Articles | Volume 13, issue 1
Geosci. Model Dev., 13, 169–183, 2020
https://doi.org/10.5194/gmd-13-169-2020
© Author(s) 2020. This work is distributed under
the Creative Commons Attribution 4.0 License.
the Creative Commons Attribution 4.0 License.
Special issue: Simulation chambers as tools in atmospheric research (AMT/ACP/GMD...
Geosci. Model Dev., 13, 169–183, 2020
https://doi.org/10.5194/gmd-13-169-2020
© Author(s) 2020. This work is distributed under
the Creative Commons Attribution 4.0 License.
the Creative Commons Attribution 4.0 License.
Model description paper 27 Jan 2020
Model description paper | 27 Jan 2020
AtChem (version 1), an open-source box model for the Master Chemical Mechanism
Roberto Sommariva et al.
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Beth S. Nelson, Gareth J. Stewart, Will S. Drysdale, Mike J. Newland, Adam R. Vaughan, Rachel E. Dunmore, Pete M. Edwards, Alastair C. Lewis, Jacqueline F. Hamilton, W. Joe Acton, C. Nicholas Hewitt, Leigh R. Crilley, Mohammed S. Alam, Ülkü A. Şahin, David C. S. Beddows, William J. Bloss, Eloise Slater, Lisa K. Whalley, Dwayne E. Heard, James M. Cash, Ben Langford, Eiko Nemitz, Roberto Sommariva, Sam Cox, Shivani, Ranu Gadi, Bhola R. Gurjar, James R. Hopkins, Andrew R. Rickard, and James D. Lee
Atmos. Chem. Phys., 21, 13609–13630, https://doi.org/10.5194/acp-21-13609-2021, https://doi.org/10.5194/acp-21-13609-2021, 2021
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Ozone production at an urban site in Delhi is sensitive to volatile organic compound (VOC) concentrations, particularly those of the aromatic, monoterpene, and alkene VOC classes. The change in ozone production by varying atmospheric pollutants according to their sources, as defined in an emissions inventory, is investigated. The study suggests that reducing road transport emissions alone does not reduce reactive VOCs in the atmosphere enough to perturb an increase in ozone production.
Paul S. Monks, A. R. Ravishankara, Erika von Schneidemesser, and Roberto Sommariva
Atmos. Chem. Phys., 21, 12909–12948, https://doi.org/10.5194/acp-21-12909-2021, https://doi.org/10.5194/acp-21-12909-2021, 2021
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Which published papers have transformed our understanding of the chemical processes in the troposphere and shaped the field of atmospheric chemistry? We explore how these papers have shaped the development of the field of atmospheric chemistry and identify the major landmarks in the field of atmospheric chemistry through the lens of those papers' impact on science, legislation and environmental events.
Roberto Sommariva, Louisa J. Kramer, Leigh R. Crilley, Mohammed S. Alam, and William J. Bloss
Atmos. Meas. Tech., 13, 1655–1670, https://doi.org/10.5194/amt-13-1655-2020, https://doi.org/10.5194/amt-13-1655-2020, 2020
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Ozone is a key atmospheric pollutant formed through chemical processing of natural and anthropogenic emissions and removed by reaction with organic compounds emitted by plants. We describe a new instrument – the
Total Ozone Reactivity Systemor TORS – that measures the total loss of ozone in the troposphere. The objective of the TORS instrument is to provide an estimate of the organic compounds emitted by plants which are not measured and thus to improve our understanding of the ozone budget.
Rupert Holzinger, W. Joe F. Acton, William J. Bloss, Martin Breitenlechner, Leigh R. Crilley, Sébastien Dusanter, Marc Gonin, Valerie Gros, Frank N. Keutsch, Astrid Kiendler-Scharr, Louisa J. Kramer, Jordan E. Krechmer, Baptiste Languille, Nadine Locoge, Felipe Lopez-Hilfiker, Dušan Materić, Sergi Moreno, Eiko Nemitz, Lauriane L. J. Quéléver, Roland Sarda Esteve, Stéphane Sauvage, Simon Schallhart, Roberto Sommariva, Ralf Tillmann, Sergej Wedel, David R. Worton, Kangming Xu, and Alexander Zaytsev
Atmos. Meas. Tech., 12, 6193–6208, https://doi.org/10.5194/amt-12-6193-2019, https://doi.org/10.5194/amt-12-6193-2019, 2019
P. S. Monks, A. T. Archibald, A. Colette, O. Cooper, M. Coyle, R. Derwent, D. Fowler, C. Granier, K. S. Law, G. E. Mills, D. S. Stevenson, O. Tarasova, V. Thouret, E. von Schneidemesser, R. Sommariva, O. Wild, and M. L. Williams
Atmos. Chem. Phys., 15, 8889–8973, https://doi.org/10.5194/acp-15-8889-2015, https://doi.org/10.5194/acp-15-8889-2015, 2015
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Ozone holds a certain fascination in atmospheric science. It is ubiquitous in the atmosphere, central to tropospheric oxidation chemistry, and yet harmful to human and ecosystem health as well as being an important greenhouse gas. It is not emitted into the atmosphere but is a byproduct of the very oxidation chemistry it largely initiates. This review examines current understanding of the processes regulating tropospheric ozone at global to local scales from both measurements and models.
Beth S. Nelson, Gareth J. Stewart, Will S. Drysdale, Mike J. Newland, Adam R. Vaughan, Rachel E. Dunmore, Pete M. Edwards, Alastair C. Lewis, Jacqueline F. Hamilton, W. Joe Acton, C. Nicholas Hewitt, Leigh R. Crilley, Mohammed S. Alam, Ülkü A. Şahin, David C. S. Beddows, William J. Bloss, Eloise Slater, Lisa K. Whalley, Dwayne E. Heard, James M. Cash, Ben Langford, Eiko Nemitz, Roberto Sommariva, Sam Cox, Shivani, Ranu Gadi, Bhola R. Gurjar, James R. Hopkins, Andrew R. Rickard, and James D. Lee
Atmos. Chem. Phys., 21, 13609–13630, https://doi.org/10.5194/acp-21-13609-2021, https://doi.org/10.5194/acp-21-13609-2021, 2021
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Ozone production at an urban site in Delhi is sensitive to volatile organic compound (VOC) concentrations, particularly those of the aromatic, monoterpene, and alkene VOC classes. The change in ozone production by varying atmospheric pollutants according to their sources, as defined in an emissions inventory, is investigated. The study suggests that reducing road transport emissions alone does not reduce reactive VOCs in the atmosphere enough to perturb an increase in ozone production.
Paul S. Monks, A. R. Ravishankara, Erika von Schneidemesser, and Roberto Sommariva
Atmos. Chem. Phys., 21, 12909–12948, https://doi.org/10.5194/acp-21-12909-2021, https://doi.org/10.5194/acp-21-12909-2021, 2021
Short summary
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Which published papers have transformed our understanding of the chemical processes in the troposphere and shaped the field of atmospheric chemistry? We explore how these papers have shaped the development of the field of atmospheric chemistry and identify the major landmarks in the field of atmospheric chemistry through the lens of those papers' impact on science, legislation and environmental events.
Leigh Crilley, Louisa Kramer, Francis Pope, Chris Reed, James Lee, Lucy Carpenter, Lloyd Hollis, Stephen Ball, and William Bloss
Atmos. Chem. Phys. Discuss., https://doi.org/10.5194/acp-2021-532, https://doi.org/10.5194/acp-2021-532, 2021
Revised manuscript accepted for ACP
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Nitrous acid (HONO) is a key source of atmospheric oxidants. We evaluate if the ocean surface is a source of HONO into the marine boundary layer, using measurements from two contrasting coastal locations. We observed no evidence for a night-time ocean surface source, in contrast to previous work. This points to significant geographical variation in the predominant HONO formation mechanisms in marine environments, reflecting possible variability in the sea-surface microlayer composition.
Karn Vohra, Eloise A. Marais, Shannen Suckra, Louisa Kramer, William J. Bloss, Ravi Sahu, Abhishek Gaur, Sachchida N. Tripathi, Martin Van Damme, Lieven Clarisse, and Pierre-F. Coheur
Atmos. Chem. Phys., 21, 6275–6296, https://doi.org/10.5194/acp-21-6275-2021, https://doi.org/10.5194/acp-21-6275-2021, 2021
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We find satellite observations of atmospheric composition generally reproduce variability in surface air pollution, so we use their long record to estimate air quality trends in major UK and Indian cities. Our trend analysis shows that pollutants targeted with air quality policies have not declined in Delhi and Kanpur but have in London and Birmingham, with the exception of a recent and dramatic increase in reactive volatile organics in London. Unregulated ammonia has increased only in Delhi.
Claire E. Reeves, Graham P. Mills, Lisa K. Whalley, W. Joe F. Acton, William J. Bloss, Leigh R. Crilley, Sue Grimmond, Dwayne E. Heard, C. Nicholas Hewitt, James R. Hopkins, Simone Kotthaus, Louisa J. Kramer, Roderic L. Jones, James D. Lee, Yanhui Liu, Bin Ouyang, Eloise Slater, Freya Squires, Xinming Wang, Robert Woodward-Massey, and Chunxiang Ye
Atmos. Chem. Phys., 21, 6315–6330, https://doi.org/10.5194/acp-21-6315-2021, https://doi.org/10.5194/acp-21-6315-2021, 2021
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The impact of isoprene on atmospheric chemistry is dependent on how its oxidation products interact with other pollutants, specifically nitrogen oxides. Such interactions can lead to isoprene nitrates. We made measurements of the concentrations of individual isoprene nitrate isomers in Beijing and used a model to test current understanding of their chemistry. We highlight areas of uncertainty in understanding, in particular the chemistry following oxidation of isoprene by the nitrate radical.
Simone T. Andersen, Lucy J. Carpenter, Beth S. Nelson, Luis Neves, Katie A. Read, Chris Reed, Martyn Ward, Matthew J. Rowlinson, and James D. Lee
Atmos. Meas. Tech., 14, 3071–3085, https://doi.org/10.5194/amt-14-3071-2021, https://doi.org/10.5194/amt-14-3071-2021, 2021
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NOx has been measured in remote marine air via chemiluminescence detection using two different methods for NO2 to NO photolytic conversion: (a) internal diodes and a reaction chamber made of Teflon-like barium-doped material, which causes a NO2 artefact, and (b) external diodes and a quartz photolysis cell. Once corrections are made for the artefact of (a), the two converters are shown to give comparable NO2 mixing ratios, giving confidence in the quantitative measurement of NOx at low levels.
Steven J. Campbell, Kate Wolfer, Battist Utinger, Joe Westwood, Zhi-Hui Zhang, Nicolas Bukowiecki, Sarah S. Steimer, Tuan V. Vu, Jingsha Xu, Nicholas Straw, Steven Thomson, Atallah Elzein, Yele Sun, Di Liu, Linjie Li, Pingqing Fu, Alastair C. Lewis, Roy M. Harrison, William J. Bloss, Miranda Loh, Mark R. Miller, Zongbo Shi, and Markus Kalberer
Atmos. Chem. Phys., 21, 5549–5573, https://doi.org/10.5194/acp-21-5549-2021, https://doi.org/10.5194/acp-21-5549-2021, 2021
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In this study, we quantify PM2.5 oxidative potential (OP), a metric widely suggested as a potential measure of particle toxicity, in Beijing in summer and winter using four acellular assays. We correlate PM2.5 OP with a comprehensive range of atmospheric and particle composition measurements, demonstrating inter-assay differences and seasonal variation of PM2.5 OP. Using multivariate statistical analysis, we highlight specific particle chemical components and sources that influence OP.
Gareth J. Stewart, Beth S. Nelson, W. Joe F. Acton, Adam R. Vaughan, Naomi J. Farren, James R. Hopkins, Martyn W. Ward, Stefan J. Swift, Rahul Arya, Arnab Mondal, Ritu Jangirh, Sakshi Ahlawat, Lokesh Yadav, Sudhir K. Sharma, Siti S. M. Yunus, C. Nicholas Hewitt, Eiko Nemitz, Neil Mullinger, Ranu Gadi, Lokesh K. Sahu, Nidhi Tripathi, Andrew R. Rickard, James D. Lee, Tuhin K. Mandal, and Jacqueline F. Hamilton
Atmos. Chem. Phys., 21, 2407–2426, https://doi.org/10.5194/acp-21-2407-2021, https://doi.org/10.5194/acp-21-2407-2021, 2021
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Biomass burning releases many lower-molecular-weight organic species which are difficult to analyse but important for the formation of organic aerosol. This study examined a new high-resolution technique to better characterise these difficult-to-analyse organic components. Some burning sources analysed in this study, such as cow dung cake and municipal solid waste, released extremely complex mixtures containing many thousands of different lower-volatility organic compounds.
Gareth J. Stewart, W. Joe F. Acton, Beth S. Nelson, Adam R. Vaughan, James R. Hopkins, Rahul Arya, Arnab Mondal, Ritu Jangirh, Sakshi Ahlawat, Lokesh Yadav, Sudhir K. Sharma, Rachel E. Dunmore, Siti S. M. Yunus, C. Nicholas Hewitt, Eiko Nemitz, Neil Mullinger, Ranu Gadi, Lokesh K. Sahu, Nidhi Tripathi, Andrew R. Rickard, James D. Lee, Tuhin K. Mandal, and Jacqueline F. Hamilton
Atmos. Chem. Phys., 21, 2383–2406, https://doi.org/10.5194/acp-21-2383-2021, https://doi.org/10.5194/acp-21-2383-2021, 2021
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Biomass burning is a major source of trace gases to the troposphere; however, the composition and quantity of emissions vary greatly between different fuel types. This work provided near-total quantitation of non-methane volatile organic compounds from combustion of biofuels from India. Emissions from cow dung cake combustion were significantly larger than conventional fuelwood combustion, potentially indicating that this source has a disproportionately large impact on regional air quality.
Lisa K. Whalley, Eloise J. Slater, Robert Woodward-Massey, Chunxiang Ye, James D. Lee, Freya Squires, James R. Hopkins, Rachel E. Dunmore, Marvin Shaw, Jacqueline F. Hamilton, Alastair C. Lewis, Archit Mehra, Stephen D. Worrall, Asan Bacak, Thomas J. Bannan, Hugh Coe, Carl J. Percival, Bin Ouyang, Roderic L. Jones, Leigh R. Crilley, Louisa J. Kramer, William J. Bloss, Tuan Vu, Simone Kotthaus, Sue Grimmond, Yele Sun, Weiqi Xu, Siyao Yue, Lujie Ren, W. Joe F. Acton, C. Nicholas Hewitt, Xinming Wang, Pingqing Fu, and Dwayne E. Heard
Atmos. Chem. Phys., 21, 2125–2147, https://doi.org/10.5194/acp-21-2125-2021, https://doi.org/10.5194/acp-21-2125-2021, 2021
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To understand how emission controls will impact ozone, an understanding of the sources and sinks of OH and the chemical cycling between peroxy radicals is needed. This paper presents measurements of OH, HO2 and total RO2 taken in central Beijing. The radical observations are compared to a detailed chemistry model, which shows that under low NO conditions, there is a missing OH source. Under high NOx conditions, the model under-predicts RO2 and impacts our ability to model ozone.
