council, Official Journal of the European Union, 2004.
EEA: Status of black carbon monitoring in ambient air in Europe, European Environment Agency, European Environment Agency, 2013.
Fernandez, P., Grimalt, J. O., and Vilanova, R. M.: Atmospheric gas-particle partitioning of polycyclic aromatic hydrocarbons in high mountain regions of Europe, Environ. Sci. Technol., 36, 1162–1168, https://doi.org/10.1021/es010190t, 2002.
Finizio, A., Mackay, D., Bidleman, T., and Harner, T.: Octanol-air partition coefficient as a predictor of partitioning of semi-volatile organic chemicals to aerosols, Atmos. Environ., 31, 2289–2296, https://doi.org/10.1016/S1352-2310(97)00013-7, 1997.
Finlayson-Pitts, B. J. and Pitts Jr., J. N.: Chemistry of the Upper and Lower Atmosphere, Academic Press, 1999.
Friedman, C. L. and Selin, N. E.: Long-range atmospheric transport of polycyclic aromatic hydrocarbons: a global 3-D model analysis including evaluation of arctic sources, Environ. Sci. Technol., 46, 9501–9510, https://doi.org/10.1021/es301904d, 2012.
Friedman, C. L., Pierce, J. R., and Selin, N. E.: Assessing the influence of secondary organic versus primary carbonaceous aerosols on long-range atmospheric polycyclic aromatic hydrocarbon transport, Environ. Sci. Technol., 48, 3293–3302, https://doi.org/10.1021/es405219r, 2014.
Galarneau, E., Makar, P. A., Zheng, Q., Narayan, J., Zhang, J., Moran, M. D., Bari, M. A., Pathela, S., Chen, A., and Chlumsky, R.: PAH concentrations simulated with the AURAMS-PAH chemical transport model over Canada and the USA, Atmos. Chem. Phys., 14, 4065–4077, https://doi.org/10.5194/acp-14-4065-2014, 2014.
Goss, K.-U.: Comment on “Influence of soot carbon on the soil-air partitioning of polycyclic aromatic hydrocarbon”, Environ. Sci. Technol., 38, 1622–1623, https://doi.org/10.1021/es0301370, 2004.
Götz, C. W., Scheringer, M., MacLeod, M., Roth, C. M., and Hungerbühler, K.: Alternative approaches for modeling gas-particle partitioning of semivolatile organic chemicals: model development and comparison, Environ. Sci. Technol., 41, 1272–1278, https://doi.org/10.1021/es060583y, 2007.
Grell, G. A.: Prognostic Evaluation of Assumptions Used by Cumulus Parameterizations, Mon. Weather Rev., 121, 764–787, https://doi.org/10.1175/1520-0493(1993)121<0764:PEOAUB>2.0.CO;2, 1993.
Grell, G. A. and Devenyi, D.: A generalized approach to parameterizing convection combining ensemble and data assimilation techniques, Geophys. Res. Lett., 29, 1693, https://doi.org/10.1029/2002GL015311, 2002.
Guerreiro, C., Horálek, J., and De Leeuw, F.: Benzo(a)pyrene in Europe: Ambient air concentrations, population exposure and health effects, Environ. Pollut., 214, 657–667, https://doi.org/10.1016/j.envpol.2016.04.081, 2016a.
Guerreiro, C., Horálek, J., de Leeuw, F., and Couvidat, F.: Mapping ambient concentrations of benzo(a)pyrene in Europe, European Topic Centre on Air Pollution and Climate Change Mitigation, Technical Paper 2014/6, 2016b.
Gusev, A., Mantseva, E., and Shatalov, V.: Regional multicompartment model MSCE-POP, MSC-E Technical Report, 2005.
Halsall, C. J., Sweetman, A. J., Barrie, L. A., and Jones, K. C.: Modelling the behaviour of PAHs during atmospheric transport from the UK to the Arctic, Atmos. Environ., 35, 255–267, https://doi.org/10.1016/S1352-2310(00)00195-3, 2001.
Hansen, K. M., Halsall, C. J., and Christensen, J. H.: A dynamic model to study the exchange of gas-phase persistent organic pollutants between air and a seasonal snowpack, Environ. Sci. Technol., 40, 2644–2652, https://doi.org/10.1021/es051685b, 2006.
