florent Louis
345
Documents
Publications
A mechanistic and kinetics study of the hydroxyl radical-initial oxidation reaction of β-endosulfan pesticide in the aqueous phaseThe 10th Virtual Winter School on Computational Chemistry, Jan 2024, Lausanne, Switzerland
Poster de conférence
hal-04463406v1
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Hydroxyl radical-initiated oxidation of β-endosulfan pesticide in the aqueous phase: A mechanistic and kinetics study#RSCPoster LinkedIn Conference, Mar 2024, London, United Kingdom
Poster de conférence
hal-04528955v1
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Carbofuran oxidation by HO radical in the gas phase#RSCPoster LinkedIn Conference, Mar 2024, London, United Kingdom
Poster de conférence
hal-04528931v1
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The environmental oxidation of phosmet insecticide by HO• radical in gas and water: Mechanism, kinetics, and ecotoxicity#RSCPoster LinkedIn Conference, Mar 2024, Villeneuve d'Ascq, France
Poster de conférence
hal-04558273v1
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A theoretical study on the HO●-initiated oxidation of chlorpyrifos pesticide: Mechanism, kinetics, and ecotoxicity2024 scientific day of the Labex CaPPA, Mar 2024, Villeneuve d'Ascq, France
Poster de conférence
hal-04558241v1
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In silico investigation of DMSe and DMDSe and radicals, unraveling relevant molecular parameters: structural and thermochemical properties#RSCPoster LinkedIn Conference, Mar 2024, London, United Kingdom
Poster de conférence
hal-04558267v1
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Mechanistic and kinetic studies of H-abstraction reactions from fenpyrazamine fungicide by HO• radicals in aqueous phase2023 #RSCPoster Twitter Conference, Feb 2023, London, United Kingdom
Poster de conférence
hal-04087967v1
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A theoretical study on the environmental oxidation of phosmet insecticide by HO• radical#LatinXChem23 Conference, Oct 2023, Mexico City/Virtual, Mexico
Poster de conférence
hal-04262801v1
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Ozonolysis of Phosmet Insecticide in the Gas Phase – Mechanistic and Kinetics StudyVirtual Winter School on Computational Chemistry 2023, Feb 2023, Lausanne, Switzerland
Poster de conférence
hal-04005685v1
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Mechanistic and Kinetic Studies on the Oxidation of Quinmerac Herbicide Initiated by HO Radical in Aqueous MediaVirtual Winter School on Computational Chemistry 2023, Feb 2023, Lausanne, Switzerland
Poster de conférence
hal-04005686v1
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A theoretical study of Thiram fungicide decomposition by HO radical in the aqueous phase#LatinXChem2023 Conference, Oct 2023, Mexico City/Virtual, Mexico
Poster de conférence
hal-04255873v1
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Examining the Atmospheric Breakdown of Relevant Methylated Selenium Species Upon Exposure to HO∙ Using Computational Methods2023 iCACGP-IGAC ECR online conference, Nov 2023, Boulder, United States
Poster de conférence
hal-04388255v1
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Theoretical study on the OH-initiated atmospheric reaction of acetamiprid insecticide2023 iCACGP-IGAC ECR online conference, Nov 2023, Boulder, United States
Poster de conférence
hal-04388181v1
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Theoretical study of bromous acid microhydration2023 #RSCPoster Twitter conference, Feb 2023, London, United Kingdom
Poster de conférence
hal-04087925v1
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Molecular structures and thermochemical properties for selenium-containing species of atmospheric interest2023 scientific day of labex CaPPA, Mar 2023, Villeneuve d' Ascq, France
Poster de conférence
hal-04087998v1
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Theoretical study of OH-initiated decomposition of chlorpyrifos in the gaseous and aqueous phases17th International Congress of Quantum Chemistry (ICQC), Jun 2023, Bratislava, Slovakia
Poster de conférence
hal-04140828v1
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HOꞏ-initiated Oxidation of Quinmerac Herbicide in Aqueous Media: Mechanistic and Kinetic Studies2023 #RSCPoster Twitter conference,, Feb 2023, London, United Kingdom
Poster de conférence
hal-04015767v1
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A Computational Study on the alpha-Endosulfan Decomposition by Hydroxyl Radicals in the Aqueous Phase – A Wastewater Treatment Implication2023 Twitter Latin American Conference on Environmental and Chemical Process Systems Engineering #LatinEnvChemPSE, Jul 2023, Mexico city, Mexico
Poster de conférence
hal-04184519v1
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Oxidation of phosmet herbicide initiated by HO·radical in air and water environments: mechanistic and kinetic studies2023 #RSCPoster Twitter Conference, Feb 2023, London, United Kingdom
Poster de conférence
hal-04087980v1
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Oxidation of phosmet insecticide initiated by HO• radical in air and water environments: mechanistic, kinetic, and ecotoxicity studies2023 iCACGP-IGAC ECR online conference, Nov 2023, Boulder, United States
Poster de conférence
hal-04388231v1
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Computationally exploring the atmospheric breakdown of methylated Se species when exposed to OH#LatinXChem23 Conference, Oct 2023, Mexico City/Virtual, Mexico
Poster de conférence
hal-04262759v1
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The theoretical study on the reaction of acetamiprid insecticide with hydroxyl radical: atmospheric implications#LatinXChem23 Conference, Oct 2023, Mexico City/Virtual, Mexico