Mike J. Newland, Daniel J. Bryant, Rachel E. Dunmore, Thomas J. Bannan, W. Joe F. Acton, Ben Langford, James R. Hopkins, Freya A. Squires, William Dixon, William S. Drysdale, Peter D. Ivatt, Mathew J. Evans, Peter M. Edwards, Lisa K. Whalley, Dwayne E. Heard, Eloise J. Slater, Robert Woodward-Massey, Chunxiang Ye, Archit Mehra, Stephen D. Worrall, Asan Bacak, Hugh Coe, Carl J. Percival, C. Nicholas Hewitt, James D. Lee, Tianqu Cui, Jason D. Surratt, Xinming Wang, Alastair C. Lewis, Andrew R. Rickard, and Jacqueline F. Hamilton
Atmos. Chem. Phys., 21, 1613–1625, https://doi.org/10.5194/acp-21-1613-2021, https://doi.org/10.5194/acp-21-1613-2021, 2021
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We report the formation of secondary pollutants in the urban megacity of Beijing that are typically associated with remote regions such as rainforests. This is caused by extremely low levels of nitric oxide (NO), typically expected to be high in urban areas, observed in the afternoon. This work has significant implications for how we understand atmospheric chemistry in the urban environment and thus for how to implement effective policies to improve urban air quality.
Eloise J. Slater, Lisa K. Whalley, Robert Woodward-Massey, Chunxiang Ye, James D. Lee, Freya Squires, James R. Hopkins, Rachel E. Dunmore, Marvin Shaw, Jacqueline F. Hamilton, Alastair C. Lewis, Leigh R. Crilley, Louisa Kramer, William Bloss, Tuan Vu, Yele Sun, Weiqi Xu, Siyao Yue, Lujie Ren, W. Joe F. Acton, C. Nicholas Hewitt, Xinming Wang, Pingqing Fu, and Dwayne E. Heard
Atmos. Chem. Phys., 20, 14847–14871, https://doi.org/10.5194/acp-20-14847-2020, https://doi.org/10.5194/acp-20-14847-2020, 2020
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The paper details atmospheric chemistry in a megacity (Beijing), focussing on radicals which mediate the formation of secondary pollutants such as ozone and particles. Highly polluted conditions were experienced, including the highest ever levels of nitric oxide (NO), with simultaneous radical measurements. Radical concentrations were large during "haze" events, demonstrating active photochemistry. Modelling showed that our understanding of the chemistry at high NOx levels is incomplete.
Atallah Elzein, Gareth J. Stewart, Stefan J. Swift, Beth S. Nelson, Leigh R. Crilley, Mohammed S. Alam, Ernesto Reyes-Villegas, Ranu Gadi, Roy M. Harrison, Jacqueline F. Hamilton, and Alastair C. Lewis
Atmos. Chem. Phys., 20, 14303–14319, https://doi.org/10.5194/acp-20-14303-2020, https://doi.org/10.5194/acp-20-14303-2020, 2020
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We collected high-frequency air particle samples (PM2.5) in Beijing (China) and Delhi (India) and measured the concentration of PAHs in daytime and night-time. PAHs were higher in Delhi than in Beijing, and the five-ring PAHs contribute the most to the total PAH concentration. We compared the emission sources and identified the major sectors that could be subject to mitigation measures. The adverse health effects from inhalation exposure to PAHs in Delhi are 2.2 times higher than in Beijing.
Sarah S. Steimer, Daniel J. Patton, Tuan V. Vu, Marios Panagi, Paul S. Monks, Roy M. Harrison, Zoë L. Fleming, Zongbo Shi, and Markus Kalberer
Atmos. Chem. Phys., 20, 13303–13318, https://doi.org/10.5194/acp-20-13303-2020, https://doi.org/10.5194/acp-20-13303-2020, 2020
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Air pollution is of growing concern due to its negative effect on public health, especially in low- and middle-income countries. This study investigates how the chemical composition of particles in Beijing changes under different measurement conditions (pollution levels, season) to get a better understanding of the sources of this form of air pollution.
Mohammed S. Alam, Leigh R. Crilley, James D. Lee, Louisa J. Kramer, Christian Pfrang, Mónica Vázquez-Moreno, Milagros Ródenas, Amalia Muñoz, and William J. Bloss
Atmos. Meas. Tech., 13, 5977–5991, https://doi.org/10.5194/amt-13-5977-2020, https://doi.org/10.5194/amt-13-5977-2020, 2020
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We report on the interference arising in measurements of nitrogen oxides (NOx) from the presence of a range of alkenes in sampled air when using the most widespread air quality monitoring technique for chemiluminescence detection. Interferences of up to 11 % are reported, depending upon the alkene present and conditions used. Such interferences may be of substantial importance for the interpretation of ambient NOx data, particularly for high volatile organic compound and low NOx environments.
Michael E. Jenkin, Richard Valorso, Bernard Aumont, Mike J. Newland, and Andrew R. Rickard
Atmos. Chem. Phys., 20, 12921–12937, https://doi.org/10.5194/acp-20-12921-2020, https://doi.org/10.5194/acp-20-12921-2020, 2020
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Unsaturated organic compounds are emitted in large quantities from natural and human-influenced sources. Atmospheric removal occurs significantly by reaction with ozone, initiating reaction sequences forming free radicals and organic pollutants in the gaseous and particulate phases. Due to their very large number, it is impossible to study the reaction rate for every compound, and most have to be estimated. Updated and extended estimation methods are reported for use in atmospheric models.
Archit Mehra, Yuwei Wang, Jordan E. Krechmer, Andrew Lambe, Francesca Majluf, Melissa A. Morris, Michael Priestley, Thomas J. Bannan, Daniel J. Bryant, Kelly L. Pereira, Jacqueline F. Hamilton, Andrew R. Rickard, Mike J. Newland, Harald Stark, Philip Croteau, John T. Jayne, Douglas R. Worsnop, Manjula R. Canagaratna, Lin Wang, and Hugh Coe
Atmos. Chem. Phys., 20, 9783–9803, https://doi.org/10.5194/acp-20-9783-2020, https://doi.org/10.5194/acp-20-9783-2020, 2020
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Aromatic volatile organic compounds (VOCs) emitted from anthropogenic activity are important for tropospheric ozone and secondary organic aerosol (SOA) formation. Here we present a detailed chemical characterisation of SOA from four C9-aromatic isomers and a polycyclic aromatic hydrocarbon (PAH). We identify and compare their oxidation products in the gas and particle phases, showing the different relative importance of oxidation pathways and proportions of highly oxygenated organic molecules.
Jacob T. Shaw, Andrew R. Rickard, Mike J. Newland, and Terry J. Dillon
Atmos. Chem. Phys., 20, 9725–9736, https://doi.org/10.5194/acp-20-9725-2020, https://doi.org/10.5194/acp-20-9725-2020, 2020
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This work expands upon the recently developed multivariate relative rate technique, presented in Shaw et al. (2019), for the measurement of rates of reaction between aromatic and aliphatic volatile organic compounds (VOCs) and OH. Knowledge of the rates of such reactions are important for understanding air quality in urban environments. This work also provides a key validation of structure–activity relationship models, which provide a theoretical method for estimating OH + VOC kinetics.
Daniel J. Bryant, William J. Dixon, James R. Hopkins, Rachel E. Dunmore, Kelly L. Pereira, Marvin Shaw, Freya A. Squires, Thomas J. Bannan, Archit Mehra, Stephen D. Worrall, Asan Bacak, Hugh Coe, Carl J. Percival, Lisa K. Whalley, Dwayne E. Heard, Eloise J. Slater, Bin Ouyang, Tianqu Cui, Jason D. Surratt, Di Liu, Zongbo Shi, Roy Harrison, Yele Sun, Weiqi Xu, Alastair C. Lewis, James D. Lee, Andrew R. Rickard, and Jacqueline F. Hamilton
Atmos. Chem. Phys., 20, 7531–7552, https://doi.org/10.5194/acp-20-7531-2020, https://doi.org/10.5194/acp-20-7531-2020, 2020
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Using the chemical composition of offline filter samples, we report that a large share of oxidized organic aerosol in Beijing during summer is due to isoprene secondary organic aerosol (iSOA). iSOA organosulfates showed a strong correlation with the product of ozone and particulate sulfate. This highlights the role of both photochemistry and the availability of particulate sulfate in heterogeneous reactions and further demonstrates that iSOA formation is controlled by anthropogenic emissions.
Kirsti Ashworth, Silvia Bucci, Peter J. Gallimore, Junghwa Lee, Beth S. Nelson, Alberto Sanchez-Marroquín, Marina B. Schimpf, Paul D. Smith, Will S. Drysdale, Jim R. Hopkins, James D. Lee, Joe R. Pitt, Piero Di Carlo, Radovan Krejci, and James B. McQuaid
Atmos. Chem. Phys., 20, 7193–7216, https://doi.org/10.5194/acp-20-7193-2020, https://doi.org/10.5194/acp-20-7193-2020, 2020
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In July 2017 we flew three research flights around London during European Facility for Airborne Research (EUFAR) training. We made continuous measurements of concentrations of key pollutants (ozone, NOx, aerosol particles, CO, CO2 and methane) and meteorology, and we collected periodic samples of air to analyse for volatile organic compounds. We saw evidence that plumes of pollution from the city, strong local emissions and pollution from distant sources all contribute to regional pollution.
Louisa J. Kramer, Leigh R. Crilley, Thomas J. Adams, Stephen M. Ball, Francis D. Pope, and William J. Bloss
Atmos. Chem. Phys., 20, 5231–5248, https://doi.org/10.5194/acp-20-5231-2020, https://doi.org/10.5194/acp-20-5231-2020, 2020
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HONO is a large source of OH radicals, which can drive VOC oxidation, leading to the formation of ozone and secondary organic aerosols. Here we investigate primary vehicle emissions of HONO from measurements in a road tunnel in Birmingham, UK. A HONO/NOx emission ratio was detemined and compared to previous studies. Results indicate HONO/NOx has not varied much over the last two decades and technologies aimed at reducing NO2 may have also resulted in a reduction in direct HONO vehicle emissions.
Elise S. Droste, Karina E. Adcock, Matthew J. Ashfold, Charles Chou, Zoë Fleming, Paul J. Fraser, Lauren J. Gooch, Andrew J. Hind, Ray L. Langenfelds, Emma Leedham Elvidge, Norfazrin Mohd Hanif, Simon O'Doherty, David E. Oram, Chang-Feng Ou-Yang, Marios Panagi, Claire E. Reeves, William T. Sturges, and Johannes C. Laube
Atmos. Chem. Phys., 20, 4787–4807, https://doi.org/10.5194/acp-20-4787-2020, https://doi.org/10.5194/acp-20-4787-2020, 2020
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We update the tropospheric trends and emissions of six perfluorocarbon (PFC) gases, including separate isomers. Trends for these strong greenhouse gases are still increasing, but at slower rates than previously. The lack of natural sinks results in the global accumulation of 833 million metric tonnes of CO2 equivalent for these six PFCs by 2017. Modelling results indicate potential source regions and types in East Asia, but we find that many emissions are unaccounted for in emission reports.
Roberto Sommariva, Louisa J. Kramer, Leigh R. Crilley, Mohammed S. Alam, and William J. Bloss
Atmos. Meas. Tech., 13, 1655–1670, https://doi.org/10.5194/amt-13-1655-2020, https://doi.org/10.5194/amt-13-1655-2020, 2020
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Ozone is a key atmospheric pollutant formed through chemical processing of natural and anthropogenic emissions and removed by reaction with organic compounds emitted by plants. We describe a new instrument – the
Total Ozone Reactivity Systemor TORS – that measures the total loss of ozone in the troposphere. The objective of the TORS instrument is to provide an estimate of the organic compounds emitted by plants which are not measured and thus to improve our understanding of the ozone budget.
Leigh R. Crilley, Ajit Singh, Louisa J. Kramer, Marvin D. Shaw, Mohammed S. Alam, Joshua S. Apte, William J. Bloss, Lea Hildebrandt Ruiz, Pingqing Fu, Weiqi Fu, Shahzad Gani, Michael Gatari, Evgenia Ilyinskaya, Alastair C. Lewis, David Ng'ang'a, Yele Sun, Rachel C. W. Whitty, Siyao Yue, Stuart Young, and Francis D. Pope
Atmos. Meas. Tech., 13, 1181–1193, https://doi.org/10.5194/amt-13-1181-2020, https://doi.org/10.5194/amt-13-1181-2020, 2020
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There is considerable interest in using low-cost optical particle counters (OPCs) for particle mass measurements; however, there is no agreed upon method with respect to calibration. Here we exploit a number of datasets globally to demonstrate that particle composition and relative humidity are the key factors affecting measured concentrations from a low-cost OPC, and we present a simple correction methodology that corrects for this influence.
Leigh R. Crilley, Louisa J. Kramer, Bin Ouyang, Jun Duan, Wenqian Zhang, Shengrui Tong, Maofa Ge, Ke Tang, Min Qin, Pinhua Xie, Marvin D. Shaw, Alastair C. Lewis, Archit Mehra, Thomas J. Bannan, Stephen D. Worrall, Michael Priestley, Asan Bacak, Hugh Coe, James Allan, Carl J. Percival, Olalekan A. M. Popoola, Roderic L. Jones, and William J. Bloss
Atmos. Meas. Tech., 12, 6449–6463, https://doi.org/10.5194/amt-12-6449-2019, https://doi.org/10.5194/amt-12-6449-2019, 2019
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Nitrous acid (HONO) is key species for understanding tropospheric chemistry, yet accurate and precise measurements are challenging. Here we report an inter–comparison exercise of a number of instruments that measured HONO in a highly polluted location (Beijing). All instruments agreed on the temporal trends yet displayed divergence in absolute concentrations. The cause of this divergence was unclear, but it may in part be due to spatial variability in instrument location.