Harner, T. and Bidleman, T. F.: Octanol-air partition coefficient for describing particle/gas partitioning of aromatic compounds in urban air, Environ. Sci. Technol., 32, 1494–1502, https://doi.org/10.1021/es970890r, 1998.
Iacono, M. J., Delamere, J. S., Mlawer, E. J., Shephard, M. W., Clough, S. A., and Collins, W. D.: Radiative forcing by long-lived greenhouse gases: Calculations with the AER radiative transfer models, J. Geophys. Res-Atmos., 113, D13103, https://doi.org/10.1029/2008JD009944, 2008.
Inomata, Y., Kajino, M., Sato, K., Ohara, T., Kurokawa, J.-I., Ueda, H., Tang, N., Hayakawa, K., Ohizumi, T., and Akimoto, H.: Emission and atmospheric transport of particulate PAHs in Northeast Asia, Environ. Sci. Technol., 46, 4941–4949, https://doi.org/10.1021/es300391w, 2012.
Jonker, M. T. O. and Koelmans, A. A.: Sorption of polycyclic aromatic hydrocarbons and polychlorinated biphenyls to soot and soot-like materials in the aqueous environment: Mechanistic considerations, Environ. Sci. Technol., 36, 3725–3734, https://doi.org/10.1021/es020019x, 2002.
Junge, C. E.: Fate of pollutants in the air and water environment, edited by: Suffet, I. H., Wiley, New York, 1977.
Kahan, T. F. and Donaldson, D. J.: Heterogeneous ozonation kinetics of polycyclic aromatic hydrocarbons on organic films, Atmos. Environ., 40, 3448–3459, https://doi.org/10.1016/j.atmosenv.2006.02.004, 2006.
Kaiser, J. C., Riemer, N., and Knopf, D. A.: Detailed heterogeneous oxidation of soot surfaces in a particle-resolved aerosol model, Atmos. Chem. Phys., 11, 4505–4520, https://doi.org/10.5194/acp-11-4505-2011, 2011.
Kalberer, M., Paulsen, D., Sax, M., Steinbacher, M., Dommen, J., Prevot, A. S. H., Fisseha, R., Weingartner, E., Frankevich, V., Zenobi, R., and Baltensperger, U.: Identification of polymers as major components of atmospheric organic aerosols, Science, 303, 1659–1662, https://doi.org/10.1126/science.1092185, 2004.
Keyte, I. J., Harrison, R. M., and Lammel, G.: Chemical reactivity and long-range transport potential of polycyclic aromatic hydrocarbons – a review, Chem. Soc. Rev., 42, 9333–9391, https://doi.org/10.1039/C3CS60147A, 2013.
Kim, Y. P., Seinfeld, J. H., and Saxena, P.: Atmospheric gas-aerosol equilibrium, I. Thermodynamic model, Aerosol Sci. Tech., 19, 157–181, https://doi.org/10.1080/02786829308959628, 1993.
Kwamena, N.-O. A., Thornton, J. A., and Abbatt, J. P. D.: Kinetics of surface-bound benzo[a]pyrene and ozone on solid organic and salt aerosols, J. Phys. Chem. A, 108, 11626–11634, https://doi.org/10.1021/jp046161x, 2004.
Kwamena, N.-O. A., Clarke, J. P., Kahan, T. F., Diamond, M. L., and Donaldson, D. J.: Assessing the importance of heterogeneous reactions of polycyclic aromatic hydrocarbons in the urban atmosphere using the Multimedia Urban Model, Atmos. Environ., 41, 37–50, https://doi.org/10.1016/j.atmosenv.2006.08.016, 2007.
Lammel, G., Sehili, A. M., Bond, T. C., Feichter, J., and Grassl, H.: Gas/particle partitioning and global distribution of polycyclic aromatic hydrocarbons – A modelling approach, Chemosphere, 76, 98–106, https://doi.org/10.1016/j.chemosphere.2009.02.017, 2009.
Lammel, G., Klánová, J., Ilić, P., Kohoutek, J., Gasić, B., Kovacić, I., and Škrdlíková, L.: Polycyclic aromatic hydrocarbons in air on small spatial and temporal scales – II. Mass size distributions and gas-particle partitioning, Atmos. Environ., 44, 5022–5027, https://doi.org/10.1016/j.atmosenv.2010.08.001, 2010.
