Articles | Volume 22, issue 15
https://doi.org/10.5194/acp-22-10099-2022
© Author(s) 2022. This work is distributed under
the Creative Commons Attribution 4.0 License.
the Creative Commons Attribution 4.0 License.
https://doi.org/10.5194/acp-22-10099-2022
© Author(s) 2022. This work is distributed under
the Creative Commons Attribution 4.0 License.
the Creative Commons Attribution 4.0 License.
Research article
| 
08 Aug 2022
Research article |
| 08 Aug 2022
| 08 Aug 2022
Atomistic and coarse-grained simulations reveal increased ice nucleation activity on silver iodide surfaces in slit and wedge geometries
Golnaz Roudsari
CORRESPONDING AUTHOR
Institute for Atmospheric and Earth System Research/Physics, University of Helsinki, P.O. Box 64, 00014 Helsinki, Finland
Olli H. Pakarinen
Institute for Atmospheric and Earth System Research/Physics, University of Helsinki, P.O. Box 64, 00014 Helsinki, Finland
Bernhard Reischl
Institute for Atmospheric and Earth System Research/Physics, University of Helsinki, P.O. Box 64, 00014 Helsinki, Finland
Hanna Vehkamäki
Institute for Atmospheric and Earth System Research/Physics, University of Helsinki, P.O. Box 64, 00014 Helsinki, Finland
Related authors
No articles found.
Huan Yang, Ivo Neefjes, Valtteri Tikkanen, Jakub Kubečka, Theo Kurtén, Hanna Vehkamäki, and Bernhard Reischl
Atmos. Chem. Phys., 23, 5993–6009, https://doi.org/10.5194/acp-23-5993-2023, https://doi.org/10.5194/acp-23-5993-2023, 2023
Short summary
Short summary
We present a new analytical model for collision rates between molecules and clusters of arbitrary sizes, accounting for long-range interactions. The model is verified against atomistic simulations of typical acid–base clusters participating in atmospheric new particle formation (NPF). Compared to non-interacting models, accounting for long-range interactions leads to 2–3 times higher collision rates for small clusters, indicating the necessity of including such interactions in NPF modeling.
Ivo Neefjes, Roope Halonen, Hanna Vehkamäki, and Bernhard Reischl
Atmos. Chem. Phys., 22, 11155–11172, https://doi.org/10.5194/acp-22-11155-2022, https://doi.org/10.5194/acp-22-11155-2022, 2022
Short summary
Short summary
Collisions between ionic and dipolar molecules and clusters facilitate the formation of atmospheric aerosol particles, which affect global climate and air quality. We compared often-used classical approaches for calculating ion–dipole collision rates with robust atomistic computer simulations. While classical approaches work for simple ions and dipoles only, our modeling approach can also efficiently calculate reasonable collision properties for more complex systems.
Dina Alfaouri, Monica Passananti, Tommaso Zanca, Lauri Ahonen, Juha Kangasluoma, Jakub Kubečka, Nanna Myllys, and Hanna Vehkamäki
Atmos. Meas. Tech., 15, 11–19, https://doi.org/10.5194/amt-15-11-2022, https://doi.org/10.5194/amt-15-11-2022, 2022
Short summary
Short summary
To study what is happening in the atmosphere, it is important to be able to measure the molecules and clusters present in it. In our work, we studied an artifact that happens inside a mass spectrometer, in particular the fragmentation of clusters. We were able to quantify the fragmentation and retrieve the correct concentration and composition of the clusters using our dual (experimental and theoretical) approach.
Shahzad Gani, Lukas Kohl, Rima Baalbaki, Federico Bianchi, Taina M. Ruuskanen, Olli-Pekka Siira, Pauli Paasonen, and Hanna Vehkamäki
Geosci. Commun., 4, 507–516, https://doi.org/10.5194/gc-4-507-2021, https://doi.org/10.5194/gc-4-507-2021, 2021
Short summary
Short summary
In this article, we present authorship guidelines which also include a novel authorship form along with the documentation of the formulation process for a multidisciplinary and interdisciplinary center with more than 250 researchers. Our practical approach promotes fair authorship practices and, by focusing on clear, transparent, and timely communication, helps avoid late-stage authorship conflict.
Emma Lumiaro, Milica Todorović, Theo Kurten, Hanna Vehkamäki, and Patrick Rinke
Atmos. Chem. Phys., 21, 13227–13246, https://doi.org/10.5194/acp-21-13227-2021, https://doi.org/10.5194/acp-21-13227-2021, 2021
Short summary
Short summary
The study of climate change relies on climate models, which require an understanding of aerosol formation. We train a machine-learning model to predict the partitioning coefficients of atmospheric molecules, which govern condensation into aerosols. The model can make instant predictions based on molecular structures with accuracy surpassing that of standard computational methods. This will allow the screening of low-volatility molecules that contribute most to aerosol formation.
Anna Shcherbacheva, Tracey Balehowsky, Jakub Kubečka, Tinja Olenius, Tapio Helin, Heikki Haario, Marko Laine, Theo Kurtén, and Hanna Vehkamäki
Atmos. Chem. Phys., 20, 15867–15906, https://doi.org/10.5194/acp-20-15867-2020, https://doi.org/10.5194/acp-20-15867-2020, 2020
Short summary
Short summary
Atmospheric new particle formation and cluster growth to aerosol particles is an important field of research, in particular due to the climate change phenomenon. Evaporation rates are very difficult to account for but they are important to explain the formation and growth of particles. Different quantum chemistry (QC) methods produce substantially different values for the evaporation rates. We propose a novel approach for inferring evaporation rates of clusters from available measurements.
Tommaso Zanca, Jakub Kubečka, Evgeni Zapadinsky, Monica Passananti, Theo Kurtén, and Hanna Vehkamäki
Atmos. Meas. Tech., 13, 3581–3593, https://doi.org/10.5194/amt-13-3581-2020, https://doi.org/10.5194/amt-13-3581-2020, 2020
Short summary
Short summary
In this paper we quantify (using a statistical model) the probability of decomposition of a representative class of HOM clusters in an APi-TOF mass spectrometer. This is important because it quantifies the systematic error of measurements in a APi-TOF MS due to cluster decomposition. The results (specific for our selected clusters) show that decomposition is negligible, provided their bonding energy is large enough to allow formation in the atmosphere in the first place.
Roope Halonen, Evgeni Zapadinsky, Theo Kurtén, Hanna Vehkamäki, and Bernhard Reischl
Atmos. Chem. Phys., 19, 13355–13366, https://doi.org/10.5194/acp-19-13355-2019, https://doi.org/10.5194/acp-19-13355-2019, 2019
Short summary
Short summary
The rate of collisions between molecules or clusters is used to determine particle formation in the atmosphere. The basic approach is to treat the colliding particles as noninteracting hard spheres. By using atomistic simulations with a realistic force field and theoretical approaches, we showed that the actual collision rate of two sulfuric acid molecules is more than twice as high as that for hard spheres. The results of this study will improve models of atmospheric particle growth.
Elham Baranizadeh, Benjamin N. Murphy, Jan Julin, Saeed Falahat, Carly L. Reddington, Antti Arola, Lars Ahlm, Santtu Mikkonen, Christos Fountoukis, David Patoulias, Andreas Minikin, Thomas Hamburger, Ari Laaksonen, Spyros N. Pandis, Hanna Vehkamäki, Kari E. J. Lehtinen, and Ilona Riipinen
Geosci. Model Dev., 9, 2741–2754, https://doi.org/10.5194/gmd-9-2741-2016, https://doi.org/10.5194/gmd-9-2741-2016, 2016
Short summary
Short summary
The molecular mechanisms through which new ultrafine (< 100 nm) aerosol particles are formed in the atmosphere have puzzled the scientific community for decades. In the past few years, however, significant progress has been made in unraveling these processes through laboratory studies and computational efforts. In this work we have implemented these new developments to an air quality model and study the implications of anthropogenically driven particle formation for European air quality.
Jenni Kontkanen, Tinja Olenius, Katrianne Lehtipalo, Hanna Vehkamäki, Markku Kulmala, and Kari E. J. Lehtinen
Atmos. Chem. Phys., 16, 5545–5560, https://doi.org/10.5194/acp-16-5545-2016, https://doi.org/10.5194/acp-16-5545-2016, 2016
K. Ruusuvuori, P. Hietala, O. Kupiainen-Määttä, T. Jokinen, H. Junninen, M. Sipilä, T. Kurtén, and H. Vehkamäki
Atmos. Meas. Tech., 8, 2577–2588, https://doi.org/10.5194/amt-8-2577-2015, https://doi.org/10.5194/amt-8-2577-2015, 2015
Short summary
Short summary
Ionization reagents suitable for accurate measurements of the atmospheric gas-phase amine vapour concentrations are needed. Based on computational results, acetone is a viable option for use as an ionization reagent in CI-APi-TOF measurements on atmospheric dimethylamine. However, comparison between the computational and experimental results revealed notable discrepancies. Further study is still required before the acetone CI-APi-TOF can be considered a viable option in practice.