Poster de conférence
hal-04262765v1
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A Mechanistic and Kinetics Study of Ozonation of Phosmet Insecticide in the Atmospheric Conditions2023 #RSCPoster Twitter Conference, Feb 2023, London, United Kingdom
Poster de conférence
hal-04015723v1
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Mechanistic and Kinetic Studies of Hydroxyl-initiated Oxidation of Quinmerac Herbicide in Aqueous Media10th Asia-Pacific Association of Theoretical and Computational Chemistry Conference (APATCC), Feb 2023, Quy Nhon, Vietnam
Poster de conférence
hal-04005704v1
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Chlorpyrifos Insecticide Oxidation by Hydroxyl Radicals in the Environment: Mechanistic, Kinetics, and Ecotoxicity Evaluation10th Asia-Pacific Association of Theoretical and Computational Chemistry Conference (APATCC), Feb 2023, Quy Nhon, Vietnam
Poster de conférence
hal-04005708v1
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Mechanistic and kinetic studies of the HO•-initiated reaction of fenpyrazamine fungicide in the aqueous phaseCanadian Chemistry Conference and Exhibition (CSC 2023), Jun 2023, Vancouver, Canada
Poster de conférence
hal-04133532v1
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Unravelling the OH-initiated atmospheric degradation of dimethyl selenide and dimethyl diselenide using computational chemistryCanadian Chemistry Conference and Exhibition (CSC 2023), Jun 2023, Vancouver, Canada
Poster de conférence
hal-04133542v1
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Hydroxyl radical initiated degradation of alpha-endosulfan insecticide in water - A mechanistic and kinetics study#LatinXChem23 Conference, Oct 2023, Mexico City/Virtual, Mexico
Poster de conférence
hal-04257269v1
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Unraveling the monohydration processes of oxygenated mercury compoundsiCACGP-IGAC ECR online conference, Nov 2023, Boulder, United States
Poster de conférence
hal-04388152v1
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Theoretical study of the adsorption of Methyl Iodide on model sea-salt surfacesEGU General Assembly, Apr 2023, Vienne (AUT), Austria. 2023, ⟨10.5194/egusphere-egu23-4481⟩
Poster de conférence
hal-04397291v1
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The Mechanistic and Kinetics of the Oxidation of Chlorpyrifos by Hydroxyl Radicals in the Environment2023 #RSCPoster Twitter conference, Feb 2023, London, United Kingdom
Poster de conférence
hal-04015745v1
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Insights in the microhydration of HOXO acids (X = Cl, Br) using computational chemistryCanadian Chemistry Conference and Exhibition (CSC 2023), Jun 2023, Vancouver, Canada
Poster de conférence
hal-04133538v1
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Assessment of thermochemical properties of selenium-containing species using computational chemistry tools: implications for atmospheric chemistry17th International Congress of Quantum Chemistry (ICQC), Jun 2023, Bratislava, Slovakia
Poster de conférence
hal-04133545v1
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Insights on the atmospheric cycling of selenium-containing species2023 #RSCPoster Twitter Conference, Feb 2023, London, United Kingdom
Poster de conférence
hal-04087937v1
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A theoretical study of the OH-initiated atmospheric degradation of pentachlorophenolRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598095v1
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Atmospheric reactivity of halogenated methylhydroperoxydes towards OH radicalsRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598004v1
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Detailed Kinetic Study of stilbene reaction formation from benzyl radicalat high temperatureTwitter Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Poster de conférence
hal-03810401v1
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Metazachlor herbicide decomposition initiated by ozone and sulfate radical anion in environmental conditions – A mechanistic and kinetic studyCanadian Chemistry Conference and Exhibition CCCE 2022, Jun 2022, Calgary, Canada
Poster de conférence
hal-03765354v1
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Theoretical study of the OH-initiated atmospheric degradation of pentachlorophenol18th Central European Symposium on Theoretical Chemistry, Sep 2022, Balatonszárszó, Hungary
Poster de conférence
hal-03812614v1
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A study of the degradation of tetrachlorophenol in the atmosphere by hydroxyl radicals3rd European Symposium on Chemical Bonding CBOND2022, Sep 2022, Amsterdam, Netherlands
Poster de conférence
hal-03812680v1
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Theoretical study of halogenated methyl hydroperoxides of atmospheric reactivityLatin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Poster de conférence
hal-03810420v1
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Decomposition of Metazachlor by Ozone in the Gas Phase: A Computational StudyLatinXChem 2022 Conference, Nov 2022, Mexico City, Mexico
Poster de conférence
hal-03884209v1
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Competition between iron ions chelating-based antioxidant properties and Fenton-type pro-oxidant risks of rosmarinic acidRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598034v1
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Atmospheric reactivity of pentachlorophenol with OH Radicals: abstraction and addition reaction pathwaysLatinXChem 2022 Conference, Nov 2022, Mexico City, Mexico