Lammel, G., Heil, A., Stemmler, I., Dvorská, A., and Klánová, J.: On the contribution of biomass burning to POPs (PAHs and PCDDs) in air in Africa, Environ. Sci. Technol., 47, 11616–11624, https://doi.org/10.1021/es401499q, 2013.
Lang, C., Tao, S., Zhang, G., Fu, J., and Simonich, S.: Outflow of polycyclic aromatic hydrocarbons from Guangdong, Southern China, Environ. Sci. Technol., 41, 8370–8375, https://doi.org/10.1021/es071853v, 2007.
Lang, C., Tao, S., Liu, W., Zhang, Y., and Simonich, S.: Atmospheric transport and outflow of polycyclic aromatic hydrocarbons from China, Environ. Sci. Technol., 42, 5196–5201, https://doi.org/10.1021/es800453n, 2008.
Liu, S., Tao, S., Liu, W., Liu, Y., Dou, H., Zhao, J., Wang, L., Wang, J., Tian, Z., and Gao, Y.: Atmospheric polycyclic aromatic hydrocarbons in North China: A winter-time study, Environ. Sci. Technol., 41, 8256–8261, https://doi.org/10.1021/es0716249, 2007.
Lohmann, R. and Lammel, G.: Adsorptive and absorptive contributions to the gas-particle partitioning of polycyclic aromatic hydrocarbons: state of knowledge and recommended parametrization for modeling, Environ. Sci. Technol., 38, 3793–3803, https://doi.org/10.1021/es035337q, 2004.
Lohmann, R., Lee, R. G. M., Abbott, J., Coleman, P., and Jones, K. C.: Verifying emission factors and national POPs emission inventories for the UK using measurements and modelling at two rural locations, J. Environ. Monit., 8, 79–88, https://doi.org/10.1039/B511399G, 2006.
Mantseva, E., Dutchak, S., Rozovskaya, O., and Shatalov, V.: EMEP contribution to the preparatory work for the review of the CLRTAP Protocol on Persistent Organic Pollutants, EMEP MSC-E Information Note, 2004.
Mathur, R., Yu, S., Kang, D., and Schere, K. L.: Assessment of the wintertime performance of developmental particulate matter forecasts with the Eta-Community Multiscale Air Quality modeling system, J. Geophys. Res., 113, D0230315, https://doi.org/10.1029/2007JD008580, 2008.
Matthias, V., Aulinger, A., and Quante, M.: Adapting CMAQ to investigate air pollution in north sea coastal regions, Environ. Model. Softw., 23, 356–368, https://doi.org/10.1016/j.envsoft.2007.04.010, 2008.
Matthias, V., Aulinger, A., and Quante, M.: CMAQ simulations of the benzo(a)pyrene distribution over Europe for 2000 and 2001, Atmos. Environ., 43, 4078–4086, https://doi.org/10.1016/j.atmosenv.2009.04.058, 2009.
Meng, F., Zhang, B., Gbor, P., Wen, D., Yang, F., Shi, C., Aronson, J., and Sloan, J.: Models for gas/particle partitioning, transformation and air/water surface exchange of PCBs and PCDD/Fs in CMAQ, Atmos. Environ., 41, 9111–9127, https://doi.org/10.1016/j.atmosenv.2007.08.009, 2007.
Milbrandt, J. A. and Yau, M. K.: A multimoment bulk microphysics parameterization, Part I: Analysis of the role of the spectral shape parameter, J. Atmos. Sci., 62, 3051–3064, https://doi.org/10.1175/JAS3535.1, 2005a.
Milbrandt, J. A. and Yau, M. K.: A multimoment bulk microphysics parameterization, Part II: A proposed three-moment closure and scheme description, J. Atmos. Sci., 62, 3065–3081, https://doi.org/10.1175/JAS3535.1, 2005b.
Milford, C., Fernández-Camacho, R., la Campa, de, A. M. S., Rodríguez, S., Castell, N., Marrero, C., Bustos, J. J., la Rosa, de, J. D., and Stein, A. F.: Black Carbon aerosol measurements and simulation in two cities in south-west Spain, Atmos. Environ., 126, 55–65, https://doi.org/10.1016/j.atmosenv.2015.11.026, 2016.
Nenes, A., Pandis, S. N., and Pilinis, C.: ISORROPIA: A new thermodynamic equilibrium model for multiphase multicomponent inorganic aerosols, Aquat. Geochem., 4, 123–152, https://doi.org/10.1023/A:1009604003981, 1998.