N. T. Tsona, N. Bork, and H. Vehkamäki
Atmos. Chem. Phys., 15, 495–503, https://doi.org/10.5194/acp-15-495-2015, https://doi.org/10.5194/acp-15-495-2015, 2015
N. Bork, J. Elm, T. Olenius, and H. Vehkamäki
Atmos. Chem. Phys., 14, 12023–12030, https://doi.org/10.5194/acp-14-12023-2014, https://doi.org/10.5194/acp-14-12023-2014, 2014
I. K. Ortega, T. Olenius, O. Kupiainen-Määttä, V. Loukonen, T. Kurtén, and H. Vehkamäki
Atmos. Chem. Phys., 14, 7995–8007, https://doi.org/10.5194/acp-14-7995-2014, https://doi.org/10.5194/acp-14-7995-2014, 2014
K. Ruusuvuori, T. Kurtén, I. K. Ortega, J. Faust, and H. Vehkamäki
Atmos. Chem. Phys., 13, 10397–10404, https://doi.org/10.5194/acp-13-10397-2013, https://doi.org/10.5194/acp-13-10397-2013, 2013
N. Bork, T. Kurtén, and H. Vehkamäki
Atmos. Chem. Phys., 13, 3695–3703, https://doi.org/10.5194/acp-13-3695-2013, https://doi.org/10.5194/acp-13-3695-2013, 2013
Related subject area
Subject: Aerosols | Research Activity: Atmospheric Modelling and Data Analysis | Altitude Range: Troposphere | Science Focus: Physics (physical properties and processes)
The underappreciated role of transboundary pollution in future air quality and health improvements in China
The export of African mineral dust across the Atlantic and its impact over the Amazon Basin
Assimilation of POLDER observations to estimate aerosol emissions
Effect of radiation interaction and aerosol processes on ventilation and aerosol concentrations in a real urban neighbourhood in Helsinki
Atlantic Multidecadal Oscillation modulates the relationship between El Niño–Southern Oscillation and fire weather in Australia
Identifying climate model structural inconsistencies allows for tight constraint of aerosol radiative forcing
Impacts of reducing scattering and absorbing aerosols on the temporal extent and intensity of South Asian summer monsoon and East Asian summer monsoon
Superimposed effects of typical local circulations driven by mountainous topography and aerosol–radiation interaction on heavy haze in the Beijing–Tianjin–Hebei central and southern plains in winter
Multi-model ensemble projection of the global dust cycle by the end of 21st century using the Coupled Model Intercomparison Project version 6 data
A thermodynamic framework for bulk–surface partitioning in finite-volume mixed organic–inorganic aerosol particles and cloud droplets
Change from aerosol-driven to cloud-feedback-driven trend in short-wave radiative flux over the North Atlantic
A new process-based and scale-aware desert dust emission scheme for global climate models – Part I: Description and evaluation against inverse modeling emissions
Biomass-burning smoke properties and its interactions with marine stratocumulus clouds in WRF-CAM5 and southeastern Atlantic field campaigns
Transported aerosols regulate the pre-monsoon rainfall over north-east India: a WRF-Chem modelling study
The effect of atmospherically relevant aminium salts on water uptake
Collision-sticking rates of acid–base clusters in the gas phase determined from atomistic simulation and a novel analytical interacting hard-sphere model
Increased Importance of Aerosol-Cloud Interaction for Surface PM2.5 Pollution Relative to Aerosol-Radiation Interaction in China With the Anthropogenic Emission Reduction
Parameterization of size of organic and secondary inorganic aerosol for efficient representation of global aerosol optical properties
Air pollution trapping in the Dresden Basin induced by natural and urban topography
Model-based insights into aerosol perturbation on pristine continental convective precipitation
The impact of using assimilated Aeolus wind data on regional WRF-Chem dust simulations
On the differences in the vertical distribution of modeled aerosol optical depth over the southeastern Atlantic
A global evaluation of daily to seasonal aerosol and water vapor relationships using a combination of AERONET and NAAPS reanalysis data
Local and remote climate impacts of future African aerosol emissions
The dependence of aerosols' global and local precipitation impacts on the emitting region
Assessing the climate and air quality effects of future aerosol mitigation in India using a global climate model combined with statistical downscaling
Aggravated air pollution and health burden due to traffic congestion in urban China
Late summer transition from a free-tropospheric to boundary layer source of Aitken mode aerosol in the high Arctic
Self-lofting of wildfire smoke in the troposphere and stratosphere: simulations and space lidar observations
Numerical simulation and evaluation of global ultrafine particle concentrations at the Earth's surface
Role of K-feldspar and quartz in global ice nucleation by mineral dust in mixed-phase clouds
Projected increases in wildfires may challenge regulatory curtailment of PM2.5 over the eastern US by 2050
The Impact of Aerosols on the Stratiform Clouds over southern West Africa: A Large-Eddy Simulation Study
Meteorological export and deposition fluxes of black carbon on glaciers of the central Chilean Andes
Future changes in atmospheric rivers over East Asia under stratospheric aerosol intervention
Modeling the influence of chain length on secondary organic aerosol (SOA) formation via multiphase reactions of alkanes
How aerosol size matters in aerosol optical depth (AOD) assimilation and the optimization using the Ångström exponent
Microphysical, macrophysical, and radiative responses of subtropical marine clouds to aerosol injections
Hemispheric-wide climate response to regional COVID-19-related aerosol emission reductions: the prominent role of atmospheric circulation adjustments
Impacts of an aerosol layer on a midlatitude continental system of cumulus clouds: how do these impacts depend on the vertical location of the aerosol layer?
The role of temporal scales in extracting dominant meteorological drivers of major airborne pollutants
Impact of phase state and non-ideal mixing on equilibration timescales of secondary organic aerosol partitioning
A global climatology of ice-nucleating particles under cirrus conditions derived from model simulations with MADE3 in EMAC
Enviro-HIRLAM model estimates of elevated black carbon pollution over Ukraine resulted from forest fires
Where does the dust deposited over the Sierra Nevada snow come from?
Instant and delayed effects of March biomass burning aerosols over the Indochina Peninsula
Aerosol–cloud interaction in the atmospheric chemistry model GRAPES_Meso5.1/CUACE and its impacts on mesoscale numerical weather prediction under haze pollution conditions in Jing–Jin–Ji in China
Survival probabilities of atmospheric particles: comparison based on theory, cluster population simulations, and observations in Beijing
The simulation of mineral dust in the United Kingdom Earth System Model UKESM1
Dust pollution in China affected by different spatial and temporal types of El Niño
Jun-Wei Xu, Jintai Lin, Dan Tong, and Lulu Chen
Atmos. Chem. Phys., 23, 10075–10089, https://doi.org/10.5194/acp-23-10075-2023, https://doi.org/10.5194/acp-23-10075-2023, 2023
Short summary
Short summary
This study highlights the necessity of a low-carbon pathway in foreign countries for China to achieve air quality goals and to protect public health. We find that adopting the low-carbon instead of the fossil-fuel-intensive pathway in foreign countries would prevent 63 000–270 000 transboundary PM2.5-associated mortalities in China in 2060. Our study provides direct evidence of the necessity of inter-regional cooperation for air quality improvement.
Xurong Wang, Qiaoqiao Wang, Maria Prass, Christopher Pöhlker, Daniel Moran-Zuloaga, Paulo Artaxo, Jianwei Gu, Ning Yang, Xiajie Yang, Jiangchuan Tao, Juan Hong, Nan Ma, Yafang Cheng, Hang Su, and Meinrat O. Andreae
Atmos. Chem. Phys., 23, 9993–10014, https://doi.org/10.5194/acp-23-9993-2023, https://doi.org/10.5194/acp-23-9993-2023, 2023
Short summary
Short summary
In this work, with an optimized particle mass size distribution, we captured observed aerosol optical depth (AOD) and coarse aerosol concentrations over source and/or receptor regions well, demonstrating good performance in simulating export of African dust toward the Amazon Basin. In addition to factors controlling the transatlantic transport of African dust, the study investigated the impact of African dust over the Amazon Basin, including the nutrient inputs associated with dust deposition.
