Articles | Volume 10, issue 16
https://doi.org/10.5194/acp-10-7643-2010
© Author(s) 2010. 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-10-7643-2010
© Author(s) 2010. This work is distributed under
the Creative Commons Attribution 3.0 License.
the Creative Commons Attribution 3.0 License.
Structure-activity relationships to estimate the effective Henry's law constants of organics of atmospheric interest
T. Raventos-Duran
LISA, UMR CNRS/INSU 7583, Université Paris Est Créteil et Université Paris Diderot, Institut Pierre Simon Laplace, 94010 Créteil Cedex, France
M. Camredon
LISA, UMR CNRS/INSU 7583, Université Paris Est Créteil et Université Paris Diderot, Institut Pierre Simon Laplace, 94010 Créteil Cedex, France
R. Valorso
LISA, UMR CNRS/INSU 7583, Université Paris Est Créteil et Université Paris Diderot, Institut Pierre Simon Laplace, 94010 Créteil Cedex, France
C. Mouchel-Vallon
LISA, UMR CNRS/INSU 7583, Université Paris Est Créteil et Université Paris Diderot, Institut Pierre Simon Laplace, 94010 Créteil Cedex, France
B. Aumont
LISA, UMR CNRS/INSU 7583, Université Paris Est Créteil et Université Paris Diderot, Institut Pierre Simon Laplace, 94010 Créteil Cedex, France
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70 citations as recorded by crossref.
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- Aqueous-Phase Oxidation of Terpene-Derived Acids by Atmospherically Relevant Radicals T. Otto et al.
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- Technical Note: Development of chemoinformatic tools to enumerate functional groups in molecules for organic aerosol characterization G. Ruggeri & S. Takahama
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- Structural and Light-Absorption Characteristics of Complex Water-Insoluble Organic Mixtures in Urban Submicrometer Aerosols Q. Chen et al.
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70 citations as recorded by crossref.
- Boreal forest BVOC exchange: emissions versus in-canopy sinks P. Zhou et al.
- Furoyl peroxynitrate (fur-PAN), a product of VOC–NOxphotochemistry from biomass burning emissions: photochemical synthesis, calibration, chemical characterization, and first atmospheric observations J. Roberts et al.
- Reliability analysis of soil slope stability using MARS, GPR and FN soft computing techniques R. Ray et al.
- Molecular characterization of gaseous and particulate oxygenated compounds at a remote site in Cape Corsica in the western Mediterranean Basin V. Michoud et al.
- Development of a protocol for the auto-generation of explicit aqueous-phase oxidation schemes of organic compounds P. Bräuer et al.
- Reliability analysis of reinforced soil slope stability using GA-ANFIS, RFC, and GMDH soft computing techniques R. Ray et al.
- Comprehensive isoprene and terpene gas-phase chemistry improves simulated surface ozone in the southeastern US R. Schwantes et al.
- CLEPS 1.0: A new protocol for cloud aqueous phase oxidation of VOC mechanisms C. Mouchel-Vallon et al.
- Exploration of oxidative chemistry and secondary organic aerosol formation in the Amazon during the wet season: explicit modeling of the Manaus urban plume with GECKO-A C. Mouchel-Vallon et al.
- Online headspace monitoring of volatile organic compounds using proton transfer reaction-mass spectrometry: Application to the multiphase atmospheric fate of 2,4-hexadienedial N. Brun et al.
- Recent advances in thermal desorption-gas chromatography-mass spectrometery method to eliminate the matrix effect between air and water samples: Application to the accurate determination of Henry's law constant Y. Kim & K. Kim
- The effect of dry and wet deposition of condensable vapors on secondary organic aerosols concentrations over the continental US C. Knote et al.
- Aqueous-Phase Oxidation of Terpene-Derived Acids by Atmospherically Relevant Radicals T. Otto et al.
- Large contribution to secondary organic aerosol from isoprene cloud chemistry H. Lamkaddam et al.
- Uncertain Henry's law constants compromise equilibrium partitioning calculations of atmospheric oxidation products C. Wang et al.
- Secondary organic aerosol formation from isoprene photooxidation during cloud condensation–evaporation cycles L. Brégonzio-Rozier et al.
- Application of soft computing techniques for shallow foundation reliability in geotechnical engineering R. Ray et al.
- Tropospheric Aqueous-Phase Chemistry: Kinetics, Mechanisms, and Its Coupling to a Changing Gas Phase H. Herrmann et al.
- Modeling of hygroscopicity parameter kappa of organic aerosols using quantitative structure-property relationships J. Markelj et al.
