Articles | Volume 11, issue 13
https://doi.org/10.5194/acp-11-6549-2011
© Author(s) 2011. This work is distributed under
the Creative Commons Attribution 3.0 License.
the Creative Commons Attribution 3.0 License.
https://doi.org/10.5194/acp-11-6549-2011
© Author(s) 2011. This work is distributed under
the Creative Commons Attribution 3.0 License.
the Creative Commons Attribution 3.0 License.
Model HULIS compounds in nanoaerosol clusters – investigations of surface tension and aggregate formation using molecular dynamics simulations
T. Hede
Department of Meteorology, Stockholm University, 10691 Stockholm, Sweden
X. Li
Laboratory for Advanced Materials and Institute of Fine Chemicals, East China University of Science and Technology, Shanghai 200237, China
Department of Theoretical Chemistry, School of Biotechnology, Royal Institute of Technology, 10691 Stockholm, Sweden
C. Leck
Department of Meteorology, Stockholm University, 10691 Stockholm, Sweden
Y. Tu
Department of Theoretical Chemistry, School of Biotechnology, Royal Institute of Technology, 10691 Stockholm, Sweden
H. Ågren
Department of Theoretical Chemistry, School of Biotechnology, Royal Institute of Technology, 10691 Stockholm, Sweden
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Cited
24 citations as recorded by crossref.
- Amplified Feedback Mechanism of the Forests-Aerosols-Climate System T. Hede et al. 10.1155/2015/262980
- Molecular Interaction of Pinic Acid with Sulfuric Acid: Exploring the Thermodynamic Landscape of Cluster Growth J. Elm et al. 10.1021/jp503736s
- Water Activity from Equilibrium Molecular Dynamics Simulations and Kirkwood-Buff Theory M. Lbadaoui-Darvas & S. Takahama 10.1021/acs.jpcb.9b06735
- Importance of aerosol composition and mixing state for cloud droplet activation over the Arctic pack ice in summer C. Leck & E. Svensson 10.5194/acp-15-2545-2015
- Simulations of Light Absorption of Carbon Particles in Nanoaerosol Clusters T. Hede et al. 10.1021/jp412384j
- Efficient scavenging of Criegee intermediates on water by surface-active cis-pinonic acid S. Enami & A. Colussi 10.1039/C7CP03869K
- Molecular-scale simulations of organic compounds on ice: application to atmospheric and interstellar sciences S. Picaud & P. Jedlovszky 10.1080/08927022.2018.1502428
- Molecular Dynamics Simulations of the Interaction between Water Molecules and Aggregates of Acetic or Propionic Acid Molecules B. Radola et al. 10.1021/acs.jpcb.5b08110
- Correlation between Surface Tension and the Bulk Dynamics in Salty Atmospheric Aquatic Droplets A. Salameh et al. 10.1021/acs.jpcc.6b01842
- Insights into the mechanism of electrostatic field promoting ozone mass transfer in water: A molecular dynamics perspective Y. Han et al. 10.1016/j.scitotenv.2022.157710
- Constraints on the Role of Laplace Pressure in Multiphase Reactions and Viscosity of Organic Aerosols S. Petters 10.1029/2022GL098959
- Molecular dynamics simulation of the local concentration and structure in multicomponent aerosol nanoparticles under atmospheric conditions K. Karadima et al. 10.1039/C7CP02036H
- Size-Dependent Liquid–Liquid Phase Separation in Atmospherically Relevant Complex Systems T. Kucinski et al. 10.1021/acs.jpclett.9b02532
- Analysis of Mixed Formic and Acetic Acid Aggregates Interacting With Water: A Molecular Dynamics Simulation Study B. Radola et al. 10.1021/acs.jpcc.7b02728
- Uptake of Common Atmospheric Gases by Organic-Coated Water Droplets W. Li et al. 10.1021/acs.jpcc.9b03252
- Insights into the morphology of multicomponent organic and inorganic aerosols from molecular dynamics simulations K. Karadima et al. 10.5194/acp-19-5571-2019
- Combined Effect of Glycine and Sea Salt on Aerosol Cloud Droplet Activation Predicted by Molecular Dynamics Simulations L. Sun et al. 10.1021/jp407538x
- Water and formic acid aggregates: A molecular dynamics study D. Vardanega & S. Picaud 10.1063/1.4894658
- Understanding water interactions with organic surfaces: environmental molecular beam and molecular dynamics studies of the water–butanol system S. Johansson et al. 10.1039/C8CP04151B
- The Dynamics and Kinetics of Water Interactions with a Condensed Nopinone Surface S. Johansson et al. 10.1021/acs.jpca.7b06263
- Surface tension depression by low-solubility organic material in aqueous aerosol mimics A. Schwier et al. 10.1016/j.atmosenv.2012.02.032
- Current state of aerosol nucleation parameterizations for air-quality and climate modeling K. Semeniuk & A. Dastoor 10.1016/j.atmosenv.2018.01.039
- Cloud droplet activation mechanisms of amino acid aerosol particles: insight from molecular dynamics simulations X. Li et al. 10.3402/tellusb.v65i0.20476
- Molecular Dynamics Simulations of Small Halogenated Organics at the Air–Water Interface: Implications in Water Treatment and Atmospheric Chemistry A. Habartová et al. 10.1021/jp405292k
24 citations as recorded by crossref.