Athanasios Tsikerdekis, Otto P. Hasekamp, Nick A. J. Schutgens, and Qirui Zhong
Atmos. Chem. Phys., 23, 9495–9524, https://doi.org/10.5194/acp-23-9495-2023, https://doi.org/10.5194/acp-23-9495-2023, 2023
Short summary
Short summary
Aerosols are tiny particles of different substances (species) that can be emitted into the atmosphere by natural processes or by anthropogenic activities. However, the actual aerosol emission amount per species is highly uncertain. Thus in this work we correct the aerosol emissions used to drive a global aerosol–climate model using satellite observations through a process called data assimilation. These more accurate aerosol emissions can lead to a more accurate weather and climate prediction.
Jani Strömberg, Xiaoyu Li, Mona Kurppa, Heino Kuuluvainen, Liisa Pirjola, and Leena Järvi
Atmos. Chem. Phys., 23, 9347–9364, https://doi.org/10.5194/acp-23-9347-2023, https://doi.org/10.5194/acp-23-9347-2023, 2023
Short summary
Short summary
We conclude that with low wind speeds, solar radiation has a larger decreasing effect (53 %) on pollutant concentrations than aerosol processes (18 %). Additionally, our results showed that with solar radiation included, pollutant concentrations were closer to observations (−13 %) than with only aerosol processes (+98 %). This has implications when planning simulations under calm conditions such as in our case and when deciding whether or not simulations need to include these processes.
Guanyu Liu, Jing Li, and Tong Ying
Atmos. Chem. Phys., 23, 9217–9228, https://doi.org/10.5194/acp-23-9217-2023, https://doi.org/10.5194/acp-23-9217-2023, 2023
Short summary
Short summary
Fires in Australia are positively correlated with the El Niño–Southern Oscillation (ENSO). However, the correlation between ENSO and the Australian Fire Weather Index (FWI) increases from 0.17 to 0.70 when the Atlantic Multidecadal Oscillation (AMO) shifts from a negative to positive phase. This is explained by the teleconnection effect through which the warmer AMO generates Rossby wave trains and results in high pressures and a weather condition conducive to wildfires.
Leighton A. Regayre, Lucia Deaconu, Daniel P. Grosvenor, David M. H. Sexton, Christopher Symonds, Tom Langton, Duncan Watson-Paris, Jane P. Mulcahy, Kirsty J. Pringle, Mark Richardson, Jill S. Johnson, John W. Rostron, Hamish Gordon, Grenville Lister, Philip Stier, and Ken S. Carslaw
Atmos. Chem. Phys., 23, 8749–8768, https://doi.org/10.5194/acp-23-8749-2023, https://doi.org/10.5194/acp-23-8749-2023, 2023
Short summary
Short summary
Aerosol forcing of Earth’s energy balance has persisted as a major cause of uncertainty in climate simulations over generations of climate model development. We show that structural deficiencies in a climate model are exposed by comprehensively exploring parametric uncertainty and that these deficiencies limit how much the model uncertainty can be reduced through observational constraint. This provides a future pathway towards building models with greater physical realism and lower uncertainty.
Chenwei Fang, Jim M. Haywood, Ju Liang, Ben T. Johnson, Ying Chen, and Bin Zhu
Atmos. Chem. Phys., 23, 8341–8368, https://doi.org/10.5194/acp-23-8341-2023, https://doi.org/10.5194/acp-23-8341-2023, 2023
Short summary
Short summary
The responses of Asian summer monsoon duration and intensity to air pollution mitigation are identified given the net-zero future. We show that reducing scattering aerosols makes the rainy season longer and stronger across South Asia and East Asia but that absorbing aerosol reduction has the opposite effect. Our results hint at distinct monsoon responses to emission controls that target different aerosols.
Yue Peng, Hong Wang, Xiaoye Zhang, Zhaodong Liu, Wenjie Zhang, Siting Li, Chen Han, and Huizheng Che
Atmos. Chem. Phys., 23, 8325–8339, https://doi.org/10.5194/acp-23-8325-2023, https://doi.org/10.5194/acp-23-8325-2023, 2023
Short summary
Short summary
This study demonstrates a strong link between local circulation, aerosol–radiation interaction (ARI), and haze pollution. Under the weak weather-scale systems, the typical local circulation driven by mountainous topography is the main cause of pollutant distribution in the Beijing–Tianjin–Hebei region, and the ARI mechanism amplifies this influence of local circulation on pollutants, making haze pollution aggravated by the superposition of both.
Yuan Zhao, Xu Yue, Yang Cao, Jun Zhu, Chenguang Tian, Hao Zhou, Yuwen Chen, Yihan Hu, Weijie Fu, and Xu Zhao
Atmos. Chem. Phys., 23, 7823–7838, https://doi.org/10.5194/acp-23-7823-2023, https://doi.org/10.5194/acp-23-7823-2023, 2023
Short summary
Short summary
We project the future changes of dust emissions and loading using an ensemble of model outputs from the Coupled Model Intercomparison Project version 6 under four scenarios. We find increased dust emissions and loading in North Africa, due to increased drought and strengthened surface wind, and decreased dust loading over Asia, following enhanced precipitation. Such a spatial pattern remains similar, though the regional intensity varies among different scenarios.
Ryan Schmedding and Andreas Zuend
Atmos. Chem. Phys., 23, 7741–7765, https://doi.org/10.5194/acp-23-7741-2023, https://doi.org/10.5194/acp-23-7741-2023, 2023
Short summary
Short summary
Aerosol particles below 100 nm in diameter have high surface-area-to-volume ratios. The enrichment of compounds in the surface of an aerosol particle may lead to depletion of that species in the interior bulk of the particle. We present a framework for modeling the equilibrium bulk–surface partitioning of mixed organic–inorganic particles, including cases of co-condensation of semivolatile organic compounds and species with extremely limited solubility in the bulk or surface of a particle.
Daniel P. Grosvenor and Kenneth S. Carslaw
Atmos. Chem. Phys., 23, 6743–6773, https://doi.org/10.5194/acp-23-6743-2023, https://doi.org/10.5194/acp-23-6743-2023, 2023
Short summary
Short summary
We determine what causes long-term trends in short-wave (SW) radiative fluxes in two climate models. A positive trend occurs between 1850 and 1970 (increasing SW reflection) and a negative trend between 1970 and 2014; the pre-1970 positive trend is mainly driven by an increase in cloud droplet number concentrations due to increases in aerosol, and the 1970–2014 trend is driven by a decrease in cloud fraction, which we attribute to changes in clouds caused by greenhouse gas-induced warming.
Danny M. Leung, Jasper F. Kok, Longlei Li, Gregory S. Okin, Catherine Prigent, Martina Klose, Carlos Pérez García-Pando, Laurent Menut, Natalie M. Mahowald, David M. Lawrence, and Marcelo Chamecki
Atmos. Chem. Phys., 23, 6487–6523, https://doi.org/10.5194/acp-23-6487-2023, https://doi.org/10.5194/acp-23-6487-2023, 2023
Short summary
Short summary
Desert dust modeling is important for understanding climate change, as dust regulates the atmosphere's greenhouse effect and radiation. This study formulates and proposes a more physical and realistic desert dust emission scheme for global and regional climate models. By considering more aeolian processes in our emission scheme, our simulations match better against dust observations than existing schemes. We believe this work is vital in improving dust representation in climate models.
Calvin Howes, Pablo E. Saide, Hugh Coe, Amie Nicole Dobracki, Steffen Freitag, Jim M. Haywood, Steven G. Howell, Siddhant Gupta, Janek Uin, Mary Kacarab, Chongai Kuang, L. Ruby Leung, Athanasios Nenes, Greg McFarquhar, Jens Redemann, Arther J. Sedlacek, Kenneth L. Thornhill, Jenny P. S. Wong, Robert Wood, Huihui Wu, Yang Zhang, Jianhao Zhang, and Paquita Zuidema
EGUsphere, https://doi.org/10.5194/egusphere-2023-886, https://doi.org/10.5194/egusphere-2023-886, 2023
Short summary
Short summary
To better understand smoke properties and its interactions with clouds, we compare WRF-CAM5 with observations from ORACLES, CLARIFY, and LASIC field campaigns in the Southeastern Atlantic in August 2017. The model transports and mixes smoke well but is not fully capturing some important processes. These include smoke chemical and physical aging over 4–12 days, smoke removal by rain, new particle formation, aerosol activation into cloud droplets, and boundary layer turbulence.
Neeldip Barman and Sharad Gokhale
Atmos. Chem. Phys., 23, 6197–6215, https://doi.org/10.5194/acp-23-6197-2023, https://doi.org/10.5194/acp-23-6197-2023, 2023
Short summary
Short summary
The study shows that during the pre-monsoon season transported aerosols, especially from the Indo-Gangetic Plain (IGP), have a greater impact with respect to air pollution, radiative forcing and rainfall over north-east (NE) India than emissions from within NE India itself. Hence, controlling emissions in the IGP will be significantly more fruitful in reducing pollution as well as climatic impacts over this region.