Rupert Holzinger, W. Joe F. Acton, William J. Bloss, Martin Breitenlechner, Leigh R. Crilley, Sébastien Dusanter, Marc Gonin, Valerie Gros, Frank N. Keutsch, Astrid Kiendler-Scharr, Louisa J. Kramer, Jordan E. Krechmer, Baptiste Languille, Nadine Locoge, Felipe Lopez-Hilfiker, Dušan Materić, Sergi Moreno, Eiko Nemitz, Lauriane L. J. Quéléver, Roland Sarda Esteve, Stéphane Sauvage, Simon Schallhart, Roberto Sommariva, Ralf Tillmann, Sergej Wedel, David R. Worton, Kangming Xu, and Alexander Zaytsev
Atmos. Meas. Tech., 12, 6193–6208, https://doi.org/10.5194/amt-12-6193-2019, https://doi.org/10.5194/amt-12-6193-2019, 2019
Joseph R. Pitt, Grant Allen, Stéphane J.-B. Bauguitte, Martin W. Gallagher, James D. Lee, Will Drysdale, Beth Nelson, Alistair J. Manning, and Paul I. Palmer
Atmos. Chem. Phys., 19, 8931–8945, https://doi.org/10.5194/acp-19-8931-2019, https://doi.org/10.5194/acp-19-8931-2019, 2019
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This paper presents a new method to assess inventory estimates of greenhouse gas and air pollutant emissions for large cities and their surrounding regions. A case study using data sampled by a research aircraft around London was used to test the method. We found that the UK national inventory agrees with our observations for CO but needed lower emissions for CH4 to agree with the measured data. Repeated studies could help determine how these emissions vary on different timescales.
Michael E. Jenkin, Richard Valorso, Bernard Aumont, and Andrew R. Rickard
Atmos. Chem. Phys., 19, 7691–7717, https://doi.org/10.5194/acp-19-7691-2019, https://doi.org/10.5194/acp-19-7691-2019, 2019
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Organic compounds are emitted in large amounts from natural and human-influenced sources. Peroxy radicals are key intermediates formed during oxidation of organic compounds, and play a central role in mechanisms forming pollutants such as ozone and organic particles. Due to the large number of different peroxy radicals formed, it is impossible to study the rates of all of their reactions, and most have to be estimated. Updated and new estimation methods are reported for use in atmospheric models
Zongbo Shi, Tuan Vu, Simone Kotthaus, Roy M. Harrison, Sue Grimmond, Siyao Yue, Tong Zhu, James Lee, Yiqun Han, Matthias Demuzere, Rachel E. Dunmore, Lujie Ren, Di Liu, Yuanlin Wang, Oliver Wild, James Allan, W. Joe Acton, Janet Barlow, Benjamin Barratt, David Beddows, William J. Bloss, Giulia Calzolai, David Carruthers, David C. Carslaw, Queenie Chan, Lia Chatzidiakou, Yang Chen, Leigh Crilley, Hugh Coe, Tie Dai, Ruth Doherty, Fengkui Duan, Pingqing Fu, Baozhu Ge, Maofa Ge, Daobo Guan, Jacqueline F. Hamilton, Kebin He, Mathew Heal, Dwayne Heard, C. Nicholas Hewitt, Michael Hollaway, Min Hu, Dongsheng Ji, Xujiang Jiang, Rod Jones, Markus Kalberer, Frank J. Kelly, Louisa Kramer, Ben Langford, Chun Lin, Alastair C. Lewis, Jie Li, Weijun Li, Huan Liu, Junfeng Liu, Miranda Loh, Keding Lu, Franco Lucarelli, Graham Mann, Gordon McFiggans, Mark R. Miller, Graham Mills, Paul Monk, Eiko Nemitz, Fionna O'Connor, Bin Ouyang, Paul I. Palmer, Carl Percival, Olalekan Popoola, Claire Reeves, Andrew R. Rickard, Longyi Shao, Guangyu Shi, Dominick Spracklen, David Stevenson, Yele Sun, Zhiwei Sun, Shu Tao, Shengrui Tong, Qingqing Wang, Wenhua Wang, Xinming Wang, Xuejun Wang, Zifang Wang, Lianfang Wei, Lisa Whalley, Xuefang Wu, Zhijun Wu, Pinhua Xie, Fumo Yang, Qiang Zhang, Yanli Zhang, Yuanhang Zhang, and Mei Zheng
Atmos. Chem. Phys., 19, 7519–7546, https://doi.org/10.5194/acp-19-7519-2019, https://doi.org/10.5194/acp-19-7519-2019, 2019
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APHH-Beijing is a collaborative international research programme to study the sources, processes and health effects of air pollution in Beijing. This introduction to the special issue provides an overview of (i) the APHH-Beijing programme, (ii) the measurement and modelling activities performed as part of it and (iii) the air quality and meteorological conditions during joint intensive field campaigns as a core activity within APHH-Beijing.
Paul Herenz, Heike Wex, Alexander Mangold, Quentin Laffineur, Irina V. Gorodetskaya, Zoë L. Fleming, Marios Panagi, and Frank Stratmann
Atmos. Chem. Phys., 19, 275–294, https://doi.org/10.5194/acp-19-275-2019, https://doi.org/10.5194/acp-19-275-2019, 2019
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Atmospheric aerosol particles were observed in Antarctica, at the Belgian Princess Elisabeth station during three austral summers. Possible source regions for the particles were examined. Air that spent more than 90 %; of the time during 10 days over Antarctica had low and stable number concentrations, while the highest (new particle formation) and lowest (scavenging and wet deposition) concentrations were observed for air masses that were more strongly influenced by the Southern Ocean.
Robbie Ramsay, Chiara F. Di Marco, Mathew R. Heal, Marsailidh M. Twigg, Nicholas Cowan, Matthew R. Jones, Sarah R. Leeson, William J. Bloss, Louisa J. Kramer, Leigh Crilley, Matthias Sörgel, Meinrat Andreae, and Eiko Nemitz
Atmos. Chem. Phys., 18, 16953–16978, https://doi.org/10.5194/acp-18-16953-2018, https://doi.org/10.5194/acp-18-16953-2018, 2018
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Understanding the impact of agricultural activities on the atmosphere requires more measurements of inorganic trace gases and associated aerosol counterparts. This research presents 1 month of measurements above agricultural grassland during a period of fertiliser application. It was found that emissions of the important trace gases ammonia and nitrous acid peaked after fertiliser use and that the velocity at which the measured aerosols were deposited was dependent upon their size.
Prasad Kasibhatla, Tomás Sherwen, Mathew J. Evans, Lucy J. Carpenter, Chris Reed, Becky Alexander, Qianjie Chen, Melissa P. Sulprizio, James D. Lee, Katie A. Read, William Bloss, Leigh R. Crilley, William C. Keene, Alexander A. P. Pszenny, and Alma Hodzic
Atmos. Chem. Phys., 18, 11185–11203, https://doi.org/10.5194/acp-18-11185-2018, https://doi.org/10.5194/acp-18-11185-2018, 2018
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Recent measurements of NOx and HONO suggest that photolysis of particulate nitrate in sea-salt aerosols is important in terms of marine boundary layer oxidant chemistry. We present the first global-scale assessment of the significance of this new chemical pathway for NOx, O3, and OH in the marine boundary layer. We also present a preliminary assessment of the potential impact of photolysis of particulate nitrate associated with other aerosol types on continental boundary layer chemistry.
Michael E. Jenkin, Richard Valorso, Bernard Aumont, Andrew R. Rickard, and Timothy J. Wallington
Atmos. Chem. Phys., 18, 9297–9328, https://doi.org/10.5194/acp-18-9297-2018, https://doi.org/10.5194/acp-18-9297-2018, 2018
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Organic compounds are emitted in large quantities from natural and human-influenced sources. Removal from the atmosphere occurs mainly by reaction with hydroxyl (OH) radicals, and initiates reaction sequences forming pollutants such as ozone and organic particles. Due to their very large number, it is impossible to measure the removal rate for all compounds, and most have to be estimated. An updated and extended estimation method is reported for use in atmospheric models and impact assessments.
Michael E. Jenkin, Richard Valorso, Bernard Aumont, Andrew R. Rickard, and Timothy J. Wallington
Atmos. Chem. Phys., 18, 9329–9349, https://doi.org/10.5194/acp-18-9329-2018, https://doi.org/10.5194/acp-18-9329-2018, 2018
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Organic compounds are emitted in large quantities from natural and human-influenced sources. Removal from the atmosphere occurs mainly by reaction with hydroxyl (OH) radicals, and initiates reaction sequences forming pollutants such as ozone and organic particles. Due to their very large number, it is impossible to measure the removal rate for all compounds, and most have to be estimated. An updated and extended estimation method is reported for use in atmospheric models and impact assessments.
Mike J. Newland, Andrew R. Rickard, Tomás Sherwen, Mathew J. Evans, Luc Vereecken, Amalia Muñoz, Milagros Ródenas, and William J. Bloss
Atmos. Chem. Phys., 18, 6095–6120, https://doi.org/10.5194/acp-18-6095-2018, https://doi.org/10.5194/acp-18-6095-2018, 2018
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Stabilised Criegee intermediates (SCIs) are formed in the reaction of alkenes with ozone, both of which are ubiquitous throughout the troposphere. We determine the fate and global distribution of SCI from monoterpene ozonolysis. One major fate of SCI is reaction with H2O, but for a fraction of SCIs, unimolecular reactions dominate. Concentrations of SCIs are high enough regionally to play a key role in the conversion of sulfur dioxide to aerosol, affecting air quality and climate.
Felix A. Mackenzie-Rae, Helen J. Wallis, Andrew R. Rickard, Kelly L. Pereira, Sandra M. Saunders, Xinming Wang, and Jacqueline F. Hamilton
Atmos. Chem. Phys., 18, 4673–4693, https://doi.org/10.5194/acp-18-4673-2018, https://doi.org/10.5194/acp-18-4673-2018, 2018
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Native to Australasia, the remarkable adaptability, rapid growth rates and high quality wood of eucalypt trees has led to them the most widely planted hardwood forest trees in the world. In contrast to boreal and tropical forests, there has been little study of aerosol formation in these regions. Here, we study the secondary organic aerosol formation from the very fast reaction of α-phellandrene, emitted from eucalypts, and identify key products and reaction pathways.
Jacob T. Shaw, Richard T. Lidster, Danny R. Cryer, Noelia Ramirez, Fiona C. Whiting, Graham A. Boustead, Lisa K. Whalley, Trevor Ingham, Andrew R. Rickard, Rachel E. Dunmore, Dwayne E. Heard, Ally C. Lewis, Lucy J. Carpenter, Jacqui F. Hamilton, and Terry J. Dillon
Atmos. Chem. Phys., 18, 4039–4054, https://doi.org/10.5194/acp-18-4039-2018, https://doi.org/10.5194/acp-18-4039-2018, 2018
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The lifetime of a chemical in the atmosphere is largely governed by the rate of its reaction with the hydroxyl radical (OH). Measurements of rates for many of the thousands of identified volatile organic compounds (VOCs) have yet to be determined experimentally. We have developed a new technique for the rapid determination of gas-phase rate coefficients for the simultaneous reactions between multiple VOCs and OH. The method is tasted across a range of scenarios and is used to derive new values.
Mike J. Newland, Patricia Martinerie, Emmanuel Witrant, Detlev Helmig, David R. Worton, Chris Hogan, William T. Sturges, and Claire E. Reeves
Atmos. Chem. Phys., 17, 8269–8283, https://doi.org/10.5194/acp-17-8269-2017, https://doi.org/10.5194/acp-17-8269-2017, 2017
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We report increasing levels of alkyl nitrates in the Northern Hemisphere atmosphere between 1960 and the mid-1990s. These increases are symptomatic of large-scale changes to the chemical composition of the atmosphere, particularly with regards to the amounts of short-lived, reactive species. The observed increases are likely driven by increasing levels of nitrogen oxides. These changes have direct implications for the lifetimes of climate-relevant species in the atmosphere, such as methane.
Chris Reed, Mathew J. Evans, Leigh R. Crilley, William J. Bloss, Tomás Sherwen, Katie A. Read, James D. Lee, and Lucy J. Carpenter
Atmos. Chem. Phys., 17, 4081–4092, https://doi.org/10.5194/acp-17-4081-2017, https://doi.org/10.5194/acp-17-4081-2017, 2017
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The source of ozone-depleting compounds in the remote troposphere has been thought to be long-range transport of secondary pollutants such as organic nitrates. Processing of organic nitrates to nitric acid and subsequent deposition on surfaces in the atmosphere was thought to remove these nitrates from the ozone–NOx–HOx cycle. We found through observation of NOx in the remote tropical troposphere at the Cape Verde Observatory that surface nitrates can be released back into the atmosphere.
Ajit Singh, William J. Bloss, and Francis D. Pope
Atmos. Chem. Phys., 17, 2085–2101, https://doi.org/10.5194/acp-17-2085-2017, https://doi.org/10.5194/acp-17-2085-2017, 2017
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Reduced visibility can indicate poor air quality. Using long-term visibility measurements, we explore the combined
influence of aerosol particle and gas characteristics, and meteorology on long-term visibility. The measured
data were fitted to a newly developed light-extinction model to generate predictions of historic aerosol and
gas scattering and absorbing properties. This approach allows for estimation of historic aerosol properties where measurements are not available.
Suad S. Al-Kindi, Francis D. Pope, David C. Beddows, William J. Bloss, and Roy M. Harrison
Atmos. Chem. Phys., 16, 15561–15579, https://doi.org/10.5194/acp-16-15561-2016, https://doi.org/10.5194/acp-16-15561-2016, 2016
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Oleic acid is a chemical substance which is emitted from cooking processes and is present as tiny particles in the atmosphere. The oleic acid in the particles reacts chemically with atmospheric ozone, causing substantial changes to the composition of the particles. This paper uses new techniques to explore these chemical reactions and the effect of humidity upon them. The significance of the results for the atmosphere is considered.
Mathew A. Stiller-Reeve, Céline Heuzé, William T. Ball, Rachel H. White, Gabriele Messori, Karin van der Wiel, Iselin Medhaug, Annemarie H. Eckes, Amee O'Callaghan, Mike J. Newland, Sian R. Williams, Matthew Kasoar, Hella Elisa Wittmeier, and Valerie Kumer
Hydrol. Earth Syst. Sci., 20, 2965–2973, https://doi.org/10.5194/hess-20-2965-2016, https://doi.org/10.5194/hess-20-2965-2016, 2016
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Scientific writing must improve and the key to long-term improvement of scientific writing lies with the early-career scientist (ECS). We introduce the ClimateSnack project, which aims to motivate ECSs to start writing groups around the world to improve their skills together. Writing groups offer many benefits but can be a challenge to keep going. Several ClimateSnack writing groups formed, and this paper examines why some of the groups flourished and others dissolved.
