Articles | Volume 22, issue 15
https://doi.org/10.5194/acp-22-10099-2022
https://doi.org/10.5194/acp-22-10099-2022
Research article
 | 
08 Aug 2022
Research article |  | 08 Aug 2022

Atomistic and coarse-grained simulations reveal increased ice nucleation activity on silver iodide surfaces in slit and wedge geometries

Golnaz Roudsari, Olli H. Pakarinen, Bernhard Reischl, and Hanna Vehkamäki

Related authors

Collision-sticking rates of acid–base clusters in the gas phase determined from atomistic simulation and a novel analytical interacting hard-sphere model
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
Modeling approaches for atmospheric ion–dipole collisions: all-atom trajectory simulations and central field methods
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
A study on the fragmentation of sulfuric acid and dimethylamine clusters inside an atmospheric pressure interface time-of-flight mass spectrometer
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
Clear, transparent, and timely communication for fair authorship decisions: a practical guide
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
Predicting gas–particle partitioning coefficients of atmospheric molecules with machine learning
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

Related subject area

Subject: Aerosols | Research Activity: Atmospheric Modelling and Data Analysis | Altitude Range: Troposphere | Science Focus: Physics (physical properties and processes)
Microphysical modelling of aerosol scavenging by different types of clouds: description and validation of the approach
Pascal Lemaitre, Arnaud Quérel, Alexis Dépée, Alice Guerra Devigne, Marie Monier, Thibault Hiron, Chloé Soto Minguez, Daniel Hardy, and Andrea Flossmann
Atmos. Chem. Phys., 24, 9713–9732, https://doi.org/10.5194/acp-24-9713-2024,https://doi.org/10.5194/acp-24-9713-2024, 2024
Short summary
Insights into the sources of ultrafine particle numbers at six European urban sites obtained by investigating COVID-19 lockdowns
Alex Rowell, James Brean, David C. S. Beddows, Tuukka Petäjä, Máté Vörösmarty, Imre Salma, Jarkko V. Niemi, Hanna E. Manninen, Dominik van Pinxteren, Thomas Tuch, Kay Weinhold, Zongbo Shi, and Roy M. Harrison
Atmos. Chem. Phys., 24, 9515–9531, https://doi.org/10.5194/acp-24-9515-2024,https://doi.org/10.5194/acp-24-9515-2024, 2024
Short summary
In-plume and out-of-plume analysis of aerosol–cloud interactions derived from the 2014–2015 Holuhraun volcanic eruption
Amy H. Peace, Ying Chen, George Jordan, Daniel G. Partridge, Florent Malavelle, Eliza Duncan, and Jim M. Haywood
Atmos. Chem. Phys., 24, 9533–9553, https://doi.org/10.5194/acp-24-9533-2024,https://doi.org/10.5194/acp-24-9533-2024, 2024
Short summary
Impacts of atmospheric circulation patterns and cloud inhibition on aerosol radiative effect and boundary layer structure during winter air pollution in Sichuan Basin, China
Hua Lu, Min Xie, Bingliang Zhuang, Danyang Ma, Bojun Liu, Yangzhihao Zhan, Tijian Wang, Shu Li, Mengmeng Li, and Kuanguang Zhu
Atmos. Chem. Phys., 24, 8963–8982, https://doi.org/10.5194/acp-24-8963-2024,https://doi.org/10.5194/acp-24-8963-2024, 2024
Short summary
Investigating the sign of stratocumulus adjustments to aerosols in the ICON global storm-resolving model
Emilie Fons, Ann Kristin Naumann, David Neubauer, Theresa Lang, and Ulrike Lohmann
Atmos. Chem. Phys., 24, 8653–8675, https://doi.org/10.5194/acp-24-8653-2024,https://doi.org/10.5194/acp-24-8653-2024, 2024
Short summary

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
Bi, Y., Cao, B., and Li, T.: Enhanced heterogeneous ice nucleation by special surface geometry, Nat. Commun., 9, 15372, https://doi.org/10.1038/ncomms15372, 2017. a, b, c, d, e, f, g, h, i
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
Download
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.
Altmetrics
Final-revised paper
Preprint