Noora Hyttinen
EGUsphere, https://doi.org/10.5194/egusphere-2023-1123, https://doi.org/10.5194/egusphere-2023-1123, 2023
Short summary
Short summary
Water activity in aerosol particles describes the particles respond to variations in relative humidity. Here, water activities were calculated for a set of 80 salts that may be present in aerosol particles, using a state-of-the-art quantum chemistry based method. The effect of the dissociated salt on water activity varies with both the cation and anion. Most of the studied salts increase water uptake compared to pure water soluble organic particles.
Huan Yang, Ivo Neefjes, Valtteri Tikkanen, Jakub Kubečka, Theo Kurtén, Hanna Vehkamäki, and Bernhard Reischl
Atmos. Chem. Phys., 23, 5993–6009, https://doi.org/10.5194/acp-23-5993-2023, https://doi.org/10.5194/acp-23-5993-2023, 2023
Short summary
Short summary
We present a new analytical model for collision rates between molecules and clusters of arbitrary sizes, accounting for long-range interactions. The model is verified against atomistic simulations of typical acid–base clusters participating in atmospheric new particle formation (NPF). Compared to non-interacting models, accounting for long-range interactions leads to 2–3 times higher collision rates for small clusters, indicating the necessity of including such interactions in NPF modeling.
Da Gao, Bin Zhao, Shuxiao Wang, Yuan Wang, Brain Gaudet, Yun Zhu, Xiaochun Wang, Jiewen Shen, Shengyue Li, Yicong He, Dejia Yin, and Zhaoxin Dong
EGUsphere, https://doi.org/10.5194/egusphere-2023-502, https://doi.org/10.5194/egusphere-2023-502, 2023
Short summary
Short summary
Surface PM2.5 concentrations can be enhanced by aerosol-radiation interaction (ARI) and aerosol-cloud interaction (ACI). In this study, we found the ACI-induced PM2.5 enhancement shows a significantly smaller decrease ratio than the ARI-induced enhancement in China with anthropogenic emission reduction from 2013 to 2021, making ACI more important for enhancing PM2.5 concentrations. ACI-induced PM2.5 enhancement needs to be emphatically considered to meet the national PM2.5 air quality standard.
Haihui Zhu, Randall V. Martin, Betty Croft, Shixian Zhai, Chi Li, Liam Bindle, Jeffrey R. Pierce, Rachel Y.-W. Chang, Bruce E. Anderson, Luke D. Ziemba, Johnathan W. Hair, Richard A. Ferrare, Chris A. Hostetler, Inderjeet Singh, Deepangsu Chatterjee, Jose L. Jimenez, Pedro Campuzano-Jost, Benjamin A. Nault, Jack E. Dibb, Joshua S. Schwarz, and Andrew Weinheimer
Atmos. Chem. Phys., 23, 5023–5042, https://doi.org/10.5194/acp-23-5023-2023, https://doi.org/10.5194/acp-23-5023-2023, 2023
Short summary
Short summary
Particle size of atmospheric aerosol is important for estimating its climate and health effects, but simulating atmospheric aerosol size is computationally demanding. This study derives a simple parameterization of the size of organic and secondary inorganic ambient aerosol that can be applied to atmospheric models. Applying this parameterization allows a better representation of the global spatial pattern of aerosol size, as verified by ground and airborne measurements.
Michael Weger and Bernd Heinold
Atmos. Chem. Phys. Discuss., https://doi.org/10.5194/acp-2023-33, https://doi.org/10.5194/acp-2023-33, 2023
Revised manuscript accepted for ACP
Short summary
Short summary
This study investigates the effects of complex terrain on air pollution trapping using a numerical model, which simulates the dispersion of emissions under real meteorological conditions. The additionally simulated aerosol age allows distinguishing areas that accumulate aerosol over time from the areas that are more influenced by fresh emissions. The Dresden Basin, a widened section of the Elbe Valley in eastern Germany, is selected as the target area in a case study to demonstrate the concept.
Mengjiao Jiang, Yaoting Li, Weiji Hu, Yinshan Yang, Guy Brasseur, and Xi Zhao
Atmos. Chem. Phys., 23, 4545–4557, https://doi.org/10.5194/acp-23-4545-2023, https://doi.org/10.5194/acp-23-4545-2023, 2023
Short summary
Short summary
Relatively clean background aerosol over the Tibetan Plateau makes the study of aerosol–cloud–precipitation interactions distinctive. A convection on 24 July 2014 in Naqu was selected using the Weather Research Forecasting (WRF) model, including the Thompson aerosol-aware microphysical scheme. Our study uses a compromise approach to the limited observations. We show that the transformation of cloud water to graupel and the development of convective clouds are favored in a polluted situation.
Pantelis Kiriakidis, Antonis Gkikas, Georgios Papangelis, Theodoros Christoudias, Jonilda Kushta, Emmanouil Proestakis, Anna Kampouri, Eleni Marinou, Eleni Drakaki, Angela Benedetti, Michael Rennie, Christian Retscher, Anne Grete Straume, Alexandru Dandocsi, Jean Sciare, and Vasilis Amiridis
Atmos. Chem. Phys., 23, 4391–4417, https://doi.org/10.5194/acp-23-4391-2023, https://doi.org/10.5194/acp-23-4391-2023, 2023
Short summary
Short summary
With the launch of the Aeolus satellite, higher-accuracy wind products became available. This research was carried out to validate the assimilated wind products by testing their effect on the WRF-Chem model predictive ability of dust processes. This was carried out for the eastern Mediterranean and Middle East region for two 2-month periods in autumn and spring 2020. The use of the assimilated products improved the dust forecasts of the autumn season (both quantitatively and qualitatively).
Ian Chang, Lan Gao, Connor J. Flynn, Yohei Shinozuka, Sarah J. Doherty, Michael S. Diamond, Karla M. Longo, Gonzalo A. Ferrada, Gregory R. Carmichael, Patricia Castellanos, Arlindo M. da Silva, Pablo E. Saide, Calvin Howes, Zhixin Xue, Marc Mallet, Ravi Govindaraju, Qiaoqiao Wang, Yafang Cheng, Yan Feng, Sharon P. Burton, Richard A. Ferrare, Samuel E. LeBlanc, Meloë S. Kacenelenbogen, Kristina Pistone, Michal Segal-Rozenhaimer, Kerry G. Meyer, Ju-Mee Ryoo, Leonhard Pfister, Adeyemi A. Adebiyi, Robert Wood, Paquita Zuidema, Sundar A. Christopher, and Jens Redemann
Atmos. Chem. Phys., 23, 4283–4309, https://doi.org/10.5194/acp-23-4283-2023, https://doi.org/10.5194/acp-23-4283-2023, 2023
Short summary
Short summary
Abundant aerosols are present above low-level liquid clouds over the southeastern Atlantic during late austral spring. The model simulation differences in the proportion of aerosol residing in the planetary boundary layer and in the free troposphere can greatly affect the regional aerosol radiative effects. This study examines the aerosol loading and fractional aerosol loading in the free troposphere among various models and evaluates them against measurements from the NASA ORACLES campaign.
Juli I. Rubin, Jeffrey S. Reid, Peng Xian, Christopher M. Selman, and Thomas F. Eck
Atmos. Chem. Phys., 23, 4059–4090, https://doi.org/10.5194/acp-23-4059-2023, https://doi.org/10.5194/acp-23-4059-2023, 2023
Short summary
Short summary
This work aims to quantify the covariability between aerosol optical depth/extinction with water vapor (PW) globally, using NASA AERONET observations and NAAPS model data. Findings are important for data assimilation and radiative transfer. The study shows statistically significant and positive AOD–PW relationships are found across the globe, varying in strength with location and season and tied to large-scale aerosol events. Hygroscopic growth was also found to be an important factor.
Christopher D. Wells, Matthew Kasoar, Nicolas Bellouin, and Apostolos Voulgarakis
Atmos. Chem. Phys., 23, 3575–3593, https://doi.org/10.5194/acp-23-3575-2023, https://doi.org/10.5194/acp-23-3575-2023, 2023
Short summary
Short summary
The climate is altered by greenhouse gases and air pollutant particles, and such emissions are likely to change drastically in the future over Africa. Air pollutants do not travel far, so their climate effect depends on where they are emitted. This study uses a climate model to find the climate impacts of future African pollutant emissions being either high or low. The particles absorb and scatter sunlight, causing the ground nearby to be cooler, but elsewhere the increased heat causes warming.