- Amplified Feedback Mechanism of the Forests-Aerosols-Climate System T. Hede et al. 10.1155/2015/262980
- Molecular Interaction of Pinic Acid with Sulfuric Acid: Exploring the Thermodynamic Landscape of Cluster Growth J. Elm et al. 10.1021/jp503736s
- Water Activity from Equilibrium Molecular Dynamics Simulations and Kirkwood-Buff Theory M. Lbadaoui-Darvas & S. Takahama 10.1021/acs.jpcb.9b06735
- Importance of aerosol composition and mixing state for cloud droplet activation over the Arctic pack ice in summer C. Leck & E. Svensson 10.5194/acp-15-2545-2015
- Simulations of Light Absorption of Carbon Particles in Nanoaerosol Clusters T. Hede et al. 10.1021/jp412384j
- Efficient scavenging of Criegee intermediates on water by surface-active cis-pinonic acid S. Enami & A. Colussi 10.1039/C7CP03869K
- Molecular-scale simulations of organic compounds on ice: application to atmospheric and interstellar sciences S. Picaud & P. Jedlovszky 10.1080/08927022.2018.1502428
- Molecular Dynamics Simulations of the Interaction between Water Molecules and Aggregates of Acetic or Propionic Acid Molecules B. Radola et al. 10.1021/acs.jpcb.5b08110
- Correlation between Surface Tension and the Bulk Dynamics in Salty Atmospheric Aquatic Droplets A. Salameh et al. 10.1021/acs.jpcc.6b01842
- Insights into the mechanism of electrostatic field promoting ozone mass transfer in water: A molecular dynamics perspective Y. Han et al. 10.1016/j.scitotenv.2022.157710
- Constraints on the Role of Laplace Pressure in Multiphase Reactions and Viscosity of Organic Aerosols S. Petters 10.1029/2022GL098959
- Molecular dynamics simulation of the local concentration and structure in multicomponent aerosol nanoparticles under atmospheric conditions K. Karadima et al. 10.1039/C7CP02036H
- Size-Dependent Liquid–Liquid Phase Separation in Atmospherically Relevant Complex Systems T. Kucinski et al. 10.1021/acs.jpclett.9b02532
- Analysis of Mixed Formic and Acetic Acid Aggregates Interacting With Water: A Molecular Dynamics Simulation Study B. Radola et al. 10.1021/acs.jpcc.7b02728
- Uptake of Common Atmospheric Gases by Organic-Coated Water Droplets W. Li et al. 10.1021/acs.jpcc.9b03252
- Insights into the morphology of multicomponent organic and inorganic aerosols from molecular dynamics simulations K. Karadima et al. 10.5194/acp-19-5571-2019
- Combined Effect of Glycine and Sea Salt on Aerosol Cloud Droplet Activation Predicted by Molecular Dynamics Simulations L. Sun et al. 10.1021/jp407538x
- Water and formic acid aggregates: A molecular dynamics study D. Vardanega & S. Picaud 10.1063/1.4894658
- Understanding water interactions with organic surfaces: environmental molecular beam and molecular dynamics studies of the water–butanol system S. Johansson et al. 10.1039/C8CP04151B
- The Dynamics and Kinetics of Water Interactions with a Condensed Nopinone Surface S. Johansson et al. 10.1021/acs.jpca.7b06263
- Surface tension depression by low-solubility organic material in aqueous aerosol mimics A. Schwier et al. 10.1016/j.atmosenv.2012.02.032
- Current state of aerosol nucleation parameterizations for air-quality and climate modeling K. Semeniuk & A. Dastoor 10.1016/j.atmosenv.2018.01.039
- Cloud droplet activation mechanisms of amino acid aerosol particles: insight from molecular dynamics simulations X. Li et al. 10.3402/tellusb.v65i0.20476
- Molecular Dynamics Simulations of Small Halogenated Organics at the Air–Water Interface: Implications in Water Treatment and Atmospheric Chemistry A. Habartová et al. 10.1021/jp405292k
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