Poster de conférence
hal-03964507v1
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Impact of the bromine presence on H-transfer reactions from soot precursorsRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598099v1
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Brominated Polycyclic Aromatics Hydrocarbons Reactivity with H AtomsJournées François Lacas des Doctorants en Combustion, Mar 2022, Nancy, France
Poster de conférence
hal-03810435v1
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Theoretical interpretation of single and quaternary adsorption of Cu2+, Co2+, Ni2+ and Ag+ on sludge modified by alkaline fusion via physical modelsRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598505v1
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Effect of H2O on the adsorption of CH3I on NaCl using a force field approachRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03597985v1
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A theoretical study of the atmospheric fate of phosmet insecticideRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598111v1
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Selenium in our atmosphere: an overviewLatinXChem 2022 Conference, Nov 2022, Mexico City, Mexico
Poster de conférence
hal-03964489v1
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Reactivity of Halogenated Polycyclic Aromatic Hydrocarbons with H Atoms26th International Symposium on Gas Kinetics and Related Phenomena, Aug 2022, Rennes, France
Poster de conférence
hal-03812526v1
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Theoretical insight on antioxidant and UV absorption activities of AaptaminesTwitter Poster RSC Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598052v1
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Numerical investigation of trans-stilbene formation from benzyl radical at high temperature26th International Symposium on Gas Kinetics and Related Phenomena, Aug 2022, Rennes, France
Poster de conférence
hal-03812545v1
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Ozonation of Phosmet Insecticide in the Gas and Aqueous Phase: A Mechanistic and Kinetic StudyLatinXChem 2022 Conference, Nov 2022, Mexico city, Mexico
Poster de conférence
hal-03884198v1
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OH-initiated reaction of phosmet herbicide in the atmosphere3rd European Symposium on Chemical Bonding CBOND2022, Sep 2022, Amsterdam, Netherlands
Poster de conférence
hal-03812694v1
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Box modelling of tropospheric chlorine chemistry1st ACTRIS Science Conference, May 2022, Helsinki, Finland
Poster de conférence
hal-03671032v1
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A theoretical study of the kinetics of the H-abstraction reaction from triphenylene, benzo[e]pyrene, dibenzo[fg,op]naphtacene, and coronene by H atoms: implications in combustion chemistryRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598119v1
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A theoretical study of the OH-initiated atmospheric degradation of several polychlorophenolsPoster de conférence hal-03810383v1 |
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A theoretical study of the OH-initiated atmospheric degradation of several polychlorophenolsPoster de conférence hal-03812537v1 |
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Reactivity of 2,3,4,5-tetrachlorophenol with OH radicals in the atmosphere: A theoretical studyTwitter Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Poster de conférence
hal-03810391v1
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0D modelling of the tropospheric chlorine chemistryCanadian Chemistry Conference and Exhibition CCCE, Jun 2022, Canada, Canada
Poster de conférence
hal-03810303v1
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The Atmospheric Oxidation of CH3I by the OH Radical: the Effect of Water Vapor26th International Symposium on Gas Kinetics and Related Phenomena, Aug 2022, Rennes, France
Poster de conférence
hal-03812555v1
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Theoretical study of H-abstraction reactions by H-atoms from selected oxygenated polycyclic aromatic hydrocarbons (OPAHs)RSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03597993v1
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Modelling of the Chlorine Tropospheric Chemistry by a 0D Model26th International Symposium on Gas Kinetics and Related Phenomena, Aug 2022, Rennes, France
Poster de conférence
hal-03812560v1
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Degradation of Metazachlor Herbicide by Hydroxyl HO• Radical in Aqueous Phase - A Theoretical InsightVirtual Winter School on Computational Chemistry, Feb 2022, Lausanne, Switzerland
Poster de conférence
hal-03586600v1
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Competition between iron ions chelating-based antioxidant properties and Fenton-type pro-oxidant risks of rosmarinic acidVirtual Winter School on Computational Chemistry, Feb 2022, Lausanne, Switzerland
Poster de conférence
hal-03586599v1
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Hydrogen’s Reactivity with Halogenated Polycyclic Aromatic HydrocarbonsTwitter Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Poster de conférence
hal-03810411v1
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Gas-phase OH-initiated degradation of metazachlor herbicideRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598070v1
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Reactivity of H Atoms with Halogenated Polycyclic Aromatics Hydrocarbons2022 scientifc day of Labex CaPPA, Mar 2022, Villeneuve d'Ascq, France