Geeta G. Persad
Atmos. Chem. Phys., 23, 3435–3452, https://doi.org/10.5194/acp-23-3435-2023, https://doi.org/10.5194/acp-23-3435-2023, 2023
Short summary
Short summary
Human-induced aerosol pollution has major impacts on both local and global precipitation. This study demonstrates using a global climate model that both the strength and localization of aerosols' precipitation impacts are highly dependent on which region the aerosols are emitted from. The findings highlight that the geographic distribution of human-induced aerosol emissions must be accounted for when quantifying their influence on global precipitation.
Tuuli Miinalainen, Harri Kokkola, Antti Lipponen, Antti-Pekka Hyvärinen, Vijay Kumar Soni, Kari E. J. Lehtinen, and Thomas Kühn
Atmos. Chem. Phys., 23, 3471–3491, https://doi.org/10.5194/acp-23-3471-2023, https://doi.org/10.5194/acp-23-3471-2023, 2023
Short summary
Short summary
We simulated the effects of aerosol emission mitigation on both global and regional radiative forcing and city-level air quality with a global-scale climate model. We used a machine learning downscaling approach to bias-correct the PM2.5 values obtained from the global model for the Indian megacity New Delhi. Our results indicate that aerosol mitigation could result in both improved air quality and less radiative heating for India.
Peng Wang, Ruhan Zhang, Shida Sun, Meng Gao, Bo Zheng, Dan Zhang, Yanli Zhang, Gregory R. Carmichael, and Hongliang Zhang
Atmos. Chem. Phys., 23, 2983–2996, https://doi.org/10.5194/acp-23-2983-2023, https://doi.org/10.5194/acp-23-2983-2023, 2023
Short summary
Short summary
In China, the number of vehicles has jumped significantly in the last decade. This caused severe traffic congestion and aggravated air pollution. In this study, we developed a new temporal allocation approach to quantify the impacts of traffic congestion. We found that traffic congestion worsens air quality and the health burden across China, especially in the urban clusters. More effective and comprehensive vehicle emission control policies should be implemented to improve air quality in China.
Ruth Price, Andrea Baccarini, Julia Schmale, Paul Zieger, Ian M. Brooks, Paul Field, and Ken S. Carslaw
Atmos. Chem. Phys., 23, 2927–2961, https://doi.org/10.5194/acp-23-2927-2023, https://doi.org/10.5194/acp-23-2927-2023, 2023
Short summary
Short summary
Arctic clouds can control how much energy is absorbed by the surface or reflected back to space. Using a computer model of the atmosphere we investigated the formation of atmospheric particles that allow cloud droplets to form. We found that particles formed aloft are transported to the lowest part of the Arctic atmosphere and that this is a key source of particles. Our results have implications for the way Arctic clouds will behave in the future as climate change continues to impact the region.
Kevin Ohneiser, Albert Ansmann, Jonas Witthuhn, Hartwig Deneke, Alexandra Chudnovsky, Gregor Walter, and Fabian Senf
Atmos. Chem. Phys., 23, 2901–2925, https://doi.org/10.5194/acp-23-2901-2023, https://doi.org/10.5194/acp-23-2901-2023, 2023
Short summary
Short summary
This study shows that smoke layers can reach the tropopause via the self-lofting effect within 3–7 d in the absence of pyrocumulonimbus convection if the
aerosol optical thickness is larger than approximately 2 for a longer time period. When reaching the stratosphere, wildfire smoke can sensitively influence the stratospheric composition on a hemispheric scale and thus can affect the Earth’s climate and the ozone layer.
Matthias Kohl, Jos Lelieveld, Sourangsu Chowdhury, Sebastian Ehrhart, Disha Sharma, Yafang Cheng, Sachchida Nand Tripathi, Mathew Sebastian, Govindan Pandithurai, Hongli Wang, and Andrea Pozzer
EGUsphere, https://doi.org/10.5194/egusphere-2023-317, https://doi.org/10.5194/egusphere-2023-317, 2023
Short summary
Short summary
Knowledge on atmospheric ultrafine particles (UFP) with a diameter smaller than 100 nm is crucial for public health and the hydrological cycle. We present a new global dataset of UFP concentrations at the Earth's surface derived with a comprehensive chemistry climate model, and evaluated with ground-based observations. The evaluation results are combined with high-resolution primary emissions to downscale UFP concentrations to an unprecedented horizontal resolution of 0.1° x 0.1°.
Marios Chatziparaschos, Nikos Daskalakis, Stelios Myriokefalitakis, Nikos Kalivitis, Athanasios Nenes, María Gonçalves Ageitos, Montserrat Costa-Surós, Carlos Pérez García-Pando, Medea Zanoli, Mihalis Vrekoussis, and Maria Kanakidou
Atmos. Chem. Phys., 23, 1785–1801, https://doi.org/10.5194/acp-23-1785-2023, https://doi.org/10.5194/acp-23-1785-2023, 2023
Short summary
Short summary
Ice formation is enabled by ice-nucleating particles (INP) at higher temperatures than homogeneous formation and can profoundly affect the properties of clouds. Our global model results show that K-feldspar is the most important contributor to INP concentrations globally, affecting mid-level mixed-phase clouds. However, quartz can significantly contribute and dominates the lowest and the highest altitudes of dust-derived INP, affecting mainly low-level and high-level mixed-phase clouds.
Chandan Sarangi, Yun Qian, L. Ruby Leung, Yang Zhang, Yufei Zou, and Yuhang Wang
Atmos. Chem. Phys., 23, 1769–1783, https://doi.org/10.5194/acp-23-1769-2023, https://doi.org/10.5194/acp-23-1769-2023, 2023
Short summary
Short summary
We show that for air quality, the densely populated eastern US may see even larger impacts of wildfires due to long-distance smoke transport and associated positive climatic impacts, partially compensating the improvements from regulations on anthropogenic emissions. This study highlights the tension between natural and anthropogenic contributions and the non-local nature of air pollution that complicate regulatory strategies for improving future regional air quality for human health.
Lambert Delbeke, Chien Wang, Pierre Tulet, Cyrielle Denjean, Maurin Zouzoua, Nicolas Maury, and Adrien Deroubaix
Atmos. Chem. Phys. Discuss., https://doi.org/10.5194/acp-2022-856, https://doi.org/10.5194/acp-2022-856, 2023
Revised manuscript accepted for ACP
Short summary
Short summary
Low-Level Stratiform Clouds (LLSC) appear frequently over southern West Africa and during West African Monsoon local and remote aerosol sources (biomass burning aerosol from Central Africa) play a significant role in LLSC life cycle. Based on measurements of DACCIWA campaign, Large Eddy Simulations (LES) were driven using different aerosols scenarios showing indirect effect depends on microphysics and cloud-void spaces. Absorbing particles produced a strong semi-direct effect stabilizing clouds.
Rémy Lapere, Nicolás Huneeus, Sylvain Mailler, Laurent Menut, and Florian Couvidat
Atmos. Chem. Phys., 23, 1749–1768, https://doi.org/10.5194/acp-23-1749-2023, https://doi.org/10.5194/acp-23-1749-2023, 2023
Short summary
Short summary
Glaciers in the Andes of central Chile are shrinking rapidly in response to global warming. This melting is accelerated by the deposition of opaque particles onto snow and ice. In this work, model simulations quantify typical deposition rates of soot on glaciers in summer and winter months and show that the contribution of emissions from Santiago is not as high as anticipated. Additionally, the combination of regional- and local-scale meteorology explains the seasonality in deposition.
Ju Liang and Jim Haywood
Atmos. Chem. Phys., 23, 1687–1703, https://doi.org/10.5194/acp-23-1687-2023, https://doi.org/10.5194/acp-23-1687-2023, 2023
Short summary
Short summary
The recent record-breaking flood events in China during the summer of 2021 highlight the importance of mitigating the risks from future changes in high-impact weather systems under global warming. Based on a state-of-the-art Earth system model, we demonstrate a pilot study on the responses of atmospheric rivers and extreme precipitation over East Asia to anthropogenically induced climate warming and an unconventional mitigation strategy – stratospheric aerosol injection.
Azad Madhu, Myoseon Jang, and David Deacon
Atmos. Chem. Phys., 23, 1661–1675, https://doi.org/10.5194/acp-23-1661-2023, https://doi.org/10.5194/acp-23-1661-2023, 2023
Short summary
Short summary
SOA formation is simulated using the UNIPAR model for series of linear alkanes. The inclusion of autoxidation reactions within the explicit gas mechanisms of C9–C12 was found to significantly improve predictions. Available product distributions were extrapolated with an incremental volatility coefficient (IVC) to predict SOA formation of alkanes without explicit mechanisms. These product distributions were used to simulate SOA formation from C13 and C15 and had good agreement with chamber data.