Ngabe, B. and Poissant, L.: Polycyclic aromatic hydrocarbons in the air in the St. Lawrence Basin (Quebec), Environ. Sci. Technol., 37, 2094–2099, https://doi.org/10.1021/es0210345, 2003.
Odabasi, M., Cetin, E., and Sofuoglu, A.: Determination of octanol–air partition coefficients and supercooled liquid vapor pressures of PAHs as a function of temperature: Application to gas–particle partitioning in an urban atmosphere, Atmos. Environ., 40, 6615–6625, https://doi.org/10.1016/j.atmosenv.2006.05.051, 2006.
Offenberg, J. H. and Baker, J. E.: Aerosol size distributions of polycyclic aromatic hydrocarbons in urban and over-water atmospheres, Environ. Sci. Technol., 33, 3324–3331, https://doi.org/10.1021/es990089c, 1999.
Otte, T. L. and Pleim, J. E.: The Meteorology-Chemistry Interface Processor (MCIP) for the CMAQ modeling system: updates through MCIPv3.4.1, Geosci. Model Dev., 3, 243–256, https://doi.org/10.5194/gmd-3-243-2010, 2010.
Pacyna, J. M., Breivik, K., Münch, J., and Fudala, J.: European atmospheric emissions of selected persistent organic pollutants, 1970–1995, Atmos. Environ., 37, 119–131, https://doi.org/10.1016/S1352-2310(03)00240-1, 2003.
Pankow, J. F.: Review and comparative-analysis of the theories on partitioning between the gas and aerosol particulate phases in the atmosphere, Atmos. Environ., 21, 2275–2283, https://doi.org/10.1016/0004-6981(87)90363-5, 1987.
Pankow, J. F.: An absorption model of gas/particle partitioning of organic compounds in the atmosphere, Atmos. Environ., 28, 185–188, https://doi.org/10.1016/1352-2310(94)90093-0, 1994.
Pankow, J. F.: Further discussion of the octanol/air partition coefficient Koa as a correlating parameter for gas/particle partitioning coefficients, Atmos. Environ., 32, 1493–1497, https://doi.org/10.1016/S1352-2310(97)00383-X, 1998.
Pankow, J. F.: An absorption model of the gas/aerosol partitioning involved in the formation of secondary organic aerosol, Atmos. Environ., 41, 75–79, https://doi.org/10.1016/j.atmosenv.2007.10.060, 2007.
Pedersen, D. U., Durant, J. L., Penman, B. W., Crespi, C. L., Hemond, H. F., Lafleur, A. L., and Cass, G. R.: Human cell mutagens in respirable airborne particles from the Northeastern United States, 1. Mutagenicity of fractionated samples, Environ. Sci. Technol., 38, 682–689, https://doi.org/10.1021/es0347282, 2004.
Pedersen, D. U., Durant, J. L., Taghizadeh, K., Hemond, H. F., Lafleur, A. L., and Cass, G. R.: Human cell mutagens in respirable airborne particles from the Northeastern United States, 2. Quantification of mutagens and other organic compounds, Environ. Sci. Technol., 39, 9547–9560, https://doi.org/10.1021/es050886c, 2005.
Perraudin, E., Budzinski, H., and Villenave, E.: Kinetic study of the reactions of ozone with polycyclic aromatic hydrocarbons adsorbed on atmospheric model particles, J. Atmos. Chem., 56, 57–82, https://doi.org/10.1007/s10874-006-9042-x, 2007.
Pleim, J. E.: A combined local and nonlocal closure model for the atmospheric boundary layer, Part I: Model description and testing, J. Appl. Meteor. Climatol., 46, 1383–1395, https://doi.org/10.1175/JAM2539.1, 2007.
Pleim, J. E. and Xiu, A.: Development and testing of a surface flux and planetary boundary layer model for application in mesoscale models, J. Appl. Meteor., 34, 16–32, https://doi.org/10.1175/1520-0450(1995)034<0034:DATOAS>2.0.CO;2, 1995.
Pleim, J. E. and Xiu, A. J.: Development of a land surface model, Part II: Data assimilation, J. Appl. Meteor., 42, 1811–1822, https://doi.org/10.1175/1520-0450(2003)042<1811:DOALSM>2.0.CO;2, 2003.