Poster de conférence
hal-03604402v1
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Reactivity of OH with CH3I in the presence of H2O2022 scientific day of labex CaPPA, Mar 2022, Villeneuve d'Ascq, France
Poster de conférence
hal-03604408v1
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Atmospheric reactivity of phosmet insecticideLatinXChem 2022 Conference, Nov 2022, Mexico City, Mexico
Poster de conférence
hal-03964458v1
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Insights in the atmospheric reactivity of OH radicals with 2,3,4,5-chlorophenolRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598081v1
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OH-initiated atmospheric degradation of phosmet insecticide2022 scientific day of labex CaPPA, Mar 2022, Villeneuve d'Ascq, France
Poster de conférence
hal-03604436v1
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What is the effect of the water molecule on the reaction mechanism of OH radicals with CH3IRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598019v1
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Numerical investigation of Stilbene formation from benzyl radicals at high temperatureRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598129v1
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Box modelling of the atmospheric chlorine chemistry using a new updated chemical mechanismRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03598136v1
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Ozonolysis of Metazachlor Herbicide in the Atmosphere: Mechanistic and Kinetic StudyTwitter Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico city, Mexico
Poster de conférence
hal-03765370v1
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Oxidation of Quinmerac by HO radical in aqueous media: A possible water treatment processLatinXChem 2022 Conference, Nov 2022, Mexico City, Mexico
Poster de conférence
hal-03884226v1
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OH-radical-induced degradation of Metazachlor herbicide in aqueous phase - A kinetics and mechanistic studyRSC Poster Twitter Conference, Mar 2022, London, United Kingdom
Poster de conférence
hal-03597969v1
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The Atmospheric Oxidation of CH3I by the OH Radical: the Effect of Water VaporTwitter Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Poster de conférence
hal-03810397v1
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Reactivity of H Atoms with Halogenated Polycyclic Aromatic HydrocarbonsCanadian Chemistry Conference and Exhibition CCCE, Jun 2022, Calgary, Canada
Poster de conférence
hal-03810376v1
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Chemical kinetics of representative quinonesPoster de conférence hal-03812602v1 |
OH-initiated atmospheric degradation of 2,3,4,5-chlorophenol insectide2022 scientific day of labex CaPPA, Mar 2022, Villeneuve d'Ascq, France
Poster de conférence
hal-03604425v1
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The Monohydration of oxygenated mercury-containing compounds of Atmospheric InterestJournées « Théorie, Modélisation et Simulation », visioconférence, Dec 2021, Rennes, France
Poster de conférence
hal-03584983v1
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Unraveling the monohydration processes of oxygenated mercury-containing compoundsProcesses in Atmospheric and Astrochemical environnments (PATAS 2021), Jan 2021, virtually conference, United Kingdom
Poster de conférence
hal-03357961v1
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Unraveling the atmospheric degradation of metazachlor18th European Symposium on Organic Reactivity (ESOR2021), Sep 2021, Amsterdam, Netherlands
Poster de conférence
hal-03358430v1
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Detailed kinetic study of hydrogen abstraction reactions of PAHs by H atoms57th Symposium on Theoretical Chemistry (STC), Sep 2021, Wurzburg, Germany
Poster de conférence
hal-03358423v1
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Investigation of the reaction of OH with CH2ClOOH of atmospheric interest;Summer School Graduate Program Science for a Changing Planet, Sep 2021, Villeneuve d'Ascq, France
Poster de conférence
hal-03357974v1
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Atmospheric gas phase OH-initiated degradation of metazachlor herbicideournées « Théorie, Modélisation et Simulation », visioconférence, Dec 2021, Rennes, France
Poster de conférence
hal-03584979v1
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Insights in the reactivity of CH2ICH2OH with OH radicals: implications for atmospheric iodine chemistryEUROPEAN GEOSCIENCES UNION GENERAL ASSEMBLY, EGU, Apr 2021, ONLINE, France. 2021
Poster de conférence
hal-03214153v1
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Unraveling the atmospheric degradation of metazachlorLatinXChem2021, Sep 2021, virtually twitter conference, Mexico
Poster de conférence
hal-03358349v1
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Computational chemisty in the generation of detailed kinetic models for the combustion of hydrocarbonLatinXChem2021, Sep 2021, virtually twitter conference, Mexico
Poster de conférence
hal-03358344v1
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A theoretical study of the potential energy surface for the isomerization reaction of fluoranthene to aceanthrylene: Implications for combustion chemistryLatinXChem 2021, Sep 2021, virtually twitter conference, Mexico
Poster de conférence
hal-03358121v1
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Unraveling the monohydration processes of oxygenated mercury-containing compoundsLatinXChem2021, Sep 2021, virtually twitter conference, Mexico
Poster de conférence