Jianbing Jin, Bas Henzing, and Arjo Segers
Atmos. Chem. Phys., 23, 1641–1660, https://doi.org/10.5194/acp-23-1641-2023, https://doi.org/10.5194/acp-23-1641-2023, 2023
Short summary
Short summary
Aerosol models and satellite retrieval algorithms rely on different aerosol size assumptions. In practice, differences between simulations and observations do not always reflect the difference in aerosol amount. To avoid inconsistencies, we designed a hybrid assimilation approach. Different from a standard aerosol optical depth (AOD) assimilation that directly assimilates AODs, the hybrid one estimates aerosol size parameters by assimilating Ängström observations before assimilating the AODs.
Je-Yun Chun, Robert Wood, Peter Blossey, and Sarah J. Doherty
Atmos. Chem. Phys., 23, 1345–1368, https://doi.org/10.5194/acp-23-1345-2023, https://doi.org/10.5194/acp-23-1345-2023, 2023
Short summary
Short summary
We investigate the impact of injected aerosol on subtropical low marine clouds under a variety of meteorological conditions using high-resolution model simulations. This study illustrates processes perturbed by aerosol injections and their impact on cloud properties (e.g., cloud number concentration, thickness, and cover). We show that those responses are highly sensitive to background meteorological conditions, such as precipitation, and background cloud properties.
Nora L. S. Fahrenbach and Massimo A. Bollasina
Atmos. Chem. Phys., 23, 877–894, https://doi.org/10.5194/acp-23-877-2023, https://doi.org/10.5194/acp-23-877-2023, 2023
Short summary
Short summary
We studied the monthly-scale climate response to COVID-19 aerosol emission reductions during January–May 2020 using climate models. Our results show global temperature and rainfall anomalies driven by circulation changes. The climate patterns reverse polarity from JF to MAM due to a shift in the main SO2 reduction region from China to India. This real-life example of rapid climate adjustments to abrupt, regional aerosol emission reduction has large implications for future climate projections.
Seoung Soo Lee, Junshik Um, Won Jun Choi, Kyung-Ja Ha, Chang Hoon Jung, Jianping Guo, and Youtong Zheng
Atmos. Chem. Phys., 23, 273–286, https://doi.org/10.5194/acp-23-273-2023, https://doi.org/10.5194/acp-23-273-2023, 2023
Short summary
Short summary
This paper elaborates on process-level mechanisms regarding how the interception of radiation by aerosols interacts with the surface heat fluxes and atmospheric instability in warm cumulus clouds. This paper elucidates how these mechanisms vary with the location or altitude of an aerosol layer. This elucidation indicates that the location of aerosol layers should be taken into account for parameterizations of aerosol–cloud interactions.
Miaoqing Xu, Jing Yang, Manchun Li, Xiao Chen, Qiancheng lv, Qi Yao, Bingbo Gao, and Ziyue Chen
Atmos. Chem. Phys. Discuss., https://doi.org/10.5194/acp-2022-818, https://doi.org/10.5194/acp-2022-818, 2023
Revised manuscript accepted for ACP
Short summary
Short summary
Although the temporal-scale effects on Meteorology-PM2.5 associations have been discussed, no quantitative evidence proved this before. Based on a rare 3 h-meteorology data, we revealed that the dominant meteorological factor for PM2.5 concentrations across China extracted at the 3 h and 24 h scale presented large variations. This research suggested that data sources of different temporal scales should be comprehensively considered for better attribution and prevention airborne pollution.
Meredith Schervish and Manabu Shiraiwa
Atmos. Chem. Phys., 23, 221–233, https://doi.org/10.5194/acp-23-221-2023, https://doi.org/10.5194/acp-23-221-2023, 2023
Short summary
Short summary
Secondary organic aerosols (SOAs) can exhibit complex non-ideal behavior and adopt an amorphous semisolid state. We simulate condensation of semi-volatile compounds into a phase-separated particle to investigate the effect of non-ideality and particle phase state on the equilibration timescale of SOA partitioning. Our results provide useful insights into the interpretation of experimental observations and the description and treatment of SOA in aerosol models.
Christof G. Beer, Johannes Hendricks, and Mattia Righi
Atmos. Chem. Phys., 22, 15887–15907, https://doi.org/10.5194/acp-22-15887-2022, https://doi.org/10.5194/acp-22-15887-2022, 2022
Short summary
Short summary
Ice-nucleating particles (INPs) have important influences on cirrus clouds and the climate system; however, their global atmospheric distribution in the cirrus regime is still very uncertain. We present a global climatology of INPs under cirrus conditions derived from model simulations, considering the mineral dust, soot, crystalline ammonium sulfate, and glassy organics INP types. The comparison of respective INP concentrations indicates the large importance of ammonium sulfate particles.
Mykhailo Savenets, Larysa Pysarenko, Svitlana Krakovska, Alexander Mahura, and Tuukka Petäjä
Atmos. Chem. Phys., 22, 15777–15791, https://doi.org/10.5194/acp-22-15777-2022, https://doi.org/10.5194/acp-22-15777-2022, 2022
Short summary
Short summary
The paper explores the spatio-temporal variability of black carbon during a wildfire in August 2010, with a focus on Ukraine. As a research tool, the seamless Enviro-HIRLAM modelling system is used for investigating the atmospheric transport of aerosol particles emitted by wildfires from remote and local sources. The results of this study improve our understanding of the physical and chemical processes and the interactions of aerosols in the atmosphere.
Huilin Huang, Yun Qian, Ye Liu, Cenlin He, Jianyu Zheng, Zhibo Zhang, and Antonis Gkikas
Atmos. Chem. Phys., 22, 15469–15488, https://doi.org/10.5194/acp-22-15469-2022, https://doi.org/10.5194/acp-22-15469-2022, 2022
Short summary
Short summary
Using a clustering method developed in the field of artificial neural networks, we identify four typical dust transport patterns across the Sierra Nevada, associated with the mesoscale and regional-scale wind circulations. Our results highlight the connection between dust transport and dominant weather patterns, which can be used to understand dust transport in a changing climate.
Anbao Zhu, Haiming Xu, Jiechun Deng, Jing Ma, and Shaofeng Hua
Atmos. Chem. Phys., 22, 15425–15447, https://doi.org/10.5194/acp-22-15425-2022, https://doi.org/10.5194/acp-22-15425-2022, 2022
Short summary
Short summary
This study demonstrates the instant and delayed effects of biomass burning (BB) aerosols on precipitation over the Indochina Peninsula (ICP). The convection suppression due to the BB aerosol-induced stabilized atmosphere dominates over the favorable water-vapor condition induced by large-scale circulation responses, leading to an overall reduced precipitation in March, while the delayed effect promotes precipitation from early April to mid April due to the anomalous atmospheric circulations.
Wenjie Zhang, Hong Wang, Xiaoye Zhang, Liping Huang, Yue Peng, Zhaodong Liu, Xiao Zhang, and Huizheng Che
Atmos. Chem. Phys., 22, 15207–15221, https://doi.org/10.5194/acp-22-15207-2022, https://doi.org/10.5194/acp-22-15207-2022, 2022
Short summary
Short summary
Aerosol–cloud interaction (ACI) is first implemented in the atmospheric chemistry system GRAPES_Meso5.1/CUACE. ACI can improve the simulated cloud, temperature, and precipitation under haze pollution conditions in Jing-Jin-Ji in China. This paper demonstrates the critical role of ACI in current numerical weather prediction over the severely polluted region.
Santeri Tuovinen, Runlong Cai, Veli-Matti Kerminen, Jingkun Jiang, Chao Yan, Markku Kulmala, and Jenni Kontkanen
Atmos. Chem. Phys., 22, 15071–15091, https://doi.org/10.5194/acp-22-15071-2022, https://doi.org/10.5194/acp-22-15071-2022, 2022
Short summary
Short summary
We compare observed survival probabilities of atmospheric particles from Beijing, China, with survival probabilities based on analytical formulae and model simulations. We find observed survival probabilities under polluted conditions at smaller sizes to be higher, while at larger sizes they are lower than or similar to theoretical survival probabilities. Uncertainties in condensation sink and growth rate are unlikely to explain higher-than-predicted survival probabilities at smaller sizes.
Stephanie Woodward, Alistair A. Sellar, Yongming Tang, Marc Stringer, Andrew Yool, Eddy Robertson, and Andy Wiltshire
Atmos. Chem. Phys., 22, 14503–14528, https://doi.org/10.5194/acp-22-14503-2022, https://doi.org/10.5194/acp-22-14503-2022, 2022
Short summary
Short summary
We describe the dust scheme in the UKESM1 Earth system model and show generally good agreement with observations. Comparing with the closely related HadGEM3-GC3.1 model, we show that dust differences are not only due to inter-model differences but also to the dust size distribution. Under climate change, HadGEM3-GC3.1 dust hardly changes, but UKESM1 dust decreases because that model includes the vegetation response which, in our models, has a bigger impact on dust than climate change itself.