Chris Reed, Charlotte A. Brumby, Leigh R. Crilley, Louisa J. Kramer, William J. Bloss, Paul W. Seakins, James D. Lee, and Lucy J. Carpenter
Atmos. Meas. Tech., 9, 2483–2495, https://doi.org/10.5194/amt-9-2483-2016, https://doi.org/10.5194/amt-9-2483-2016, 2016
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A new method of measuring nitrous acid (HONO), a potent mediator of air quality in the atmosphere as well as an important indoor pollutant, is presented. The new method relies on simple, proven techniques already widely applied to other atmospheric compounds. The technique can be retrofitted to existing analysers at minimal cost, or developed into instruments capable of very fast measurement which allow for more complex analysis of the behaviour of HONO.
M. E. Jenkin, J. C. Young, and A. R. Rickard
Atmos. Chem. Phys., 15, 11433–11459, https://doi.org/10.5194/acp-15-11433-2015, https://doi.org/10.5194/acp-15-11433-2015, 2015
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Atmospheric isoprene oxidation has an important effect on the formation of pollutants such as ozone and particles. A reliable representation is an essential component of climate change/air quality models. Systematic updates to the detailed chemistry in the MCM are described, with reference to recently reported kinetic/mechanistic data. Results of box model calculations are used to illustrate the impacts of the updates, with particular focus on the key atmospheric cycles involving HOx and NOx.
R. E. Dunmore, J. R. Hopkins, R. T. Lidster, J. D. Lee, M. J. Evans, A. R. Rickard, A. C. Lewis, and J. F. Hamilton
Atmos. Chem. Phys., 15, 9983–9996, https://doi.org/10.5194/acp-15-9983-2015, https://doi.org/10.5194/acp-15-9983-2015, 2015
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Technological shifts between fuel sources have had unexpected impacts on atmospheric composition and these significant changes can go undetected if source-specific monitoring infrastructure is not in place. We present chemically comprehensive, continuous measurements of organic compounds in a developed megacity (London), that show diesel-related hydrocarbons can dominate reactive carbon and ozone formation potential, highlighting a serious underestimation of this source in emission inventories.
M. J. Newland, A. R. Rickard, L. Vereecken, A. Muñoz, M. Ródenas, and W. J. Bloss
Atmos. Chem. Phys., 15, 9521–9536, https://doi.org/10.5194/acp-15-9521-2015, https://doi.org/10.5194/acp-15-9521-2015, 2015
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Stabilised Criegee intermediates (SCIs) are formed through alkene-ozone reactions, which occur throughout the atmospheric boundary layer. Recent direct laboratory studies have shown that SCI react rapidly with SO2, NO2 and other trace gases, affecting air quality and climate. We present experimental data from the EUPHORE atmospheric simulation chamber, in which we determine the effects of the ozonolysis of isoprene, on the oxidation of SO2 as a function of H2O and dimethyl sulfide concentration.
P. S. Monks, A. T. Archibald, A. Colette, O. Cooper, M. Coyle, R. Derwent, D. Fowler, C. Granier, K. S. Law, G. E. Mills, D. S. Stevenson, O. Tarasova, V. Thouret, E. von Schneidemesser, R. Sommariva, O. Wild, and M. L. Williams
Atmos. Chem. Phys., 15, 8889–8973, https://doi.org/10.5194/acp-15-8889-2015, https://doi.org/10.5194/acp-15-8889-2015, 2015
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Ozone holds a certain fascination in atmospheric science. It is ubiquitous in the atmosphere, central to tropospheric oxidation chemistry, and yet harmful to human and ecosystem health as well as being an important greenhouse gas. It is not emitted into the atmosphere but is a byproduct of the very oxidation chemistry it largely initiates. This review examines current understanding of the processes regulating tropospheric ozone at global to local scales from both measurements and models.
K. P. Wyche, P. S. Monks, K. L. Smallbone, J. F. Hamilton, M. R. Alfarra, A. R. Rickard, G. B. McFiggans, M. E. Jenkin, W. J. Bloss, A. C. Ryan, C. N. Hewitt, and A. R. MacKenzie
Atmos. Chem. Phys., 15, 8077–8100, https://doi.org/10.5194/acp-15-8077-2015, https://doi.org/10.5194/acp-15-8077-2015, 2015
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This paper describes a new ensemble methodology for the statistical analysis of atmospheric gas- & particle-phase composition data sets. The methodology reduces the huge amount of data derived from many chamber experiments to show that organic reactivity & resultant particle formation can be mapped into unique clusters in statistical space. The model generated is used to map more realistic plant mesocosm oxidation data, the projection of which gives insight into reactive pathways & precursors.
L. R. Crilley, W. J. Bloss, J. Yin, D. C. S. Beddows, R. M. Harrison, J. D. Allan, D. E. Young, M. Flynn, P. Williams, P. Zotter, A. S. H. Prevot, M. R. Heal, J. F. Barlow, C. H. Halios, J. D. Lee, S. Szidat, and C. Mohr
Atmos. Chem. Phys., 15, 3149–3171, https://doi.org/10.5194/acp-15-3149-2015, https://doi.org/10.5194/acp-15-3149-2015, 2015
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Wood is a renewable fuel but its combustion for residential heating releases a number of locally acting air pollutants, most notably particulate matter known to have adverse effects on human health. This paper used chemical tracers for wood smoke to estimate the contribution that burning wood makes to concentrations of airborne particles in the atmosphere of southern England and most particularly in London.
J. W. Taylor, J. D. Allan, G. Allen, H. Coe, P. I. Williams, M. J. Flynn, M. Le Breton, J. B. A. Muller, C. J. Percival, D. Oram, G. Forster, J. D. Lee, A. R. Rickard, M. Parrington, and P. I. Palmer
Atmos. Chem. Phys., 14, 13755–13771, https://doi.org/10.5194/acp-14-13755-2014, https://doi.org/10.5194/acp-14-13755-2014, 2014
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We present a case study of BC wet removal by examining aerosol properties in three biomass burning plumes, one of which passed through a precipitating cloud. Nucleation scavenging preferentially removed the largest and most coated BC-containing particles. Calculated single-scattering albedo (SSA) showed little variation, as a large number of non-BC particles were also present in the precipitation-affected plume.
R. T. Lidster, J. F. Hamilton, J. D. Lee, A. C. Lewis, J. R. Hopkins, S. Punjabi, A. R. Rickard, and J. C. Young
Atmos. Chem. Phys., 14, 6677–6693, https://doi.org/10.5194/acp-14-6677-2014, https://doi.org/10.5194/acp-14-6677-2014, 2014
K. L. Pereira, J. F. Hamilton, A. R. Rickard, W. J. Bloss, M. S. Alam, M. Camredon, A. Muñoz, M. Vázquez, E. Borrás, and M. Ródenas
Atmos. Chem. Phys., 14, 5349–5368, https://doi.org/10.5194/acp-14-5349-2014, https://doi.org/10.5194/acp-14-5349-2014, 2014
X. Pang, A. C. Lewis, A. R. Rickard, M. T. Baeza-Romero, T. J. Adams, S. M. Ball, M. J. S. Daniels, I. C. A. Goodall, P. S. Monks, S. Peppe, M. Ródenas García, P. Sánchez, and A. Muñoz
Atmos. Meas. Tech., 7, 373–389, https://doi.org/10.5194/amt-7-373-2014, https://doi.org/10.5194/amt-7-373-2014, 2014
M. Dall'Osto, X. Querol, A. Alastuey, M. C. Minguillon, M. Alier, F. Amato, M. Brines, M. Cusack, J. O. Grimalt, A. Karanasiou, T. Moreno, M. Pandolfi, J. Pey, C. Reche, A. Ripoll, R. Tauler, B. L. Van Drooge, M. Viana, R. M. Harrison, J. Gietl, D. Beddows, W. Bloss, C. O'Dowd, D. Ceburnis, G. Martucci, N. L. Ng, D. Worsnop, J. Wenger, E. Mc Gillicuddy, J. Sodeau, R. Healy, F. Lucarelli, S. Nava, J. L. Jimenez, F. Gomez Moreno, B. Artinano, A. S. H. Prévôt, L. Pfaffenberger, S. Frey, F. Wilsenack, D. Casabona, P. Jiménez-Guerrero, D. Gross, and N. Cots
Atmos. Chem. Phys., 13, 8991–9019, https://doi.org/10.5194/acp-13-8991-2013, https://doi.org/10.5194/acp-13-8991-2013, 2013
M. Parrington, P. I. Palmer, A. C. Lewis, J. D. Lee, A. R. Rickard, P. Di Carlo, J. W. Taylor, J. R. Hopkins, S. Punjabi, D. E. Oram, G. Forster, E. Aruffo, S. J. Moller, S. J.-B. Bauguitte, J. D. Allan, H. Coe, and R. J. Leigh
Atmos. Chem. Phys., 13, 7321–7341, https://doi.org/10.5194/acp-13-7321-2013, https://doi.org/10.5194/acp-13-7321-2013, 2013
P. I. Palmer, M. Parrington, J. D. Lee, A. C. Lewis, A. R. Rickard, P. F. Bernath, T. J. Duck, D. L. Waugh, D. W. Tarasick, S. Andrews, E. Aruffo, L. J. Bailey, E. Barrett, S. J.-B. Bauguitte, K. R. Curry, P. Di Carlo, L. Chisholm, L. Dan, G. Forster, J. E. Franklin, M. D. Gibson, D. Griffin, D. Helmig, J. R. Hopkins, J. T. Hopper, M. E. Jenkin, D. Kindred, J. Kliever, M. Le Breton, S. Matthiesen, M. Maurice, S. Moller, D. P. Moore, D. E. Oram, S. J. O'Shea, R. C. Owen, C. M. L. S. Pagniello, S. Pawson, C. J. Percival, J. R. Pierce, S. Punjabi, R. M. Purvis, J. J. Remedios, K. M. Rotermund, K. M. Sakamoto, A. M. da Silva, K. B. Strawbridge, K. Strong, J. Taylor, R. Trigwell, K. A. Tereszchuk, K. A. Walker, D. Weaver, C. Whaley, and J. C. Young
Atmos. Chem. Phys., 13, 6239–6261, https://doi.org/10.5194/acp-13-6239-2013, https://doi.org/10.5194/acp-13-6239-2013, 2013
M. J. Newland, C. E. Reeves, D. E. Oram, J. C. Laube, W. T. Sturges, C. Hogan, P. Begley, and P. J. Fraser
Atmos. Chem. Phys., 13, 5551–5565, https://doi.org/10.5194/acp-13-5551-2013, https://doi.org/10.5194/acp-13-5551-2013, 2013
A. C. Lewis, M. J. Evans, J. R. Hopkins, S. Punjabi, K. A. Read, R. M. Purvis, S. J. Andrews, S. J. Moller, L. J. Carpenter, J. D. Lee, A. R. Rickard, P. I. Palmer, and M. Parrington
Atmos. Chem. Phys., 13, 851–867, https://doi.org/10.5194/acp-13-851-2013, https://doi.org/10.5194/acp-13-851-2013, 2013
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Modeling of land–surface interactions in the PALM model system 6.0: land surface model description, first evaluation, and sensitivity to model parameters
Improvements to the representation of BVOC chemistry–climate interactions in UKCA (v11.5) with the CRI-Strat 2 mechanism: incorporation and evaluation
Extension of a gaseous dry deposition algorithm to oxidized volatile organic compounds and hydrogen cyanide for application in chemistry transport models
iNRACM: incorporating 15N into the Regional Atmospheric Chemistry Mechanism (RACM) for assessing the role photochemistry plays in controlling the isotopic composition of NOx, NOy, and atmospheric nitrate
Latent Linear Adjustment Autoencoder v1.0: a novel method for estimating and emulating dynamic precipitation at high resolution
Validation of the PALM model system 6.0 in a real urban environment: a case study in Dejvice, Prague, the Czech Republic
Data reduction for inverse modeling: an adaptive approach v1.0
Comparison of source apportionment approaches and analysis of non-linearity in a real case model application
APFoam 1.0: integrated computational fluid dynamics simulation of O3–NOx–volatile organic compound chemistry and pollutant dispersion in a typical street canyon
Exploring deep learning for air pollutant emission estimation
Model intercomparison of COSMO 5.0 and IFS 45r1 at kilometer-scale grid spacing
urbanChemFoam 1.0: large-eddy simulation of non-stationary chemical transport of traffic emissions in an idealized street canyon
Impact of Initialized Land Surface Temperature and Snowpack on Subseasonal to Seasonal Prediction Project, Phase I (LS4P-I): organization and experimental design
Sensitivity analysis of the PALM model system 6.0 in the urban environment
Investigating the importance of sub-grid particle formation in point source plumes over eastern China using IAP-AACM v1.0 with a sub-grid parameterization
SCARLET-1.0: SpheriCal Approximation for viRtuaL aggrEgaTes
BARRA v1.0: kilometre-scale downscaling of an Australian regional atmospheric reanalysis over four midlatitude domains
WOMBAT v1.0: A fully Bayesian global flux-inversion framework
Grid-independent high-resolution dust emissions (v1.0) for chemical transport models: application to GEOS-Chem (12.5.0)
High-resolution modeling the distribution of surface air pollutants and their intercontinental transport by a global tropospheric atmospheric chemistry source-receptor model (GNAQPMS-SM)
Oxidation of low-molecular-weight organic compounds in cloud droplets: development of the Jülich Aqueous-phase Mechanism of Organic Chemistry (JAMOC) in CAABA/MECCA (version 4.5.0)
Prediction of source contributions to urban background PM10 concentrations in European cities: a case study for an episode in December 2016 using EMEP/MSC-W rv4.15 – Part 2: The city contribution
Vertical structure of cloud radiative heating in the tropics: confronting the EC-Earth v3.3.1/3P model with satellite observations
Evaluation of the offline-coupled GFSv15–FV3–CMAQv5.0.2 in support of the next-generation National Air Quality Forecast Capability over the contiguous United States
MSDM v1.0: A machine learning model for precipitation nowcasting over eastern China using multisource data
A climatology of tropical wind shear produced by clustering wind profiles from the Met Office Unified Model (GA7.0)
Surface representation impacts on turbulent heat fluxes in the Weather Research and Forecasting (WRF) model (v.4.1.3)
Evaluation of global EMEP MSC-W (rv4.34)-WRF (v3.9.1.1) model surface concentrations and wet deposition of reactive N and S with measurements
Effects of heterogeneous reactions on tropospheric chemistry: a global simulation with the chemistry–climate model CHASER V4.0
Development of a large-eddy simulation subgrid model based on artificial neural networks: a case study of turbulent channel flow
WRF-GC (v2.0): online two-way coupling of WRF (v3.9.1.1) and GEOS-Chem (v12.7.2) for modeling regional atmospheric chemistry–meteorology interactions
Laurent Menut, Bertrand Bessagnet, Régis Briant, Arineh Cholakian, Florian Couvidat, Sylvain Mailler, Romain Pennel, Guillaume Siour, Paolo Tuccella, Solène Turquety, and Myrto Valari
Geosci. Model Dev., 14, 6781–6811, https://doi.org/10.5194/gmd-14-6781-2021, https://doi.org/10.5194/gmd-14-6781-2021, 2021
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The CHIMERE chemistry-transport model is presented in its new version, V2020r1. Many changes are proposed compared to the previous version. These include online modeling, new parameterizations for aerosols, new emissions schemes, a new parameter file format, the subgrid-scale variability of urban concentrations and new transport schemes.