hal-03357995v1
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Theoretical study of infrared spectra of iodide molecules on NaCl surfacesJTMS 2020 : Journées "Théorie, Modélisation et Simulation", Nov 2020, Visioconférence, France. , 2020
Poster de conférence
hal-03010047v1
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Theoretical study of infrared spectra of iodide molecules on NaCl surfacesRéunion plénière du GDR EMIE, Oct 2020, Saint Pierre d'Oléron, France
Poster de conférence
hal-03087396v1
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Theoretical study of infrared spectra of iodide molecules on NaCl surfacesPoster de conférence hal-03113861v1 |
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Theoretical study of the CH3I microhydration processesAtelier « Matériaux du nucléaire et transfert: approches expérimentale et théorique » du GDR SCINEE, Mar 2020, Villeneuve d'Ascq, France
Poster de conférence
hal-03358436v1
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Modelling of the behaviour of iodine oxidesAtelier « Matériaux du nucléaire et transfert : approches expérimentale et théorique » du GDR SCINEE, Mar 2020, Villeneuve d'Ascq, France
Poster de conférence
hal-03087399v1
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Atmospheric iodine chemistry from molecular level to 0D/3D simulations: applications to Fukushima nuclear accidentEGU General Assembly, Session “Halogens in the troposphere”, May 2020, Vienna, Austria
Poster de conférence
hal-03087397v1
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Theoretical study of the CH3I microhydration processesJournée Scientifique du Labex CaPPA, Mar 2020, Villeneuve d'Ascq, France
Poster de conférence
hal-03358450v1
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Theoretical investigation of the reaction Cl + HOIO11th International Conference on Chemical Kinetics, Jun 2019, Orléans, France
Poster de conférence
hal-03087644v1
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Isomerization reaction of fluoranthene to pyrene: A DFT studyThe Fourth International Conference on Computational Science and Engineering (ICCSE-4), Jul 2019, Ho-Chi Minh City, Vietnam
Poster de conférence
hal-03087641v1
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A theoretical study of pyrene formation from fluoranthene11th International Conference on Chemical Kinetics, Jun 2019, Orléans, France
Poster de conférence
hal-03087646v1
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Kinetics and mechanism of BrHgO• reaction with CO11th International Conference on Chemical Kinetics, Jun 2019, Orléans, France
Poster de conférence
hal-03087645v1
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Thermochemistry of HIO2 species and reactivity of iodous acid with chlorine atom: A computational approach16th Central European Symposium on Theoretical Chemistry, Sep 2018, Srni, Czech Republic
Poster de conférence
hal-03087982v1
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Comparison of UHF and ROHF reference for the MP2.5 method. Case study of atmospheric reactivity16th International Congress on Quantum Chemistry, Jun 2018, Menton, France
Poster de conférence
hal-03358489v1
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Ab initio investigation of thermochemical properties of very short-lived brominated substances (VSLS)25th International Symposium on Gas Kinetics and Related Phenomena, Jul 2018, Lille, France
Poster de conférence
hal-03087990v1
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Atmospheric fate of iodomethanol, unimolecular decomposition and its reaction with OH radicals25th International Symposium on Gas Kinetics and Related Phenomena, Jul 2018, Lille, France
Poster de conférence
hal-03087992v1
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Study of very short-lived species and their atmospheric degradation products: structures and thermochemical properties16th International Congress on Quantum Chemistry, Jun 2018, Menton, France
Poster de conférence
hal-03358525v1
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Reaction of CH2IOH with OH radical16th Central European Symposium on Theoretical Chemistr, Sep 2018, Srni, Czech Republic
Poster de conférence
hal-03087984v1
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Unravelling the reaction mechanisms of iodous acid with chlorine atom25th International Symposium on Gas Kinetics and Related Phenomena, Jul 2018, Lille, France
Poster de conférence
hal-03087987v1
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Oxidation of a potassium iodide surface by gaseous ozone25th International Symposium on Gas Kinetics and Related Phenomena, Jul 2018, Lille, France
Poster de conférence
hal-03358475v1
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Interaction of ozone and water with KI aerosolsInteraction of ozone and water with KI aerosols, Mar 2017, Villeneuve d'Ascq, France
Poster de conférence
hal-03358690v1
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Thermochemical properties for iodine nitrogen oxides in gaseous and aqueous phasesInternational Conference on Aerosol Cycle (ICAC), Mar 2017, Villeneuve d'Ascq, France
Poster de conférence
hal-03358684v1
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Reactivity of CH3I and CH2I2 with H: (H, I)-abstraction and I-substitution reaction pathwaysXLIII Congress of Theoretical Chemists of Latin Expression (CHITEL), Jul 2017, Paris, France
Poster de conférence
hal-03358588v1
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Reactivity of CH3I and CH2I2 with H atomsInternational Conference on Aerosol Cycle (ICAC), Mar 2017, Villeneuve d'Ascq, France
Poster de conférence
hal-03358662v1