Yang Yang, Liangying Zeng, Hailong Wang, Pinya Wang, and Hong Liao
Atmos. Chem. Phys., 22, 14489–14502, https://doi.org/10.5194/acp-22-14489-2022, https://doi.org/10.5194/acp-22-14489-2022, 2022
Short summary
Short summary
Using an aerosol–climate model, dust pollution in China affected by different spatial and temporal types of El Niño are examined. Both eastern and central Pacific El Niño and short-duration El Niño increase winter dust concentrations over northern China, while long-duration El Niño decreases concentrations. Only long-duration El Niño events can significantly affect dust over China in the following spring. This study has profound implications for air pollution control and dust storm prediction.
Cited articles
Abascal, J. L. F., Sanz, E., Fernández, R. G., and Vega, C.: A Potential Model for the Study of Ices and Amorphous Water: TIP4P/Ice, J. Chem. Phys., 122, 234511, https://doi.org/10.1063/1.1931662, 2005. a, b, c
Berendsen, H. J. C., van der Spoel, D., and van Drunen, R.: GROMACS: A Message-passing Parallel Molecular Dynamics Implementation, Comput. Phys. Commun., 91, 43–56, https://doi.org/10.1016/0010-4655(95)00042-E, 1995. a
Campbell, J. M., Meldrum, F. C., and Christenson, H. K.: Is Ice Nucleation from Supercooled Water Insensitive to Surface Roughness, J. Phys. Chem. C, 119, 1164–1169, https://doi.org/10.1021/jp5113729, 2015. a, b, c
Campbell, J. M., Meldrum, F. C., and Christenson, H. K.: Observing the formation of ice and organic crystals in active sites, P. Natl. Acad. Sci. USA, 114, 810–815, https://doi.org/10.1073/pnas.1617717114, 2017. a, b
Cao, B., Xu, E., and Li, T.: Anomalous Stability of Two-Dimensional Ice Confined in Hydrophobic Nanopores, ACS Nano, 13, 4712–4719, https://doi.org/doi:10.1021/acsnano.9b01014, 2019. a, b, c
Christenson, H. K.: Two-step crystal nucleation via capillary condensation, Cryst. Eng. Comm., 15, 2030–2039, https://doi.org/10.1039/C3CE26887J, 2013. a
Christner, B. C., Morris, C. E., Foreman, C. M., Cai, R., and Sands, D. C.: Ubiquity of Biological Ice Nucleators in Snowfall, Science, 319, 1214–1214, https://doi.org/10.1126/science.1149757, 2008. a
Cox, S. J., Kathmann, S. M., Slater, B., and Michaelides, A.: Molecular Simulations of Heterogeneous Ice Nucleation. I. Controlling Ice Nucleation Through Surface Hydrophilicity, J. Chem. Phys., 142, 184704, https://doi.org/10.1063/1.4919714, 2015. a
David, R. O., Marcolli, C., Fahrni, J., Qiu, Y., Perez Sirkin, Y. A., Molinero, V., Mahrt, F., Brühwiler, D., Lohmann, U., and Kanji, Z. A.: Pore condensation and freezing is responsible for ice formation below water saturation for porous particles, P. Natl. Acad. Sci. USA, 116, 8184–8189, https://doi.org/10.1073/pnas.1813647116, 2019. a
Djikaev, Y. S., Tabazadeh, A., Hamill, P., and Reiss, H.: Thermodynamic Conditions for the Surface-Stimulated Crystallization of Atmospheric Droplets, J. Phys. Chem. A, 106, 10247–10253, https://doi.org/10.1021/jp021044s, 2002. a
Donadio, D., Raiteri, P., and Parrinello, M.: Topological defects and bulk melting of hexagonal ice, J. Phys. Chem. B, 109, 5421–5424, https://doi.org/10.1021/jp050690z, 2005. a
Espinosa, J. R., Navarro, C., Sanz, E., Valeriani, C., and Vega, C.: On the time required to freeze water, J. Chem. Phys., 145, 211922, https://doi.org/10.1063/1.4965427, 2016a. a
Espinosa, J. R., Vega, C., and Sanz, E.: Ice–Water Interfacial Free Energy for the TIP4P, TIP4P/2005, TIP4P/Ice, and mW Models As Obtained from the Mold Integration Technique, J. Phys. Chem. C, 120, 8068–8075, https://doi.org/10.1021/acs.jpcc.5b11221, 2016b. a
Essmann, U., Perera, L., Berkowitz, M. L., Darden, T., Lee, H., and Pedersen, L. G.: A smooth particle mesh Ewald method, J. Chem. Phys., 103, 8577–8593, https://doi.org/10.1063/1.470117, 1995. a
Fernandez, R. G., Abascal, J. L. F., and Vega, C.: The melting point of ice I-h for common water models calculated from direct coexistence of the solid-liquid interface, J. Chem. Phys., 124, 144506, https://doi.org/10.1063/1.2183308, 2006. a
Glatz, B. and Sarupria, S.: The Surface Charge Distribution Affects the Ice Nucleating Efficiency of Silver Iodide, J. Chem. Phys., 145, 211924, https://doi.org/10.1063/1.4966018, 2016. a, b
Guoying, B., Dong, G., Zhang, L., Xin, Z., and Jianjun, W.: Probing the critical nucleus size for ice formation with graphene oxide nanosheets, Nature, 576, 437–441, https://doi.org/10.1038/s41586-019-1827-6, 2019. a
Hale, B. N. and Kiefer, J.: Studies of H2O on beta-AgI Surfaces – An Effective Pair Potential Model, J. Chem. Phys., 73, 923–933, https://doi.org/10.1063/1.440211, 1980. a
Hawker, R. E., Miltenberger, A. K., Wilkinson, J. M., Hill, A. A., Shipway, B. J., Cui, Z., Cotton, R. J., Carslaw, K. S., Field, P. R., and Murray, B. J.: The temperature dependence of ice-nucleating particle concentrations affects the radiative properties of tropical convective cloud systems, Atmos. Chem. Phys., 21, 5439–5461, https://doi.org/10.5194/acp-21-5439-2021, 2021. a
Hess, B., Bekker, H., Berendsen, H. J. C., and Fraaije, J. G. E. M.: LINCS: A linear constraint solver for molecular simulations, J. Comput. Chem., 18, 1463–1472, https://doi.org/10.1002/(SICI)1096-987X(199709)18:12<1463::AID-JCC4>3.0.CO;2-H, 1997. a
Hiranuma, N., Hoffmann, N., Kiselev, A., Dreyer, A., Zhang, K., Kulkarni, G., Koop, T., and Möhler, O.: Influence of surface morphology on the immersion mode ice nucleation efficiency of hematite particles, Atmos. Chem. Phys., 14, 2315–2324, https://doi.org/10.5194/acp-14-2315-2014, 2014. a, b
Holden, M. A., Whale, T. F., Tarn, M. D., O'Sullivan, D., Walshaw, R. D., Murray, B. J., Meldrum, F. C., and Christenson, H. K.: High-speed imaging of ice nucleation in water proves the existence of active sites, Sci. Adv., 5, eaav4316, https://doi.org/10.1126/sciadv.aav4316, 2019. a, b, c
Holden, M. A., Campbell, J. M., Meldrum, F. C., Murray, B. J., and Christenson, H. K.: Active sites for ice nucleation differ depending on nucleation mode, P. Natl. Acad. Sci. USA, 118, e2022859118, https://doi.org/10.1073/pnas.2022859118, 2021. a, b
Hoover, W. G.: Canonical dynamics: Equilibrium phase-space distributions, Phys. Rev. A, 31, 1695–1697, https://doi.org/10.1103/PhysRevA.31.1695, 1985. a
Hudait, A., Qiu, S., Lupi, L., and Molinero, V.: Free energy contributions and structural characterization of stacking disordered ices, Phys. Chem. Chem. Phys., 18, 9544–9553, https://doi.org/10.1039/C6CP00915H, 2016. a, b
Kanji, Z. A., Ladino, L. A., Wex, H., Boose, Y., Burkert-Kohn, M., Cziczo, D. J., and Krämer, M.: Overview of Ice Nucleating Particles, Meteor. Mon., 58, 1.1–1.33, https://doi.org/10.1175/AMSMONOGRAPHS-D-16-0006.1, 2017. a
Kastelowitz, N. and Molinero, V.: Ice–Liquid Oscillations in Nanoconfined Water, ACS Nano, 12, 8234–8239, https://doi.org/10.1021/acsnano.8b03403, 2018. a