Sebastian Buschow and Petra Friederichs
Geosci. Model Dev., 14, 6765–6780, https://doi.org/10.5194/gmd-14-6765-2021, https://doi.org/10.5194/gmd-14-6765-2021, 2021
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When insects fill the lower kilometers of the atmosphere, they get caught in the convergent parts of the wind field. Their concentration visualizes the otherwise invisible circulation on radar images. This study shows how clear-air radar data can be compared to simulated wind fields in terms of scale, anisotropy, and direction. Despite known difficulties with simulating these near-surface wind systems, we find decent agreement between a long-term simulation and the German radar mosaic.
Timothy H. Raupach, Andrey Martynov, Luca Nisi, Alessandro Hering, Yannick Barton, and Olivia Martius
Geosci. Model Dev., 14, 6495–6514, https://doi.org/10.5194/gmd-14-6495-2021, https://doi.org/10.5194/gmd-14-6495-2021, 2021
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When simulated thunderstorms are compared to observations or other simulations, a match between overall storm properties is often more important than exact matches to individual storms. We tested a comparison method that uses a thunderstorm tracking algorithm to characterise simulated storms. For May 2018 in Switzerland, the method produced reasonable matches to independent observations for most storm properties, showing its feasibility for summarising simulated storms over mountainous terrain.
Martina Klose, Oriol Jorba, María Gonçalves Ageitos, Jeronimo Escribano, Matthew L. Dawson, Vincenzo Obiso, Enza Di Tomaso, Sara Basart, Gilbert Montané Pinto, Francesca Macchia, Paul Ginoux, Juan Guerschman, Catherine Prigent, Yue Huang, Jasper F. Kok, Ron L. Miller, and Carlos Pérez García-Pando
Geosci. Model Dev., 14, 6403–6444, https://doi.org/10.5194/gmd-14-6403-2021, https://doi.org/10.5194/gmd-14-6403-2021, 2021
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Mineral soil dust is a major atmospheric airborne particle type. We present and evaluate MONARCH, a model used for regional and global dust-weather prediction. An important feature of the model is that it allows different approximations to represent dust, ranging from more simplified to more complex treatments. Using these different treatments, MONARCH can help us better understand impacts of dust in the Earth system, such as its interactions with radiation.
Dandan Wei, Hariprasad D. Alwe, Dylan B. Millet, Brandon Bottorff, Michelle Lew, Philip S. Stevens, Joshua D. Shutter, Joshua L. Cox, Frank N. Keutsch, Qianwen Shi, Sarah C. Kavassalis, Jennifer G. Murphy, Krystal T. Vasquez, Hannah M. Allen, Eric Praske, John D. Crounse, Paul O. Wennberg, Paul B. Shepson, Alexander A. T. Bui, Henry W. Wallace, Robert J. Griffin, Nathaniel W. May, Megan Connor, Jonathan H. Slade, Kerri A. Pratt, Ezra C. Wood, Mathew Rollings, Benjamin L. Deming, Daniel C. Anderson, and Allison L. Steiner
Geosci. Model Dev., 14, 6309–6329, https://doi.org/10.5194/gmd-14-6309-2021, https://doi.org/10.5194/gmd-14-6309-2021, 2021
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Over the past decade, understanding of isoprene oxidation has improved, and proper representation of isoprene oxidation and isoprene-derived SOA (iSOA) formation in canopy–chemistry models is now recognized to be important for an accurate understanding of forest–atmosphere exchange. The updated FORCAsT version 2.0 improves the estimation of some isoprene oxidation products and is one of the few canopy models currently capable of simulating SOA formation from monoterpenes and isoprene.
Emanuele Emili and Mohammad El Aabaribaoune
Geosci. Model Dev., 14, 6291–6308, https://doi.org/10.5194/gmd-14-6291-2021, https://doi.org/10.5194/gmd-14-6291-2021, 2021
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This study presents the latest version of the global ozone reanalysis product developed at Cerfacs. The reanalysis is based on the assimilation of satellite data from the Infrared Atmospheric Sounding Interferometer (IASI) in the Météo-France chemical transport model. The results show that the quality of the ozone fields is comparable to current state-of-the-art systems and suggest that IASI provides useful information for ozone reanalyses, especially in the upper troposphere.
Mingshuai Zhang, Chun Zhao, Yuhan Yang, Qiuyan Du, Yonglin Shen, Shengfu Lin, Dasa Gu, Wenjing Su, and Cheng Liu
Geosci. Model Dev., 14, 6155–6175, https://doi.org/10.5194/gmd-14-6155-2021, https://doi.org/10.5194/gmd-14-6155-2021, 2021
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Biogenic volatile organic compounds (BVOCs) can influence atmospheric chemistry and secondary pollutant formation. This study examines the performance of different versions of the Model of Emissions of Gases and Aerosols from Nature (MEGAN) in modeling BVOCs and ozone and their sensitivities to vegetation distributions over eastern China. The results suggest more accurate vegetation distribution and measurements of BVOC emission fluxes are needed to reduce the uncertainties.
Hongyi Ding, Le Cao, Haimei Jiang, Wenxing Jia, Yong Chen, and Junling An
Geosci. Model Dev., 14, 6135–6153, https://doi.org/10.5194/gmd-14-6135-2021, https://doi.org/10.5194/gmd-14-6135-2021, 2021
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We performed a WRF model study to figure out the mechanism of how the change in minimum eddy diffusivity (Kzmin) in the planetary boundary layer (PBL) closure scheme (ACM2) affects the simulated near-surface temperature in Beijing, China. Moreover, the influence of changing Kzmin on the temperature prediction in areas with different land-use categories was studied. The model performance using a functional-type Kzmin for capturing the temperature change in this area was also clarified.
Lee T. Murray, Eric M. Leibensperger, Clara Orbe, Loretta J. Mickley, and Melissa Sulprizio
Geosci. Model Dev., 14, 5789–5823, https://doi.org/10.5194/gmd-14-5789-2021, https://doi.org/10.5194/gmd-14-5789-2021, 2021
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Chemical-transport models are tools used to study air pollution and inform public policy. However, they are limited by the availability of archived meteorology. Here, we describe how the GEOS-Chem chemical-transport model may now be driven by meteorology archived from a state-of-the-art general circulation model for past and future climates, allowing it to be used to explore the impact of climate change on air pollution and atmospheric composition.
Syuichi Itahashi, Rohit Mathur, Christian Hogrefe, Sergey L. Napelenok, and Yang Zhang
Geosci. Model Dev., 14, 5751–5768, https://doi.org/10.5194/gmd-14-5751-2021, https://doi.org/10.5194/gmd-14-5751-2021, 2021
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The Community Multiscale Air Quality (CMAQ) modeling system extended for hemispheric-scale applications (H-CMAQ) incorporated the satellite-constrained degassing SO2 emissions from 50 volcanos across the Northern Hemisphere. The impact on tropospheric sulfate aerosol (SO42−) is assessed for 2010. Although the considered volcanic emissions occurred at or below the middle of free troposphere (500 hPa), SO42− enhancements of more than 10 % were detected up to the top of free troposphere (250 hPa).
Annika Vogel and Hendrik Elbern
Geosci. Model Dev., 14, 5583–5605, https://doi.org/10.5194/gmd-14-5583-2021, https://doi.org/10.5194/gmd-14-5583-2021, 2021
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While atmospheric chemical forecasts rely on uncertain model parameters, their huge dimensions hamper an efficient uncertainty estimation. This study presents a novel approach to efficiently sample these uncertainties by extracting dominant dependencies and correlations. Applying the algorithm to biogenic emissions, their uncertainties can be estimated from a low number of dominant components. This states the capability of an efficient treatment of parameter uncertainties in atmospheric models.
Jianbing Jin, Arjo Segers, Hai Xiang Lin, Bas Henzing, Xiaohui Wang, Arnold Heemink, and Hong Liao
Geosci. Model Dev., 14, 5607–5622, https://doi.org/10.5194/gmd-14-5607-2021, https://doi.org/10.5194/gmd-14-5607-2021, 2021
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When discussing the accuracy of a dust forecast, the shape and position of the plume as well as the intensity are key elements. The position forecast determines which locations will be affected, while the intensity only describes the actual dust level. A dust forecast with position misfit directly results in incorrect timing profiles of dust loads. In this paper, an image-morphing-based data assimilation is designed for realigning a simulated dust plume to correct for the position error.
Timofei Sukhodolov, Tatiana Egorova, Andrea Stenke, William T. Ball, Christina Brodowsky, Gabriel Chiodo, Aryeh Feinberg, Marina Friedel, Arseniy Karagodin-Doyennel, Thomas Peter, Jan Sedlacek, Sandro Vattioni, and Eugene Rozanov
Geosci. Model Dev., 14, 5525–5560, https://doi.org/10.5194/gmd-14-5525-2021, https://doi.org/10.5194/gmd-14-5525-2021, 2021
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This paper features the new atmosphere–ocean–aerosol–chemistry–climate model SOCOLv4.0 and its validation. The model performance is evaluated against reanalysis products and observations of atmospheric circulation and trace gas distribution, with a focus on stratospheric processes. Although we identified some problems to be addressed in further model upgrades, we demonstrated that SOCOLv4.0 is already well suited for studies related to chemistry–climate–aerosol interactions.
Haipeng Lin, Daniel J. Jacob, Elizabeth W. Lundgren, Melissa P. Sulprizio, Christoph A. Keller, Thibaud M. Fritz, Sebastian D. Eastham, Louisa K. Emmons, Patrick C. Campbell, Barry Baker, Rick D. Saylor, and Raffaele Montuoro
Geosci. Model Dev., 14, 5487–5506, https://doi.org/10.5194/gmd-14-5487-2021, https://doi.org/10.5194/gmd-14-5487-2021, 2021
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Emissions are a central component of atmospheric chemistry models. The Harmonized Emissions Component (HEMCO) is a software component for computing emissions from a user-selected ensemble of emission inventories and algorithms. It allows users to select, add, and scale emissions from different sources through a configuration file with no change to the model source code. We demonstrate the implementation of HEMCO in several models, all sharing the same HEMCO core code and database library.
Eckhard Kadasch, Matthias Sühring, Tobias Gronemeier, and Siegfried Raasch
Geosci. Model Dev., 14, 5435–5465, https://doi.org/10.5194/gmd-14-5435-2021, https://doi.org/10.5194/gmd-14-5435-2021, 2021
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In this paper, we provide a technical description of a newly developed interface for coupling the PALM model system 6.0 to the weather prediction model COSMO. The interface allows users of PALM to simulate the detailed atmospheric flow for relatively small regions of tens of kilometres under specific weather conditions, for instance, periods around observation campaigns or extreme weather situations. We demonstrate the interface using a benchmark simulation.
Sebastien Massart, Niels Bormann, Massimo Bonavita, and Cristina Lupu
Geosci. Model Dev., 14, 5467–5485, https://doi.org/10.5194/gmd-14-5467-2021, https://doi.org/10.5194/gmd-14-5467-2021, 2021
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Numerical weather predictions combine data from satellites with atmospheric forecasts. Some satellites measure the radiance emitted by the Earth's surface. To use this data, one must have knowledge of the surface properties, like the temperature of the thin layer above the surface. Error in this temperature leads to a misuse of the satellite data and affects the quality of the weather forecast. We updated our approach to better estimate this temperature, which should help improve the forecast.
Saulo R. Freitas, Georg A. Grell, and Haiqin Li
Geosci. Model Dev., 14, 5393–5411, https://doi.org/10.5194/gmd-14-5393-2021, https://doi.org/10.5194/gmd-14-5393-2021, 2021
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Convection parameterization (CP) is a component of atmospheric models aiming to represent the statistical effects of subgrid-scale convective clouds. Because the atmosphere contains circulations with a broad spectrum of scales, the truncation needed to run models in computers requires the introduction of parameterizations to account for processes that are not explicitly resolved. We detail recent developments in the Grell–Freitas CP, which has been applied in several regional and global models.
Edmund Ryan and Oliver Wild
Geosci. Model Dev., 14, 5373–5391, https://doi.org/10.5194/gmd-14-5373-2021, https://doi.org/10.5194/gmd-14-5373-2021, 2021
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Atmospheric chemistry transport models are important tools to investigate the local, regional and global controls on atmospheric composition and air quality. In this study, we estimate some of the model parameters using machine learning and statistics. Our findings identify the level of error and spatial coverage in the O2 and CO data that are needed to achieve good parameter estimates. We also highlight the benefits of using multiple constraints to calibrate atmospheric chemistry models.
Antoine Berchet, Espen Sollum, Rona L. Thompson, Isabelle Pison, Joël Thanwerdas, Grégoire Broquet, Frédéric Chevallier, Tuula Aalto, Adrien Berchet, Peter Bergamaschi, Dominik Brunner, Richard Engelen, Audrey Fortems-Cheiney, Christoph Gerbig, Christine D. Groot Zwaaftink, Jean-Matthieu Haussaire, Stephan Henne, Sander Houweling, Ute Karstens, Werner L. Kutsch, Ingrid T. Luijkx, Guillaume Monteil, Paul I. Palmer, Jacob C. A. van Peet, Wouter Peters, Philippe Peylin, Elise Potier, Christian Rödenbeck, Marielle Saunois, Marko Scholze, Aki Tsuruta, and Yuanhong Zhao
Geosci. Model Dev., 14, 5331–5354, https://doi.org/10.5194/gmd-14-5331-2021, https://doi.org/10.5194/gmd-14-5331-2021, 2021
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We present here the Community Inversion Framework (CIF) to help rationalize development efforts and leverage the strengths of individual inversion systems into a comprehensive framework. The CIF is a programming protocol to allow various inversion bricks to be exchanged among researchers.
The ensemble of bricks makes a flexible, transparent and open-source Python-based tool. We describe the main structure and functionalities and demonstrate it in a simple academic case.