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Interaction of ozone and water on potassium iodide aerosolComputational chemistry for pollutant mitigation, Mar 2017, Rueil-Malmaison, France
Poster de conférence
hal-03358694v1
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MP2.5 method in atmospheric reactivity?Central European Symposium on Theoretical Chemistry, Sep 2017, Wisla, Poland
Poster de conférence
hal-03358573v1
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On the applicability of MP2.5 method in atmospheric chemistryXLIII Congress of Theoretical Chemists of Latin Expression (CHITEL), Jul 2017, Paris, France
Poster de conférence
hal-03358582v1
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Atmospheric chemistry if iodous acid HIO2; field measurements, thermochemistry, and gas -phase reactivityInternational Conference on Aerosol Cycle (ICAC), Mar 2017, Villeneuve d'Ascq, France
Poster de conférence
hal-03358655v1
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Modelling iodine interactions with atmospheric aerosolsInternational Conference on Aerosol Cycle (ICAC), Mar 2017, Villeneuve d'Ascq, France
Poster de conférence
hal-03358673v1
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Theoretical investigation of hydration and reactivity of iodic acidGroupe de cinétique et de photochimie en phase gazeuse, May 2016, Reims, France
Poster de conférence
hal-03359014v1
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Modélisation de la chimie de l'iode dans l'atmosphère, Groupe de cinétique et de photochimie en phase gazeuseGroupe de cinétique et de photochimie en phase gazeuse, May 2016, Reims, France
Poster de conférence
hal-03359011v1
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Hydration and reactivity of iodic acid of atmospheric and nuclear issues24th International Symposium on Gas Kinetics, Jul 2016, York, France
Poster de conférence
hal-03358994v1
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Modelling of the iodine interaction and transport in the atmosphere3ème Journée Scientifique du Labex CaPPA, Feb 2016, Villeneuve d'Ascq, France
Poster de conférence
hal-03359023v1
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Modelling iodine interactions with atmospheric aerosolsEuropean Aerosol Conference, Sep 2016, Tours, France
Poster de conférence
hal-03358706v1
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A theoretical study of the hydration of iodine oxides (V) in the atmosphere3ème Journée Scientifique du Labex CaPPA, Feb 2016, Villeneuve d'Ascq, France
Poster de conférence
hal-03359026v1
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Thermochemistry of iodine nitroxidesInternational Meeting on Atomic and Molecular Physics and Chemistry (IMAMPC), Jun 2016, Le Havre, France
Poster de conférence
hal-03359008v1
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Ab initio and DFT benchmarks of tungsten nanoclusters and tungsten hydridesInternational workshop on Models and Data for Plasma-Material Interaction in Fusion Devices (MoD-PMI), May 2015, Marseille, France
Poster de conférence
hal-03359188v1
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Etude théorique des propriétés thermochimiques de composés gazeux de l'iode: implications en chimie atmosphérique et en sûreté nucléaireCongrès 2015 de la Société Chimique de France, Jul 2015, Lille, France
Poster de conférence
hal-03359183v1
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A theoretical study of the cadmium chemistry in the primary circuit of a nuclear pressurized water reactor2ème Journée Scientifique du Labex CaPPA, Feb 2015, Villeneuve d'Ascq, France
Poster de conférence
hal-03359191v1
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A theoretical study of the thermochemical properties of nitrogen iodine oxides, their microhydration processes, and the IO oxidation by COGroupe de cinétique et de photochimie en phase gazeuse, Jun 2015, Nancy, France
Poster de conférence
hal-03359187v1
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Reactivity of iodine oxides towards CO - Is it a relevant oxidation reaction in the atmosphere?Central European Symposium on Theoretical Chemistry, Sep 2015, Banská Bystrica, Slovakia
Poster de conférence
hal-03359182v1
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Reactivity of iodoalkanes toward OH radicals : atmospheric chemistry challenge2ème Journée Scientifique du Labex CaPPA, Feb 2015, Villeneuve d'Ascq, France
Poster de conférence
hal-03359196v1
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W2, W4, WH, WH2: Ab initio and DFT benchmarks6th Japan-Czech-Slovak International Symposium on Theoretical Chemistry, Oct 2015, Smolenice, Slovakia
Poster de conférence
hal-03359036v1
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Modelling of the behaviour of iodine oxides: Implications for atmospheric chemistry and nuclear safety6th Japan-Czech-Slovak International Symposium on Theoretical Chemistry, Oct 2015, Smolenice, Slovakia
Poster de conférence
hal-03359040v1
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Modelling of the ruthenium behaviour during its transport in the primary circuit2ème Journée Scientifique du Labex CaPPA, Feb 2015, Villeneuve d'Ascq, France
Poster de conférence
hal-03359194v1
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W2, W4, WH, WH2: Ab initio and DFT benchmarksCentral European Symposium on Theoretical Chemistry, Sep 2015, Banská Bystrica, Slovakia
Poster de conférence
hal-03359059v1
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Problématiques chimiques en lien avec la sûreté nucléaireCongrès 2015 de la Société Chimique de France, Jul 2015, Lille, France
Poster de conférence
hal-03359184v1