Kiselev, A., Bachmann, F., Pedevilla, P., Cox, S. J., Michaelides, A., Gerthsen, D., and Leisner, T.: Active sites in heterogeneous ice nucleation – the example of K-rich feldspars, Science, 355, 367–371, https://doi.org/10.1126/science.aai8034, 2017. a, b, c
Koop, T.: Crystals creeping out of cracks, P. Natl. Acad. Sci. USA, 114, 797–799, https://doi.org/10.1073/pnas.1620084114, 2017. a
Li, C., Tao, R., Luo, S., Gao, X., Zhang, K., and Li, Z.: Enhancing and Impeding Heterogeneous Ice Nucleation through Nanogrooves, J. Phys. Chem. C, 122, 25992–25998, https://doi.org/10.1021/acs.jpcc.8b07779, 2018. a, b, c
Limmer, D. T. and Chandler, D.: Phase diagram of supercooled water confined to hydrophilic nanopores, J. Chem. Phys., 137, 044509, https://doi.org/10.1063/1.4737907, 2012. a
Ling, M. L., Wex, H., Grawe, S., Jakobsson, J., Löndahl, J., Hartmann, S., Finster, K., Boesen, T., and Šantl Temkiv, T.: Effects of Ice Nucleation Protein Repeat Number and Oligomerization Level on Ice Nucleation Activity, J. Geophys. Res.-Atmos., 123, 1802–1810, https://doi.org/10.1002/2017JD027307, 2018. a
Marcolli, C.: Deposition nucleation viewed as homogeneous or immersion freezing in pores and cavities, Atmos. Chem. Phys., 14, 2071–2104, https://doi.org/10.5194/acp-14-2071-2014, 2014. a
Marcolli, C., Nagare, B., Welti, A., and Lohmann, U.: Ice nucleation efficiency of AgI: review and new insights, Atmos. Chem. Phys., 16, 8915–8937, https://doi.org/10.5194/acp-16-8915-2016, 2016. a
Molinero, V. and Moore, E. B.: Water Modeled As an Intermediate Element between Carbon and Silicon, J. Phys. Chem. B, 113, 4008–4016, https://doi.org/10.1021/jp805227c, 2009. a, b
Moore, E. B., de la Llave, E., Welke, K., Scherlis, D. A., and Molinero, V.: Freezing, melting and structure of ice in a hydrophilic nanopore, Phys. Chem. Chem. Phys., 12, 4124–4134, https://doi.org/10.1039/B919724A, 2010. a
Murray, B. J., O'Sullivan, D., Atkinson, J. D., and Webb, M. E.: Ice nucleation by particles immersed in supercooled cloud droplets, Chem. Soc. Rev., 41, 6519–6554, https://doi.org/10.1039/C2CS35200A, 2012. a
Nosé, S.: A unified formulation of the constant temperature molecular dynamics methods, J. Chem. Phys., 81, 511–519, https://doi.org/10.1063/1.447334, 1984. a
opakarin: opakarin/lich-test: (Version vApr2021), Zenodo [code], https://doi.org/10.5281/zenodo.6937012, 2022. a
Page, A. J. and Sear, R. P.: Heterogeneous Nucleation in and out of Pores, Phys. Rev. Lett., 97, 065701, https://doi.org/10.1103/PhysRevLett.97.065701, 2006. a
Page, A. J. and Sear, R. P.: Crystallization Controlled by the Geometry of a Surface, J. Am. Chem. Soc., 131, 17550–17551, https://doi.org/10.1021/ja9085512, 2009. a, b
Plimpton, S.: Fast Parallel Algorithms for Short-Range Molecular Dynamics, J. Comput. Phys., 117, 1–19, https://doi.org/10.1006/jcph.1995.1039, 1995. a
Prerna, Goswami, R., Metya, A. K., Shevkunov, S. V., and Singh, J. K.: Study of ice nucleation on silver iodide surface with defects, Mol. Phys., 117, 3651–3663, https://doi.org/10.1080/00268976.2019.1657599, 2019. a
Pruppacher, H. and Klett, J.: Microphysics of Clouds and Precipitation, 2nd edn., Springer, Dordrecht, https://doi.org/10.1007/978-0-306-48100-0, 2010. a
Roudsari, G.: Atomistic and coarse grained simulations reveal increased ice nucleation activity on silver iodide surfaces in slit and wedge geometries –
Simulation data, Fairdata [data set], https://doi.org/10.23729/d841cfd5-eef9-4ae4-a820-50becf91ec97, 2022. a
Roudsari, G., Reischl, B., Pakarinen, O. H., and Vehkamäki, H.: Atomistic Simulation of Ice Nucleation on Silver Iodide (0001) Surfaces with Defects, J. Phys. Chem. C, 124, 436–445, https://doi.org/10.1021/acs.jpcc.9b08502, 2020. a, b, c, d
Sayer, T. and Cox, S. J.: Stabilization of AgI's polar surfaces by the aqueous environment, and its implications for ice formation, Phys. Chem. Chem. Phys., 21, 14546–14555, https://doi.org/10.1039/C9CP02193K, 2019. a, b
Sayer, T. and Cox, S. J.: Macroscopic surface charges from microscopic simulations, J. Chem. Phys., 153, 164709, https://doi.org/10.1063/5.0022596, 2020. a
Shevkunov, S. V.: Structure of Water Adsorbed in Slit-shaped Pores of Silver Iodide Crystal, Comput. Theor. Chem., 1084, 1–16, https://doi.org/10.1016/j.comptc.2016.03.014, 2016. a
Soni, A. and Patey, G. N.: How Microscopic Features of Mineral Surfaces Critically Influence Heterogeneous Ice Nucleation, J. Phys. Chem. C, 125, 10723–10737, https://doi.org/10.1021/acs.jpcc.1c01740, 2021. a
Sosso, G. C., Chen, J., Cox, S. J., Fitzner, M., Pedevilla, P., Zen, A., and Michaelides, A.: Crystal Nucleation in Liquids: Open Questions and Future Challenges in Molecular Dynamics Simulations, Chem. Rev., 116, 7078–7116, https://doi.org/10.1021/acs.chemrev.5b00744, 2016. a, b
Tabazadeh, A., Djikaev, Y. S., and Reiss, H.: Surface crystallization of supercooled water in clouds, P. Natl. Acad. Sci. USA, 99, 15873–15878, https://doi.org/10.1073/pnas.252640699, 2002. a
Turnbull, D.: Kinetics of Heterogeneous Nucleation, J. Chem. Phys., 18, 198–203, https://doi.org/10.1063/1.1747588, 1950. a
van der Spoel, D., Lindahl, E., Hess, B., Groenhof, G., Mark, A. E., and Berendsen, H. J.: GROMACS: Fast, Flexible, and Free, J. Comput. Chem., 26, 1701–1718, https://doi.org/10.1002/jcc.20291, 2005. a
Vonnegut, B.: The Nucleation of Ice Formation by Silver Iodide, J. Appl. Phys., 18, 593–595, https://doi.org/10.1063/1.1697813, 1947. a
Zhang, X.-X., Chen, M., and Fu, M.: Impact of surface nanostructure on ice nucleation, J. Chem. Phys., 141, 124709, https://doi.org/10.1063/1.4896149, 2014. a, b
Zhang, Z., Ying, Y., Xu, M., Zhang, C., Rao, Z., Ke, S., Zhou, Y., Huang, H., and Fei, L.: Atomic Steps Induce the Aligned Growth of Ice Crystals on Graphite Surfaces, Nano Lett., 20, 8112–8119, https://doi.org/10.1021/acs.nanolett.0c03132, 2020. a
Zielke, S. A., Bertram, A. K., and Patey, G. N.: Simulations of Ice Nucleation by Model AgI Disks and Plates, J. Phys. Chem. B, 120, 2291–2299, https://doi.org/10.1021/acs.jpcb.5b06605, 2016. a, b, c
Zobrist, B., Koop, T., Luo, B., Marcolli, C., and Peter, T.: Heterogeneous ice nucleation rate coefficient of water droplets coated by a nonadecanol monolayer, J. Phys. Chem. C, 111, 2149–2155, https://doi.org/10.1021/jp066080w, 2007. a
Short summary
We use atomistic simulations to study heterogeneous ice nucleation on silver iodide surfaces in slit and wedge geometries at low supercooling which serve as a model of irregularities on real atmospheric aerosol particle surfaces. The revealed microscopic ice nucleation mechanisms in confined geometries strongly support the experimental evidence for the importance of surface features such as cracks or pits functioning as active sites for ice nucleation in the atmosphere.
We use atomistic simulations to study heterogeneous ice nucleation on silver iodide surfaces in...
Altmetrics
Final-revised paper
Preprint