Pleim, J. E., Finkelstein, P. L., Clarke, J. F., and Ellestad, T. G.: A technique for estimating dry deposition velocities based on similarity with latent heat flux, Atmos. Environ., 33, 2257–2268, https://doi.org/10.1016/S1352-2310(98)00162-9, 1999.
Pöschl, U., Letzel, T., Schauer, C., and Niessner, R.: Interaction of ozone and water vapor with spark discharge soot aerosol particles coated with benzo[a]pyrene: O3 and H2O adsorption, benzo[a]pyrene degradation, and atmospheric implications, J. Phys. Chem. A, 105, 4029–4041, https://doi.org/10.1021/jp004137n, 2001.
Prevedouros, K., Jones, K. C., and Sweetman, A. J.: Modelling the atmospheric fate and seasonality of polycyclic aromatic hydrocarbons in the UK, Chemosphere, 56, 195–208, https://doi.org/10.1016/j.chemosphere.2004.02.032, 2004.
Prevedouros, K., Palm-Cousins, A., Gustafsson, Ö., and Cousins, I. T.: Development of a black carbon-inclusive multi-media model: Application for PAHs in Stockholm, Chemosphere, 70, 607–615, https://doi.org/10.1016/j.chemosphere.2007.07.002, 2008.
Saffari, A., Daher, N., Samara, C., Voutsa, D., Kouras, A., Manoli, E., Karagkiozidou, O., Vlachokostas, C., Moussiopoulos, N., Shafer, M. M., Schauer, J. J., and Sioutas, C.: Increased biomass burning due to the economic crisis in Greece and its adverse impact on wintertime air quality in Thessaloniki, Environ. Sci. Technol., 47, 13313–13320, https://doi.org/10.1021/es403847h, 2013.
San José, R., Pérez, J. L., Callén, M. S., López, J. M., and Mastral, A.: BaP (PAH) air quality modelling exercise over Zaragoza (Spain) using an adapted version of WRF-CMAQ model, Environ. Pollut., 183, 151–158, https://doi.org/10.1016/j.envpol.2013.02.025, 2013.
Sehili, A. M. and Lammel, G.: Global fate and distribution of polycyclic aromatic hydrocarbons emitted from Europe and Russia, Atmos. Environ., 41, 8301–8315, https://doi.org/10.1016/j.atmosenv.2007.06.050, 2007.
Shatalov, V., Gusev, A., Dutchak, S., Holoubek, I., Mantseva, E., Rozovskaya, O., Sweetman, A., Strukov, B., and Vulykh, N.: Modelling of POP contamination in European region: evaluation of the model performance, Moscow, 2005.
Shiraiwa, M., Garland, R. M., and Pöschl, U.: Kinetic double-layer model of aerosol surface chemistry and gas-particle interactions (K2-SURF): Degradation of polycyclic aromatic hydrocarbons exposed to O3, NO2, H2O, OH and NO3, Atmos. Chem. Phys., 9, 9571–9586, https://doi.org/10.5194/acp-9-9571-2009, 2009.
Shiraiwa, M., Pfrang, C., and Pöschl, U.: Kinetic multi-layer model of aerosol surface and bulk chemistry (KM-SUB): the influence of interfacial transport and bulk diffusion on the oxidation of oleic acid by ozone, Atmos. Chem. Phys., 10, 3673–3691, https://doi.org/10.5194/acp-10-3673-2010, 2010.
Silibello, C., Calori, G., Costa, M. P., Dirodi, M. G., Mircea, M., Radice, P., Vitali, L., and Zanini, G.: Benzo[a]pyrene modelling over Italy: comparison with experimental data and source apportionment, Atmos. Pollut. Res., 3, 399–407, https://doi.org/10.5094/APR.2012.046, 2012.
Springmann, M., Knopf, D. A., and Riemer, N.: Detailed heterogeneous chemistry in an urban plume box model: reversible co-adsorption of O3, NO2, and H2O on soot coated with benzo[a]pyrene, Atmos. Chem. Phys., 9, 7461–7479, https://doi.org/10.5194/acp-9-7461-2009, 2009.
Šrám, R., Dostal, M., Libalova, H., Rossner, P., Rossnerova, A., Svecova, V., Topinka, J., and Bartonova, A.: The European hot spot of B[a]P and PM2.5 exposure – The Ostrava region, Czech Republic: Health research results, ISRN Public Health, 57, 12, https://doi.org/10.3109/19396368.2010.500440, 2013.