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A theoretical study of the kinetics of gas-phase elementary reactions containing caesium species of nuclear safety interestCentral European Symposium on Theoretical Chemistry, Sep 2014, Nagybörzsöny, Hungary
Poster de conférence
hal-03359199v1
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Modelling of ruthenium chemistry in case of severe accidents occurring to a nuclear power plantRCTF2014 14ème Rencontre des Chimistes Théoriciens Francophones, Jun 2014, Paris, France. 2014
Poster de conférence
hal-01077538v1
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Etude théorique de la chimie du cadmium dans le circuit primaire d’un réacteur nucléaire à eau pressurisée14ème Rencontre des Chimistes Théoriciens Francophones (RCTF), Jun 2014, Paris, France
Poster de conférence
hal-03359200v1
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Formation of CsxHyClusters in Negative Ion Sources for ITER7th Molecular Quantum Mechanics, Jun 2013, Lugano, Switzerland
Poster de conférence
hal-03359220v1
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A theoretical study of the kinetics of gas-phase elementary reactions containing caesium species of nuclear safety interest7th Molecular Quantum Mechanics, Jun 2013, Lugano, Switzerland
Poster de conférence
hal-03359223v1
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Structure and reactivity of CsxHy clusters9th European Conference on Computational Chemistry, Sep 2013, Sopron, Hungary
Poster de conférence
hal-03359214v1
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Reactivity of iodoalkanes towards OH radicals - Atmospheric chemistry challengeCentral European Symposium on Theoretical Chemistry, Sep 2013, Znojmo, Czech Republic
Poster de conférence
hal-03359213v1
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Thermochemistry of CsxByOz type of compounds and microsolvation of CsBO29th European Conference on Computational Chemistry, Sep 2013, Sopron, Hungary
Poster de conférence
hal-03359217v1
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Atmospheric degradation of two short-lived brominated hydrocarbons (CHBr3 and CH2Br2)22nd International Symposium on Gas Kinetics, Jun 2012, Boulder, United States
Poster de conférence
hal-03365526v1
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Thermochemistry of CsxByOz type of compoundsTheory and Applications of Computational Chemistry, Sep 2012, Pavia, Italy
Poster de conférence
hal-03359227v1
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Detailed modeling of the atmospheric degradation mechanism of brominated very-short lived species (VSLS)Quadriennal Ozone Symposium, Aug 2012, Toronto, Canada
Poster de conférence
hal-03359230v1
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Thermochimie des composés de type CsxByOz13ème Rencontre des Chimistes Théoriciens Francophones (RCTF), Jul 2012, Marseille, France
Poster de conférence
hal-03365432v1
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Réactivité de l'aérosol marin à la pollution atmosphérique par NO2. Une étude de laboratoire.Journées Interdisciplinaires de la qualité de l'air (JIQA), Feb 2008, Villeneuve d'Ascq, France
Poster de conférence
hal-03065554v1
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Chemical interactions and reactions at the interface between aerosol particles covered with fatty acid films and gaseous pollutantsEuropean Research Course on Atmospheres, Jan 2007, Grenoble, France
Poster de conférence
hal-03065871v1
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Measuring heterogeneous uptake coefficients of NO2 on solid and liquid (NH4)2SO4 surfaces7th International Aerosol Conference, Sep 2006, Saint-Paul, United States
Poster de conférence
hal-03065873v1
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Laboratory Studies of the Heterogeneous Reactivity of Nitrogen Dioxide with Ammonium Sulphate Particles19th International Symposium on Gas Kinetics, Jul 2006, Orléans, France
Poster de conférence
hal-03065875v1
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Chimie troposphérique multiphasique des 2,5- et 2,6-xylénolsGroupe de cinétique et de photochimie en phase gazeuse, Jun 2005, Rennes, France
Poster de conférence
hal-03065880v1
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Etude cinétique de la réaction F + CHF3 par la méthode du réacteur à écoulement couplée à une technique de prélèvement par faisceau moléculaire et d'analyse par spectrométrie de masseJournée Scientifique Louis Pasteur, Société Française de Chimie, Jun 1995, Villeneuve d'Ascq, France
Poster de conférence
hal-03065606v1
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The selenium in you: why we take an atmospheric interest in a disregarded element2024 scientific day of the Labex CaPPA, Mar 2024, Villeneuve d'Ascq, France
Communication dans un congrès
hal-04557944v1
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In silico studies of the atmospheric reactivity of organic contaminantsMolecular-Level Understanding of Atmospheric Aerosols (MUOAA), Apr 2024, Cargèse, France
Communication dans un congrès
hal-04557929v1
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Ozonation of Phosmet Insecticide in the Gas Phase: Mechanistic and Kinetics Studies10th Asia-Pacific Association of Theoretical and Computational Chemistry Conference (APATCC), Feb 2023, Quy Nhon, Vietnam
Communication dans un congrès
hal-04005703v1
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Atmospheric oxidation of phosmet and quinmerac initiated by OH radicals: mechanistic, kinetic, and ecotoxicity studiesXLVI International Congress of Theoretical Chemists of Latin Expression, Nov 2023, Montevideo, Uruguay
Communication dans un congrès
hal-04348236v1