Katrin Frieda Gehrke, Matthias Sühring, and Björn Maronga
Geosci. Model Dev., 14, 5307–5329, https://doi.org/10.5194/gmd-14-5307-2021, https://doi.org/10.5194/gmd-14-5307-2021, 2021
James Weber, Scott Archer-Nicholls, Nathan Luke Abraham, Youngsub M. Shin, Thomas J. Bannan, Carl J. Percival, Asan Bacak, Paulo Artaxo, Michael Jenkin, M. Anwar H. Khan, Dudley E. Shallcross, Rebecca H. Schwantes, Jonathan Williams, and Alex T. Archibald
Geosci. Model Dev., 14, 5239–5268, https://doi.org/10.5194/gmd-14-5239-2021, https://doi.org/10.5194/gmd-14-5239-2021, 2021
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The new mechanism CRI-Strat 2 features state-of-the-art isoprene chemistry not previously available in UKCA and improves UKCA's ability to reproduce observed concentrations of isoprene, monoterpenes, and OH in tropical regions. The enhanced ability to model isoprene, the most widely emitted non-methane volatile organic compound (VOC), will allow understanding of how isoprene and other biogenic VOCs affect atmospheric composition and, through biosphere–atmosphere feedbacks, climate change.
Zhiyong Wu, Leiming Zhang, John T. Walker, Paul A. Makar, Judith A. Perlinger, and Xuemei Wang
Geosci. Model Dev., 14, 5093–5105, https://doi.org/10.5194/gmd-14-5093-2021, https://doi.org/10.5194/gmd-14-5093-2021, 2021
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A community dry deposition algorithm for modeling the gaseous dry deposition process in chemistry transport models was extended to include an additional 12 oxidized volatile organic compounds and hydrogen cyanide based on their physicochemical properties and was then evaluated using field flux measurements over a mixed forest. This study provides a useful tool that is needed in chemistry transport models with increasing complexity for simulating an important atmospheric process.
Huan Fang, Wendell W. Walters, David Mase, and Greg Michalski
Geosci. Model Dev., 14, 5001–5022, https://doi.org/10.5194/gmd-14-5001-2021, https://doi.org/10.5194/gmd-14-5001-2021, 2021
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A new photochemical reaction scheme that incorporates nitrogen isotopes has been developed to simulate isotope tracers in air pollution. The model contains 16 N compounds, and 96 reactions involving N used in the Regional Atmospheric Chemistry Mechanism (RACM) were replicated using 15N in a new mechanism called iNRACM. The model is able to predict d15N variations in NOx, HONO, and HNO3 that are similar to those observed in aerosol and gases in the troposphere.
Christina Heinze-Deml, Sebastian Sippel, Angeline G. Pendergrass, Flavio Lehner, and Nicolai Meinshausen
Geosci. Model Dev., 14, 4977–4999, https://doi.org/10.5194/gmd-14-4977-2021, https://doi.org/10.5194/gmd-14-4977-2021, 2021
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Quantifying dynamical and thermodynamical components of regional precipitation change is a key challenge in climate science. We introduce a novel statistical model (Latent Linear Adjustment Autoencoder) that combines the flexibility of deep neural networks with the robustness advantages of linear regression. The method enables estimation of the contribution of a coarse-scale atmospheric circulation proxy to daily precipitation at high resolution and in a spatially coherent manner.
Jaroslav Resler, Kryštof Eben, Jan Geletič, Pavel Krč, Martin Rosecký, Matthias Sühring, Michal Belda, Vladimír Fuka, Tomáš Halenka, Peter Huszár, Jan Karlický, Nina Benešová, Jana Ďoubalová, Kateřina Honzáková, Josef Keder, Šárka Nápravníková, and Ondřej Vlček
Geosci. Model Dev., 14, 4797–4842, https://doi.org/10.5194/gmd-14-4797-2021, https://doi.org/10.5194/gmd-14-4797-2021, 2021
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We describe validation of the PALM model v6.0 against measurements collected during two observational campaigns in Dejvice, Prague. The study focuses on the evaluation of the newly developed or improved radiative and energy balance modules in PALM related to urban modelling. In addition to the energy-related quantities, it also evaluates air flow and air quality under street canyon conditions.
Xiaoling Liu, August L. Weinbren, He Chang, Jovan M. Tadić, Marikate E. Mountain, Michael E. Trudeau, Arlyn E. Andrews, Zichong Chen, and Scot M. Miller
Geosci. Model Dev., 14, 4683–4696, https://doi.org/10.5194/gmd-14-4683-2021, https://doi.org/10.5194/gmd-14-4683-2021, 2021
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Observations of greenhouse gases have become far more numerous in recent years due to new satellite observations. The sheer size of these datasets makes it challenging to incorporate these data into statistical models and use these data to estimate greenhouse gas sources and sinks. In this paper, we develop an approach to reduce the size of these datasets while preserving the most information possible. We subsequently test this approach using satellite observations of carbon dioxide.
Claudio A. Belis, Guido Pirovano, Maria Gabriella Villani, Giuseppe Calori, Nicola Pepe, and Jean Philippe Putaud
Geosci. Model Dev., 14, 4731–4750, https://doi.org/10.5194/gmd-14-4731-2021, https://doi.org/10.5194/gmd-14-4731-2021, 2021
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The study presents an in-depth analysis of the implications that using different CTM source apportionment approaches (tagged species and brute force) have for the source allocation of secondary inorganic aerosol, an important component of PM10 and PM2.5. A set of runs combining different emission levels and models was carried out, aiming to describe the situations in which strong non-linearity may lead the two approaches to deliver different results and when they are expected to be comparable.
Luolin Wu, Jian Hang, Xuemei Wang, Min Shao, and Cheng Gong
Geosci. Model Dev., 14, 4655–4681, https://doi.org/10.5194/gmd-14-4655-2021, https://doi.org/10.5194/gmd-14-4655-2021, 2021
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In order to investigate street-scale flow and air quality, this study has developed APFoam 1.0 to examine the reactive pollutant formation and dispersion in the urban area. The model has been validated and shows good agreement with wind tunnel experimental data. Model sensitivity cases reveal that vehicle emissions, background concentrations, and wind conditions are the key factors affecting the photochemical reaction process.
Lin Huang, Song Liu, Zeyuan Yang, Jia Xing, Jia Zhang, Jiang Bian, Siwei Li, Shovan Kumar Sahu, Shuxiao Wang, and Tie-Yan Liu
Geosci. Model Dev., 14, 4641–4654, https://doi.org/10.5194/gmd-14-4641-2021, https://doi.org/10.5194/gmd-14-4641-2021, 2021
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Accurate estimation of emissions is a prerequisite for effectively controlling air pollution, but current methods lack either sufficient data or a representation of nonlinearity. Here, we proposed a novel deep learning method to model the dual relationship between emissions and pollutant concentrations. Emissions can be updated by back-propagating the gradient of the loss function measuring the deviation between simulations and observations, resulting in better model performance.
Christian Zeman, Nils P. Wedi, Peter D. Dueben, Nikolina Ban, and Christoph Schär
Geosci. Model Dev., 14, 4617–4639, https://doi.org/10.5194/gmd-14-4617-2021, https://doi.org/10.5194/gmd-14-4617-2021, 2021
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Kilometer-scale atmospheric models allow us to partially resolve thunderstorms and thus improve their representation. We present an intercomparison between two distinct atmospheric models for 2 summer days with heavy thunderstorms over Europe. We show the dependence of precipitation and vertical wind speed on spatial and temporal resolution and also discuss the possible influence of the system of equations, numerical methods, and diffusion in the models.
Edward C. Chan and Timothy M. Butler
Geosci. Model Dev., 14, 4555–4572, https://doi.org/10.5194/gmd-14-4555-2021, https://doi.org/10.5194/gmd-14-4555-2021, 2021
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A large-eddy simulation based chemical transport model is implemented for an idealized street canyon. The dynamics of the model are evaluated using stationary measurements. A transient model run is also conducted over a 24 h period, where variations of pollutant concentrations indicate dependence on emissions, background concentrations, and solar state. Comparison stationary model runs show changes in flow structure concentrations.
Yongkang Xue, Tandong Yao, Aaron A. Boone, Ismaila Diallo, Ye Liu, Xubin Zeng, William K. M. Lau, Shiori Sugimoto, Qi Tang, Xiaoduo Pan, Peter J. van Oevelen, Daniel Klocke, Myung-Seo Koo, Tomonori Sato, Zhaohui Lin, Yuhei Takaya, Constantin Ardilouze, Stefano Materia, Subodh K. Saha, Retish Senan, Tetsu Nakamura, Hailan Wang, Jing Yang, Hongliang Zhang, Mei Zhao, Xin-Zhong Liang, J. David Neelin, Frederic Vitart, Xin Li, Ping Zhao, Chunxiang Shi, Weidong Guo, Jianping Tang, Miao Yu, Yun Qian, Samuel S. P. Shen, Yang Zhang, Kun Yang, Ruby Leung, Yuan Qiu, Daniele Peano, Xin Qi, Yanling Zhan, Michael A. Brunke, Sin Chan Chou, Michael Ek, Tianyi Fan, Hong Guan, Hai Lin, Shunlin Liang, Helin Wei, Shaocheng Xie, Haoran Xu, Weiping Li, Xueli Shi, Paulo Nobre, Yan Pan, Yi Qin, Jeff Dozier, Craig R. Ferguson, Gianpaolo Balsamo, Qing Bao, Jinming Feng, Jinkyu Hong, Songyou Hong, Huilin Huang, Duoying Ji, Zhenming Ji, Shichang Kang, Yanluan Lin, Weiguang Liu, Ryan Muncaster, Patricia de Rosnay, Hiroshi G. Takahashi, Guiling Wang, Shuyu Wang, Weicai Wang, Xu Zhou, and Yuejian Zhu
Geosci. Model Dev., 14, 4465–4494, https://doi.org/10.5194/gmd-14-4465-2021, https://doi.org/10.5194/gmd-14-4465-2021, 2021
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The subseasonal prediction of extreme hydroclimate events such as droughts/floods has remained stubbornly low for years. This paper presents a new international initiative which, for the first time, introduces spring land surface temperature anomalies over high mountains to improve precipitation prediction through remote effects of land–atmosphere interactions. More than 40 institutions worldwide are participating in this effort. The experimental protocol and preliminary results are presented.
Michal Belda, Jaroslav Resler, Jan Geletič, Pavel Krč, Björn Maronga, Matthias Sühring, Mona Kurppa, Farah Kanani-Sühring, Vladimír Fuka, Kryštof Eben, Nina Benešová, and Mikko Auvinen
Geosci. Model Dev., 14, 4443–4464, https://doi.org/10.5194/gmd-14-4443-2021, https://doi.org/10.5194/gmd-14-4443-2021, 2021
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The analysis summarizes how sensitive the modelling of urban environment is to changes in physical parameters describing the city (e.g. reflectivity of surfaces) and to several heat island mitigation scenarios in a city quarter in Prague, Czech Republic. We used the large-eddy simulation modelling system PALM 6.0. Surface parameters connected to radiation show the highest sensitivity in this configuration. For heat island mitigation, urban vegetation is shown to be the most effective measure.
Ying Wei, Xueshun Chen, Huansheng Chen, Yele Sun, Wenyi Yang, Huiyun Du, Qizhong Wu, Dan Chen, Xiujuan Zhao, Jie Li, and Zifa Wang
Geosci. Model Dev., 14, 4411–4428, https://doi.org/10.5194/gmd-14-4411-2021, https://doi.org/10.5194/gmd-14-4411-2021, 2021
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The sub-grid particle formation (SGPF) in plumes plays an important role in air pollution and climate. We coupled an SGPF scheme to a chemical transport model with an aerosol microphysics module and applied it to investigate the SGPF impact over China. The scheme clearly improved the model performance in simulating aerosol components and particle number at typical sites influenced by point sources. The results indicate the significant effects of SGPF on aerosol particles in industrial areas.
Eduardo Rossi and Costanza Bonadonna
Geosci. Model Dev., 14, 4379–4400, https://doi.org/10.5194/gmd-14-4379-2021, https://doi.org/10.5194/gmd-14-4379-2021, 2021
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SCARLET-1.0 is a MATLAB package that creates virtual aggregates starting from a population of irregular shapes. Shapes are described in terms of the Standard Triangulation Language (STL) format, and this allows importing a great variety of shapes, such as from 3D scanning. The package produces a new STL file as an output and different analytical information about the packing, such as the porosity. It has been specifically designed for use in volcanology and scientific education.
Chun-Hsu Su, Nathan Eizenberg, Dörte Jakob, Paul Fox-Hughes, Peter Steinle, Christopher J. White, and Charmaine Franklin
Geosci. Model Dev., 14, 4357–4378, https://doi.org/10.5194/gmd-14-4357-2021, https://doi.org/10.5194/gmd-14-4357-2021, 2021
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The Bureau of Meteorology Atmospheric Regional Reanalysis for Australia (BARRA) has produced a very high-resolution reconstruction of Australian historical weather from 1990 to 2018. This paper demonstrates the added weather and climate information to supplement coarse- or moderate-resolution regional and global reanalyses. The new climate data can allow greater understanding of past weather, including extreme events, at very local kilometre scales.
Andrew Zammit-Mangion, Michael Bertolacci, Jenny Fisher, Ann Stavert, Matthew L. Rigby, Yi Cao, and Noel Cressie
Geosci. Model Dev. Discuss., https://doi.org/10.5194/gmd-2021-181, https://doi.org/10.5194/gmd-2021-181, 2021
Revised manuscript accepted for GMD
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We present a statistical framework for estimating the sources and sinks (flux) of carbon dioxide from satellite data. The framework is statistical, and yields measures of uncertainty alongside all estimates of flux and other parameters in the underlying model. It also allows us to generate other insights, such as the size of errors and biases in the data. The primary aim of this research was to develop a fully statistical flux inversion framework for use by atmospheric scientists.
Jun Meng, Randall V. Martin, Paul Ginoux, Melanie Hammer, Melissa P. Sulprizio, David A. Ridley, and Aaron van Donkelaar
Geosci. Model Dev., 14, 4249–4260, https://doi.org/10.5194/gmd-14-4249-2021, https://doi.org/10.5194/gmd-14-4249-2021, 2021
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Dust emissions in models, for example, GEOS-Chem, have a strong nonlinear dependence on meteorology, which means dust emission strengths calculated from different resolution meteorological fields are different. Offline high-resolution dust emissions with an optimized global dust strength, presented in this work, can be implemented into GEOS-Chem as offline emission inventory so that it could promote model development by harmonizing dust emissions across simulations of different resolutions.
Qian Ye, Jie Li, Xueshun Chen, Huansheng Chen, Wenyi Yang, Huiyun Du, Xiaole Pan, Xiao Tang, Wei Wang, Lili Zhu, Jianjun Li, Zhe Wang, and Zifa Wang
Geosci. Model Dev. Discuss., https://doi.org/10.5194/gmd-2021-201, https://doi.org/10.5194/gmd-2021-201, 2021
Revised manuscript accepted for GMD
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We developed a global tropospheric atmospheric chemistry source-receptor model. This model can quantify the contributions of multiple air pollutants from various source regions in one simulation without introducing the nonlinear error of atmospheric chemistry. The S-R relationships of PM2.5, O3 from a global high-resolution (0.5° × 0.5°) simulation were given and compared with previous studies. This model will be useful to help to create a link between the scientific community and policymakers.