Stokes, R. H. and Robinson, R. A.: Interactions in aqueous nonelec- trolyte solutions, I. solute-solvent equilibria, J. Phys. Chem., 70, 2126–2131, https://doi.org/10.1021/j100879a010, 1966.
Van Jaarsveld, J., Van Pul, W., and De Leeuw, F.: Modelling transport and deposition of persistent organic pollutants in the European region, Atmos. Environ., 31, 1011–1024, https://doi.org/10.1016/S1352-2310(96)00251-8, 1997.
van Noort, P.: A thermodynamics-based estimation model for adsorption of organic compounds by carbonaceous materials in environmental sorbents, Environ. Toxicol. Chem., 22, 1179–1188, https://doi.org/10.1002/etc.5620220601, 2003.
Wenborn, M. J., Coleman, P. J., Passant, N. R., Lymberidi, E., Sully, J., and Weir, A.: Speciated PAH inventory for the United Kingdom, Report AEAT 3512, available at: https://uk-air.defra.gov.uk/assets/documents/reports/cat08/0512011419_REPFIN_all_nov.pdf (last access: 6 December 2016), 1999.
WHO: World Health Organization: Health risks of persistent organic pollutants from long-range transboundary air pollution, WHO Regional Office for Europe, Copenhagen, 2003.
Xiu, A. J. and Pleim, J. E.: Development of a land surface model, Part I: Application in a mesoscale meteorological model, J. Appl. Meteor., 40, 192–209, https://doi.org/10.1175/1520-0450(2001)040<0192:DOALSM>2.0.CO;2, 2001.
Yarwood, G., Rao, S., Yocke, M., and Whitten, G.: Updates to the carbon bond chemical mechanism: CB05, Final report to the US EPA, RT-0400675, available at http://www.camx.com. (last access: 6 December 2016), 2005.
Zelenyuk, A., Imre, D., Beránek, J., Abramson, E., Wilson, J., and Shrivastava, M.: Synergy between secondary organic aerosols and long-range transport of polycyclic aromatic hydrocarbons, Environ. Sci. Technol., 46, 12459–12466, https://doi.org/10.1021/es302743z, 2012.
Zhang, B., Meng, F., Shi, C., Yang, F., Wen, D., Aronsson, J., Gbor, P. K., and Sloan, J. J.: Modeling the atmospheric transport and deposition of polychlorinated dibenzo-p-dioxins and dibenzofurans in North America, Atmos. Environ., 43, 2204–2212, https://doi.org/10.1016/j.atmosenv.2009.01.004, 2009.
Zhang, Y., Seigneur, C., Seinfeld, J. H., Jacobson, M., Clegg, S. L., and Binkowski, F. S.: A comparative review of inorganic aerosol thermodynamic equilibrium modules: similarities, differences, and their likely causes, Atmos. Environ., 34, 117–137, https://doi.org/10.1016/S1352-2310(99)00236-8, 2000.
Zhou, S., Lee, A. K. Y., McWhinney, R. D., and Abbatt, J. P. D.: Burial effects of organic coatings on the heterogeneous reactivity of particle-borne benzo[a]pyrene (BaP) toward ozone, J. Phys. Chem. A, 116, 7050–7056, https://doi.org/10.1021/jp3030705, 2012.
Zhou, S., Shiraiwa, M., McWhinney, R. D., Pöschl, U., and Abbatt, J. P. D.: Kinetic limitations in gas-particle reactions arising from slow diffusion in secondary organic aerosol, Faraday Discuss., 165, 391–406, https://doi.org/10.1039/c3fd00030c, 2013.
Zhu, Y., Tao, S., Price, O. R., Shen, H., Jones, K. C., and Sweetman, A. J.: Environmental distributions of benzo[a]pyrene in China: Current and future emission reduction scenarios explored using a spatially explicit multimedia fate model, Environ. Sci. Technol., 49, 13868–13877, https://doi.org/10.1021/acs.est.5b00474, 2015.
Short summary
Gas-particle partitioning is an important process that determines the fate and long-range transport potential of persistent organic pollutants. This work is the first effort to evaluate the behaviour of parameterizations within a regional air quality system adapted for Europe. Results corroborate the significance of the chosen implementation in predicting ambient levels and transport patterns. Implications point to improvements on the side of the emission inventories and aerosol module.
Gas-particle partitioning is an important process that determines the fate and long-range...
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