- Predicting gas–particle partitioning coefficients of atmospheric molecules with machine learning E. Lumiaro et al.
- Influence of Eccentrically Inclined Loading on Foundations Above Tunnels: A Combined Finite Element Analysis and Machine Learning Approach A. Kumar et al.
- Effects of thermodynamics parameters on mass transfer of volatile pollutants at air-water interface L. Chen et al.
- Assessing the efficiency of water-soluble organic compound biodegradation in clouds under various environmental conditions L. Pailler et al.
- Predicting Temperature-Dependent Aqueous Henry’s Law Constants Using Group Contribution Methods S. Brockbank et al.
- Measurement of Henry's law and liquid-phase loss rate constants of peroxypropionic nitric anhydride (PPN) in deionized water and in n-octanol K. Easterbrook et al.
- Technical Note: Development of chemoinformatic tools to enumerate functional groups in molecules for organic aerosol characterization G. Ruggeri & S. Takahama
- Methylglyoxal Uptake Coefficients on Aqueous Aerosol Surfaces D. De Haan et al.
- On the implications of aerosol liquid water and phase separation for organic aerosol mass H. Pye et al.
- Limited influence of dry deposition of semivolatile organic vapors on secondary organic aerosol formation in the urban plume A. Hodzic et al.
- Direct photolysis of carbonyl compounds dissolved in cloud and fog~droplets S. Epstein et al.
- Structure–activity relationship for the estimation of OH-oxidation rate constants of carbonyl compounds in the aqueous phase J. Doussin & A. Monod
- Tropospheric Aqueous-Phase Oxidation of Isoprene-Derived Dihydroxycarbonyl Compounds T. Otto et al.
- Chemical Structural Characteristics of HULIS and Other Fractionated Organic Matter in Urban Aerosols: Results from Mass Spectral and FT-IR Analysis Q. Chen et al.
- Effect of Polyvinyl Alcohol Ligands on Supported Gold Nano-Catalysts: Morphological and Kinetics Studies S. Scurti et al.
- Precursors for cytochrome P450 profiling breath tests from anin silicoscreening approach S. von Grafenstein et al.
- Layered-double hydroxides and derived oxide as CRM-free highly active catalysts for the reduction of 4-nitrophenol E. Orfei et al.
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- How accurate are physical property estimation programs for organosilicon compounds? R. Boethling & W. Meylan
- Impact of organic molecular structure on the estimation of atmospherically relevant physicochemical parameters G. Isaacman-VanWertz & B. Aumont
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- EVAPORATION: a new vapour pressure estimation methodfor organic molecules including non-additivity and intramolecular interactions S. Compernolle et al.
- Henry's law constants of diacids and hydroxy polyacids: recommended values S. Compernolle & J. Müller
- The photolysis of α-hydroperoxycarbonyls Z. Liu et al.
- Explicit modeling of volatile organic compounds partitioning in the atmospheric aqueous phase C. Mouchel-Vallon et al.
- A new approach for measuring the carbon and oxygen content of atmospherically relevant compounds and mixtures J. Hurley et al.
- Compilation of Henry's law constants (version 4.0) for water as solvent R. Sander
- Emissions and Partitioning of Intermediate-Volatility and Semi-Volatile Polar Organic Compounds (I/SV-POCs) During Laboratory Combustion of Boreal and Sub-Tropical Peat R. Yatavelli et al.
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- On the importance of atmospheric loss of organic nitrates by aqueous-phase ●OH oxidation J. González-Sánchez et al.
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- Effects of Precursor Structure on First-Generation Photo-Oxidation Organic Aerosol Formation D. Sofio et al.
- Compilation of Henry's law constants (version 5.0.0) for water as solvent R. Sander
- A new method for the determination of Henry's law constants (air-water-partition coefficients) M. Abraham et al.
- Approach to evaluate the gas/aerosol partition coefficient of organic volatile compounds using DFT methods associated with polarizable continuum models L. de Castilho et al.
- Development of a multiphase chemical mechanism to improve secondary organic aerosol formation in CAABA/MECCA (version 4.7.0) F. Wieser et al.
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- Measurement of Henry's law constants of ethyl nitrate in deionized water, synthetic sea salt solutions, and n-octanol K. Easterbrook et al.
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- Time-Resolved Measurements of Indoor Chemical Emissions, Deposition, and Reactions in a University Art Museum D. Pagonis et al.
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- Determination of descriptors for polycyclic aromatic hydrocarbons and related compounds by chromatographic methods and liquid–liquid partition in totally organic biphasic systems T. Ariyasena & C. Poole
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