Simon Rosanka, Rolf Sander, Andreas Wahner, and Domenico Taraborrelli
Geosci. Model Dev., 14, 4103–4115, https://doi.org/10.5194/gmd-14-4103-2021, https://doi.org/10.5194/gmd-14-4103-2021, 2021
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The Jülich Aqueous-phase Mechanism of Organic Chemistry (JAMOC) is developed and implemented into the Module Efficiently Calculating the Chemistry of the Atmosphere (MECCA). JAMOC is an explicit in-cloud oxidation scheme for oxygenated volatile organic compounds (OVOCs), which is suitable for global model applications. Within a box-model study, we show that JAMOC yields reduced gas-phase concentrations of most OVOCs and oxidants, except for nitrogen oxides.
Matthieu Pommier
Geosci. Model Dev., 14, 4143–4158, https://doi.org/10.5194/gmd-14-4143-2021, https://doi.org/10.5194/gmd-14-4143-2021, 2021
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Within the Copernicus Atmosphere Monitoring Service (CAMS), a forecasting system calculating the city source contribution for the surface urban background PM10 in European cities has been developed. The system uses the EMEP model and this paper presents the product by focusing on an event which occurred from 1 to 9 December 2016.
Erik Johansson, Abhay Devasthale, Michael Tjernström, Annica M. L. Ekman, Klaus Wyser, and Tristan L'Ecuyer
Geosci. Model Dev., 14, 4087–4101, https://doi.org/10.5194/gmd-14-4087-2021, https://doi.org/10.5194/gmd-14-4087-2021, 2021
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Understanding the coupling of clouds to large-scale circulation is a grand challenge for the climate community. Cloud radiative heating (CRH) is a key parameter in this coupling and is therefore essential to model realistically. We, therefore, evaluate a climate model against satellite observations. Our findings indicate good agreement in the seasonal pattern of CRH even if the magnitude differs. We also find that increasing the horizontal resolution in the model has little effect on the CRH.
Xiaoyang Chen, Yang Zhang, Kai Wang, Daniel Tong, Pius Lee, Youhua Tang, Jianping Huang, Patrick C. Campbell, Jeff Mcqueen, Havala O. T. Pye, Benjamin N. Murphy, and Daiwen Kang
Geosci. Model Dev., 14, 3969–3993, https://doi.org/10.5194/gmd-14-3969-2021, https://doi.org/10.5194/gmd-14-3969-2021, 2021
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The continuously updated National Air Quality Forecast Capability (NAQFC) provides air quality forecasts. To support the development of the next-generation NAQFC, we evaluate a prototype of GFSv15-CMAQv5.0.2. The performance and the potential improvements for the system are discussed. This study can provide a scientific basis for further development of NAQFC and help it to provide more accurate air quality forecasts to the public over the contiguous United States.
Dawei Li, Yudi Liu, and Chaohui Chen
Geosci. Model Dev., 14, 4019–4034, https://doi.org/10.5194/gmd-14-4019-2021, https://doi.org/10.5194/gmd-14-4019-2021, 2021
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In the daily weather forecast business, numerical weather prediction is mainly used to forecast precipitation, but its performance for nowcasting tasks within 0–2 h is very poor. Hence, we hope to use machine learning to improve the accuracy and resolution of quantitative precipitation nowcasting (QPN) tasks. Previous works focused on the extrapolation of radar echo without using abundant meteorological data. Therefore, we designed a model using three kinds of data for QPN in eastern china.
Mark R. Muetzelfeldt, Robert S. Plant, Peter A. Clark, Alison J. Stirling, and Steven J. Woolnough
Geosci. Model Dev., 14, 4035–4049, https://doi.org/10.5194/gmd-14-4035-2021, https://doi.org/10.5194/gmd-14-4035-2021, 2021
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Wind shear causes organized convection in the tropics, producing, e.g., squall lines. We have developed a procedure for producing a climatology of sheared wind profiles in a climate model and demonstrated that the profiles are linked with organized convection, both in terms of their structure and their spatio-temporal distribution. The procedure could be used to diagnose organization of convection in a climate model, which could lead to improvements in the model's representation of convection.
Carlos Román-Cascón, Marie Lothon, Fabienne Lohou, Oscar Hartogensis, Jordi Vila-Guerau de Arellano, David Pino, Carlos Yagüe, and Eric R. Pardyjak
Geosci. Model Dev., 14, 3939–3967, https://doi.org/10.5194/gmd-14-3939-2021, https://doi.org/10.5194/gmd-14-3939-2021, 2021
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The type of vegetation (or land cover) and its status influence the heat and water transfers between the surface and the air, affecting the processes that develop in the atmosphere at different (but connected) spatiotemporal scales. In this work, we investigate how these transfers are affected by the way the surface is represented in a widely used weather model. The results encourage including realistic high-resolution and updated land cover databases in models to improve their predictions.
Yao Ge, Mathew R. Heal, David S. Stevenson, Peter Wind, and Massimo Vieno
Geosci. Model Dev. Discuss., https://doi.org/10.5194/gmd-2021-166, https://doi.org/10.5194/gmd-2021-166, 2021
Revised manuscript accepted for GMD
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This study reports the first evaluation of the global EMEP MSC-W ACTM driven by WRF meteorology, with a focus on surface concentrations and wet deposition of reactive N and S species. The model-measurement comparison is conducted both spatially and temporally, covering 9 monitoring networks worldwide. The statistics from the comprehensive evaluations presented in this study support the application of this model framework for global analysis of the budgets and fluxes of reactive N and SIA.
Phuc T. M. Ha, Ryoki Matsuda, Yugo Kanaya, Fumikazu Taketani, and Kengo Sudo
Geosci. Model Dev., 14, 3813–3841, https://doi.org/10.5194/gmd-14-3813-2021, https://doi.org/10.5194/gmd-14-3813-2021, 2021
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Policies to mitigate air pollution require an understanding of tropospheric oxidizing capacity, which is controlled by mechanisms including heterogeneous processes on aerosols and clouds. This study uses a chemistry–climate model CHASER (MIROC) to explore the heterogeneous effects in the troposphere for -2.96 % O3, -2.19 % NOx, +3.28 % CO, and +5.91 % CH4 lifetime. Besides, these processes affect polluted areas and remote areas and can bring challenges to pollution reduction efforts.
Robin Stoffer, Caspar M. van Leeuwen, Damian Podareanu, Valeriu Codreanu, Menno A. Veerman, Martin Janssens, Oscar K. Hartogensis, and Chiel C. van Heerwaarden
Geosci. Model Dev., 14, 3769–3788, https://doi.org/10.5194/gmd-14-3769-2021, https://doi.org/10.5194/gmd-14-3769-2021, 2021
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Turbulent flows are often simulated with the large-eddy simulation (LES) technique, which requires subgrid models to account for the smallest scales. Current subgrid models often require strong simplifying assumptions. We therefore developed a subgrid model based on artificial neural networks, which requires fewer assumptions. Our data-driven SGS model showed high potential in accurately representing the smallest scales but still introduced instability when incorporated into an actual LES.
Xu Feng, Haipeng Lin, Tzung-May Fu, Melissa P. Sulprizio, Jiawei Zhuang, Daniel J. Jacob, Heng Tian, Yaping Ma, Lijuan Zhang, Xiaolin Wang, Qi Chen, and Zhiwei Han
Geosci. Model Dev., 14, 3741–3768, https://doi.org/10.5194/gmd-14-3741-2021, https://doi.org/10.5194/gmd-14-3741-2021, 2021
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WRF-GC is an online coupling of the WRF meteorological model and GEOS-Chem chemical transport model for regional atmospheric chemistry and air quality modeling. In WRF-GC v2.0, we implemented the aerosol–radiation interactions and aerosol–cloud interactions, as well as the capability to nest multiple domains for high-resolution simulations based on the modular framework of WRF-GC v1.0. This allows the GEOS-Chem users to investigate the meteorology–atmospheric chemistry interactions.
Cited articles
Abbatt, J., George, C., Melamed, M., Monks, P., Pandis, S., and Rudich, Y.:
Fundamentals of atmospheric chemistry: keeping a three-legged stool balanced,
Atmos. Environ., 84, 390–391, https://doi.org/10.1016/j.atmosenv.2013.10.025, 2014. a
Bloss, C., Wagner, V., Bonzanini, A., Jenkin, M. E., Wirtz, K., Martin-Reviejo, M., and Pilling, M. J.: Evaluation of detailed aromatic mechanisms (MCMv3 and MCMv3.1) against environmental chamber data, Atmos. Chem. Phys., 5, 623–639, https://doi.org/10.5194/acp-5-623-2005, 2005a. a
Bloss, C., Wagner, V., Jenkin, M. E., Volkamer, R., Bloss, W. J., Lee, J. D., Heard, D. E., Wirtz, K., Martin-Reviejo, M., Rea, G., Wenger, J. C., and Pilling, M. J.: Development of a detailed chemical mechanism (MCMv3.1) for the atmospheric oxidation of aromatic hydrocarbons, Atmos. Chem. Phys., 5, 641–664, https://doi.org/10.5194/acp-5-641-2005, 2005b. a
Bonet, F. J., Pérez-Pérez, R., Benito, B. M., de Albuquerque,
F. S., and Zamora, R.: Documenting, storing, and executing models in ecology:
a conceptual framework and real implementation in a global change monitoring
program, Environ. Modell. Softw., 52, 192–199,
https://doi.org/10.1016/j.envsoft.2013.10.027, 2014. a
Brauers, T., Hausmann, M., Bister, A., Kraus, A., and Dorn, H.-P.: OH
radicals in the boundary layer of the Atlantic Ocean: 1. Measurements by
long-path laser absorption spectroscopy, J. Geophys. Res., 106, 7399–7414,
https://doi.org/10.1029/2000JD900679, 2001. a
Brown, S. S., Stark, H., and Ravishankara, A. R.: Applicability of the steady
state approximation to the interpretation of atmospheric observations of
NO3 and N2O5, J. Geophys. Res., 108, 4539, https://doi.org/10.1029/2003JD003407,
2003. a
Brune, W. H., Baier, B. C., Thomas, J., Ren, X., Cohen, R. C., Pusede, S. E.,
Browne, E. C., Goldstein, A. H., Gentner, D. R., Keutsch, F. N., Thornton,
J. A., Harrold, S., Lopez-Hilfiker, F. D., and Wennberg, P. O.: Ozone
production chemistry in the presence of urban plumes, Faraday Discuss., 189,
169–189, https://doi.org/10.1039/C5FD00204D, 2016. a
Burkholder, J. B., Abbatt, J. P. D., Barnes, I., Roberts, J. M., Melamed,
M. L., Ammann, M., Bertram, A. K., Cappa, C. D., Carlton, A. G., Carpenter,
L. J., Crowley, J. N., Dubowski, Y., George, C., Heard, D. E., Herrmann, H.,
Keutsch, F. N., Kroll, J. H., McNeill, V. F., Ng, N. L., Nizkorodov, S. A.,
Orlando, J. J., Percival, C. J., Picquet-Varrault, B., Rudich, Y., Seakins,
P. W., Surratt, J. D., Tanimoto, H., Thornton, J. A., Tong, Z., Tyndall,
G. S., Wahner, A., Weschler, C. J., Wilson, K. R., and Ziemann, P. J.: The
essential role for laboratory studies in atmospheric chemistry, Environ. Sci.
Technol., 51, 2519–2528, https://doi.org/10.1021/acs.est.6b04947, 2017. a
Carslaw, N., Creasey, D. J., Heard, D. E., Lewis, A. C., McQuaid, J. B.,
Pilling, M. J., Monks, P. S., Bandy, B. J., and Penkett, S. A.: Modeling
OH, HO2, and RO2 radicals in the marine boundary layer: 1. Model
construction and comparison with field measurements, J. Geophys. Res., 104,
30241–30255, https://doi.org/10.1029/1999JD900783, 1999. a, b
Carter, W. P. L.: Computer modeling of environmental chamber measurements of
maximum incremental reactivities of volatile organic compounds, Atmos.
Environ., 29, 2513–2527, https://doi.org/10.1016/1352-2310(95)00150-W, 1995. a
Chen, G., Huey, L. G., Trainer, M., Nicks, D., Corbett, J., Ryerson, T.,
Parrish, D., Neuman, J. A., Nowak, J., Tanner, D., Holloway, J., Brock, C.,
Crawford, J., Olson, J. R., Sullivan, A., Weber, R., Schauffler, S.,
Donnelly, S., Atlas, E., Roberts, J., Flocke, F., Hübler, G., and
Fehsenfeld, F.: An investigation of the chemistry of ship emission plumes
during ITCT 2002, J. Geophys. Res., 110, D10S90,
https://doi.org/10.1029/2004JD005236, 2005. a
Chen, S., Ren, X., Mao, J., Chen, Z., Brune, W. H., Lefer, B.,
Rappenglück, B., Flynn, J., Olson, J., and Crawford, J. H.: A
comparison of chemical mechanisms based on TRAMP-2006 field data, Atmos.
Environ., 44, 4116–4125, https://doi.org/10.1016/j.atmosenv.2009.05.027, 2010. a
Chen, Y., Sexton, K. G., Jerry, R. E., Surratt, J. D., and Vizuete, W.:
Assessment of SAPRC07 with updated isoprene chemistry against outdoor
chamber experiments, Atmos. Environ., 105, 109–120,
https://doi.org/10.1016/j.atmosenv.2015.01.042, 2015. a
Curtis, A. R. and Sweetenham, W. P.: FACSIMILE/CHECKMAT user's manual, Tech.
rep., AEA Technology, Harwell, UK, 1987. a
Damian, V., Sandu, A., Damian, M., Potra, F., and Carmichael, G. R.: The
kinetic preprocessor KPP – a software environment for solving chemical
kinetics, Comput. Chem. Eng., 26, 1567–1579,
https://doi.org/10.1016/S0098-1354(02)00128-X, 2002. a
Derwent, R. G., Jenkin, M. E., Saunders, S. M., and Pilling, M. J.:
Photochemical ozone creation potentials for organic compounds in northwest
Europe calculated with a Master Chemical Mechanism, Atmos. Environ., 32,
2429–2441, https://doi.org/10.1016/S1352-2310(98)00053-3, 1998. a
Derwent, R. G., Jenkin, M. E., Saunders, S. M., Pilling, M. J., Simmonds,
P. G., Passant, N. R., Dollard, G. J., Dumitrean, P., and Kent, A.:
Photochemical ozone formation in north west Europe and its control, Atmos.
Environ., 37, 1983–1991, https://doi.org/10.1016/S1352-2310(03)00031-1, 2003. a, b
Edwards, P. M., Brown, S. S., Roberts, J. M., Ahmadov, R., Banta, R. M.,
de Gouw, J. A., Dubé, W. P., Field, R. A., Flynn, J. H., Gilman, J. B.,
Graus, M., Helmig, D., Koss, A., Langford, A. O., Lefer, B. L., Lerner,
B. M., Li, R., Li, S.-M., McKeen, S. A., Murphy, S. M., Parrish, D. D.,
Senff, C. J., Soltis, J., Stutz, J., Sweeney, C., Thompson, C. R., Trainer,
M. K., Tsai, C., Veres, P. R., Washenfelder, R. A., Warneke, C., Wild, R. J.,
Young, C. J., Yuan, B., and Zamora, R.: High winter ozone pollution from
carbonyl photolysis in an oil and gas basin, Nature, 514, 351–354,
https://doi.org/10.1038/nature13767, 2014. a
Eisele, F. L., Mount, G. H., Fehsenfeld, F. C., Harder, J., Marovich, E.,
Parrish, D. D., Roberts, J., Trainer, M., and Tanner, D.: Intercomparison of
tropospheric OH and ancillary trace gas measurements at Fritz Peak
Observatory, Colorado, J. Geophys. Res., 99, 18605,
https://doi.org/10.1029/94JD00740, 1994. a, b
Elshorbany, Y. F., Kurtenbach, R., Wiesen, P., Lissi, E., Rubio, M., Villena, G., Gramsch, E., Rickard, A. R., Pilling, M. J., and Kleffmann, J.: Oxidation capacity of the city air of Santiago, Chile, Atmos. Chem. Phys., 9, 2257–2273, https://doi.org/10.5194/acp-9-2257-2009, 2009. a, b
Emmerson, K. M. and Evans, M. J.: Comparison of tropospheric gas-phase chemistry schemes for use within global models, Atmos. Chem. Phys., 9, 1831–1845, https://doi.org/10.5194/acp-9-1831-2009, 2009. a, b
Emmerson, K. M., Carslaw, N., Carslaw, D. C., Lee, J. D., McFiggans, G., Bloss, W. J., Gravestock, T., Heard, D. E., Hopkins, J., Ingham, T., Pilling, M. J., Smith, S. C., Jacob, M., and Monks, P. S.: Free radical modelling studies during the UK TORCH Campaign in Summer 2003, Atmos. Chem. Phys., 7, 167–181, https://doi.org/10.5194/acp-7-167-2007, 2007. a, b
EUROCHAMP-2020: Database of Atmospheric Simulation Chamber Studies, available at: https://data.eurochamp.org/data-access/chamber-experiments/, last access: 16 January 2020. a
Hindmarsh, A. C., Brown, P. N., Grant, K. E., Lee, S. L., Serban, R., Shumaker,
D. E., and Woodward, C. S.: SUNDIALS: suite of nonlinear and
differential/algebraic equation solvers, ACM Trans. Math. Software, 31,
363–396, https://doi.org/10.1145/1089014.1089020, 2005. a
Ince, D. C., Hatton, L., and Graham-Cumming, J.: The case for open computer
programs, Nature, 482, 485–488, https://doi.org/10.1038/nature10836, 2012. a
Jenkin, M. E., Saunders, S. M., Derwent, R. G., and Pilling, M. J.: Development
of a reduced speciated VOC degradation mechanism for use in ozone models,
Atmos. Environ., 36, 4725–4734, https://doi.org/10.1016/S1352-2310(02)00563-0, 2002. a, b
Jenkin, M. E., Saunders, S. M., Wagner, V., and Pilling, M. J.: Protocol for the development of the Master Chemical Mechanism, MCM v3 (Part B): tropospheric degradation of aromatic volatile organic compounds, Atmos. Chem. Phys., 3, 181–193, https://doi.org/10.5194/acp-3-181-2003, 2003. a
Jenkin, M. E., Young, J. C., and Rickard, A. R.: The MCM v3.3.1 degradation scheme for isoprene, Atmos. Chem. Phys., 15, 11433–11459, https://doi.org/10.5194/acp-15-11433-2015, 2015. a
Jenkin, M. E., Khan, M. A. H., Shallcross, D. E., Bergström, R., Simpson,
D., Murphy, K. L. C., and Rickard, A. R.: The CRI v2.2 reduced degradation
scheme for isoprene, Atmos. Environ., 212, 172–182,
https://doi.org/10.1016/j.atmosenv.2019.05.055, 2019. a, b
Knote, C., Tuccella, P., Curci, G., Emmons, L., Orlando, J. J., Madronich, S.,
Baró, R., Jiménez-Guerrero, P., Luecken, D., Hogrefe, C., Forkel,
R., Werhahn, J., Hirtl, M., Pérez, J. L., José, R. S., Giordano,
L., Brunner, D., Yahya, K., and Zhang, Y.: Influence of the choice of
gas-phase mechanism on predictions of key gaseous pollutants during the
AQMEII phase-2 intercomparison, Atmos. Environ., 115, 553–568,
https://doi.org/10.1016/j.atmosenv.2014.11.066, 2015. a, b
Lu, K. D., Rohrer, F., Holland, F., Fuchs, H., Bohn, B., Brauers, T., Chang, C. C., Häseler, R., Hu, M., Kita, K., Kondo, Y., Li, X., Lou, S. R., Nehr, S., Shao, M., Zeng, L. M., Wahner, A., Zhang, Y. H., and Hofzumahaus, A.: Observation and modelling of OH and HO2 concentrations in the Pearl River Delta 2006: a missing OH source in a VOC rich atmosphere, Atmos. Chem. Phys., 12, 1541–1569, https://doi.org/10.5194/acp-12-1541-2012, 2012. a, b
Madronich, S.: The atmosphere and UV-B radiation at ground level, in:
Environmental UV Photobiology, edited by: Young, A. R., Moan, J., Björn,
L. O., and Nultsch, W., Springer, Boston, MA, 1–39,
https://doi.org/10.1007/978-1-4899-2406-3_1, 1993. a
Madronich, S.: Chemical evolution of gaseous air pollutants down-wind of
tropical megacities: Mexico City case study, Atmos. Environ., 40,
6012–6018, https://doi.org/10.1016/j.atmosenv.2005.08.047, 2006. a
Metzger, A., Dommen, J., Gaeggeler, K., Duplissy, J., Prevot, A. S. H., Kleffmann, J., Elshorbany, Y., Wisthaler, A., and Baltensperger, U.: Evaluation of 1,3,5 trimethylbenzene degradation in the detailed tropospheric chemistry mechanism, MCMv3.1, using environmental chamber data, Atmos. Chem. Phys., 8, 6453–6468, https://doi.org/10.5194/acp-8-6453-2008, 2008. a
NOAA Earth System Research Laboratory: Tropospheric Chemistry Measurements Database, available at: https://esrl.noaa.gov/csd/groups/csd7/measurements/, last access: 16 January
2020. a
Novelli, A., Kaminski, M., Rolletter, M., Acir, I.-H., Bohn, B., Dorn, H.-P., Li, X., Lutz, A., Nehr, S., Rohrer, F., Tillmann, R., Wegener, R., Holland, F., Hofzumahaus, A., Kiendler-Scharr, A., Wahner, A., and Fuchs, H.: Evaluation of OH and HO2 concentrations and their budgets during photooxidation of 2-methyl-3-butene-2-ol (MBO) in the atmospheric simulation chamber SAPHIR, Atmos. Chem. Phys., 18, 11409–11422, https://doi.org/10.5194/acp-18-11409-2018, 2018. a
Parrish, D. D., Allen, D. T., Bates, T. S., Estes, M., Fehsenfeld, F. C.,
Feingold, G., Ferrare, R., Hardesty, R. M., Meagher, J. F., Nielsen-Gammon,
J. W., Pierce, R. B., Ryerson, T. B., Seinfeld, J. H., and Williams, E. J.:
Overview of the Second Texas Air Quality Study (TEXAQS II) and the Gulf
of Mexico Atmospheric Composition and Climate Study (GOMACCS), J. Geophys.
Res., 114, D00F13, https://doi.org/10.1029/2009JD011842, 2009. a
Ren, X., Olson, J. R., Crawford, J. H., Brune, W. H., Mao, J., Long, R. B.,
Chen, Z., Chen, G., Avery, M. A., Sachse, G. W., Barrick, J. D., Diskin,
G. S., Huey, L. G., Fried, A., Cohen, R. C., Heikes, B., Wennberg, P. O.,
Singh, H. B., Blake, D. R., and Shetter, R. E.: HOx chemistry during
INTEX-A 2004: observation, model calculation, and comparison with previous
studies, J. Geophys. Res., 113, D05310, https://doi.org/10.1029/2007JD009166, 2008. a, b
Roberts, J. M., Marchewka, M., Bertman, S. B., Sommariva, R., Warneke, C.,
de Gouw, J., Kuster, W., Goldan, P., Williams, E., Lerner, B. M., Murphy, P.,
and Fehsenfeld, F. C.: Measurements of PANs during the New England Air
Quality Study 2002, J. Geophys. Res., 112, D20306,
https://doi.org/10.1029/2007JD008667, 11, 2007. a
Sander, R., Baumgaertner, A., Gromov, S., Harder, H., Jöckel, P., Kerkweg, A., Kubistin, D., Regelin, E., Riede, H., Sandu, A., Taraborrelli, D., Tost, H., and Xie, Z.-Q.: The atmospheric chemistry box model CAABA/MECCA-3.0, Geosci. Model Dev., 4, 373–380, https://doi.org/10.5194/gmd-4-373-2011, 2011. a
Saunders, S. M., Jenkin, M. E., Derwent, R. G., and Pilling, M. J.: Protocol for the development of the Master Chemical Mechanism, MCM v3 (Part A): tropospheric degradation of non-aromatic volatile organic compounds, Atmos. Chem. Phys., 3, 161–180, https://doi.org/10.5194/acp-3-161-2003, 2003. a, b, c, d
Shamir, L., Wallin, J. F., Allen, A., Berriman, B., Teuben, P., Nemiroff,
R. J., Mink, J., Hanisch, R. J., and DuPrie, K.: Practices in source code
sharing in astrophysics, Astron. Comput., 1, 54–58,
https://doi.org/10.1016/j.ascom.2013.04.001, 2013. a
Sommariva, R. and Cox, S.: AtChem2 version 1.0 (Version 1.0), Zenodo, https://doi.org/10.5281/zenodo.3404021, 2017. a, b
Sommariva, R., Trainer, M., de Gouw, J. A., Roberts, J. M., Warneke, C., Atlas,
E., Flocke, F., Goldan, P. D., Kuster, W. C., Swanson, A. L., and Fehsenfeld,
F. C.: A study of organic nitrates formation in an urban plume using a
Master Chemical Mechanism, Atmos. Environ., 42, 5771–5786,
https://doi.org/10.1016/j.atmosenv.2007.12.031, 12, 2008. a
Sommariva, R., Osthoff, H. D., Brown, S. S., Bates, T. S., Baynard, T., Coffman, D., de Gouw, J. A., Goldan, P. D., Kuster, W. C., Lerner, B. M., Stark, H., Warneke, C., Williams, E. J., Fehsenfeld, F. C., Ravishankara, A. R., and Trainer, M.: Radicals in the marine boundary layer during NEAQS 2004: a model study of day-time and night-time sources and sinks, Atmos. Chem. Phys., 9, 3075–3093, https://doi.org/10.5194/acp-9-3075-2009, 2009. a, b, c, d
Sommariva, R., Bates, T. S., Bon, D., Brookes, D. M., de Gouw, J. A., Gilman,
J. B., Herndon, S. C., Kuster, W. C., Lerner, B. M., Monks, P. S., Osthoff,
H. D., Parker, A. E., Roberts, J. M., Tucker, S. C., Warneke, C., Williams,
E. J., Zahniser, M. S., and Brown, S. S.: Modelled and measured
concentrations of peroxy radicals and nitrate radical in the U.S. Gulf
Coast region during TexAQS 2006, J. Atmos. Chem., 68, 331–362,
https://doi.org/10.1007/s10874-012-9224-7, 20, 2011a. a, b, c, d, e, f, g
Sommariva, R., de Gouw, J. A., Trainer, M., Atlas, E., Goldan, P. D., Kuster, W. C., Warneke, C., and Fehsenfeld, F. C.: Emissions and photochemistry of oxygenated VOCs in urban plumes in the Northeastern United States, Atmos. Chem. Phys., 11, 7081–7096, https://doi.org/10.5194/acp-11-7081-2011, 2011b. a
Sonderfeld, H., White, I. R., Goodall, I. C. A., Hopkins, J. R., Lewis, A. C., Koppmann, R., and Monks, P. S.: What effect does VOC sampling time have on derived OH reactivity?, Atmos. Chem. Phys., 16, 6303–6318, https://doi.org/10.5194/acp-16-6303-2016, 2016.
a, b
Topping, D., Connolly, P., and Reid, J.: PyBox: an automated box-model
generator for atmospheric chemistry and aerosol simulations, J. Open Source
Software, 3, 755, https://doi.org/10.21105/joss.00755, 2018. a
Wang, J., Doussin, J. F., Perrier, S., Perraudin, E., Katrib, Y., Pangui, E., and Picquet-Varrault, B.: Design of a new multi-phase experimental simulation chamber for atmospheric photosmog, aerosol and cloud chemistry research, Atmos. Meas. Tech., 4, 2465–2494, https://doi.org/10.5194/amt-4-2465-2011, 2011. a, b
Whalley, L. K., Stone, D., Bandy, B., Dunmore, R., Hamilton, J. F., Hopkins, J., Lee, J. D., Lewis, A. C., and Heard, D. E.: Atmospheric OH reactivity in central London: observations, model predictions and estimates of in situ ozone production, Atmos. Chem. Phys., 16, 2109–2122, https://doi.org/10.5194/acp-16-2109-2016, 2016. a
Wolfe, G. M., Marvin, M. R., Roberts, S. J., Travis, K. R., and Liao, J.: The Framework for 0-D Atmospheric Modeling (F0AM) v3.1, Geosci. Model Dev., 9, 3309–3319, https://doi.org/10.5194/gmd-9-3309-2016, 2016. a
Short summary
This paper presents the AtChem software, which can be used to build box models for atmospheric chemistry studies. The software is designed to facilitate the use of one of the most important chemical mechanisms used by atmospheric scientists, the Master Chemical Mechanism. AtChem exists in two versions: an on-line application for laboratory studies and educational or outreach activities and an offline version for more complex models and batch simulations. AtChem is open source under MIT License.
This paper presents the AtChem software, which can be used to build box models for atmospheric...