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Outils de modélisation de la chimie de l'atmosphère : Etude de l'accident de Fukushima DaiichiCNRIUT 2023 Saint Pierre - La Réunion, IUT de Saint Pierre, Jun 2023, Saint Pierre (La Réunion), La Réunion
Communication dans un congrès
hal-04326696v1
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Insights in tropospheric chemistry of iodomethanes using computational chemistry toolsCanadian Chemistry Conference and Exhibition (CSC 2023), Jun 2023, Vancouver, Canada
Communication dans un congrès
hal-04123001v1
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Elucidating the gas phase adsorption of CH3I on sea-salt aerosol using computational chemistryCanadian Chemistry Conference and Exhibition (CSC 2023), Jun 2023, Vancouver, Canada
Communication dans un congrès
hal-04119779v1
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HO•-initiated aqueous phase degradation of metazachlor and quinmerac herbicides: mechanistic, kinetic, and ecotoxicity studiesCanadian Chemistry Conference and Exhibition (CSC 2023), Jun 2023, Vancouver, Canada
Communication dans un congrès
hal-04119789v1
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Theoretical study of the adsorption of CH3I on ice and model sea-salt surfaces2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03813998v1
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Reinvestigation of the Zr-Cr binary system in the framework of the ATF assessment in severe accident conditionsThe Nuclear Materials Conference (NuMat 2022), Oct 2022, Ghent, Belgium
Communication dans un congrès
hal-04161420v1
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Recent insights into atmospheric chemistry of phytosanitary products,2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03813931v1
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What is the role of microhydration on the atmospheric reactivity of iodomethane ?2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03814018v1
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Cyclo[N]carbon rings and catenanes from different perspective. Disentangling molecular thread12th Triennial Congress of the World Association of Theoretical and Computational Chemists WATOC, Jul 2022, Vancouver, Canada
Communication dans un congrès
hal-03813994v1
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Reaction mechanism of the OH-initiated atmospheric degradation of 5-chlorophenol2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03813960v1
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Atmospheric reactivity of tetraphenols2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03814027v1
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Reaction kinetics of the consumption mechanism of Oxygenated polycyclic Aromatic Hydrocarbons (OPAHs)2nd Low Carbon Combustion, Apr 2022, Cambridge, United Kingdom
Communication dans un congrès
hal-03810249v1
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Box Modelling of Gas-Phase Atmospheric Chlorine Chemistry2022 scientific day of the Labex CaPPA, Mar 2022, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03604395v1
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Atmospheric chlorine chemistry modelling2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03813945v1
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Thermochemical and kinetic studies of hydrogen abstraction reactions of halogenated polycyclic aromatic hydrocarbons by H atoms2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Communication dans un congrès
hal-03814006v1
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Studying the atmospheric reactivity of pesticides with molecular simulationsCanadian Chemistry Conference and Exhibition CCCE, Jun 2022, Calgary, Canada
Communication dans un congrès
hal-03810278v1
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Environmental aspects of atmospheric chemistry modelling1st french-slovak workshop, Sep 2021, Bratislava, Slovakia
Communication dans un congrès
hal-03357819v1
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Hydrogen abstraction reaction of H atom from PAHs: electronic structure, reaction mechanism, and kineticsCongrès International sur les Matériaux et l’ENergie (CIMEN), Nov 2021, Sousse, Tunisia
Communication dans un congrès
hal-03584973v1
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Investigation of the reaction OH+CH2ClOOH of atmospheric interestEGU General Assembly, Session “Halogens in the troposphere”, Apr 2021, Vienna, Austria
Communication dans un congrès
hal-03357791v1
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Investigation of the adsorption of CH3I on NaCl and ice surfacesRCP21-Rencontres de Chimie-Physique 2021-SCF21, Sep 2021, Sète, France
Communication dans un congrès
hal-03438358v1
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Unraveling the Atmospheric Degradation of MetazachlorCongrès International sur les Matériaux et l’ENergie (CIMEN), Nov 2021, Sousse, Tunisia
Communication dans un congrès
hal-03584966v1
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Unraveling the Reaction Mechanism of OH Radicals with Chloromethyl HydroperoxideStudent Scientific Conference of Faculty of Natural Sciences, Comenius University in Bratislava, Apr 2021, Bratislava, Slovakia
Communication dans un congrès
hal-03357814v1
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Atmospheric chemistry of oxygenated mercury-containing compoundsEGU General Assembly, Session “Halogens in the troposphere”, Apr 2021, Vienna, Austria
Communication dans un congrès
hal-03357799v1
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2020 et les premiers pas du « Cluster de recherche » OVERSEE (mOdélisation innoVante dEs aéRoSols dE radionucléidEs »Journée scientifique IRePSE, Nov 2020, Lille, France
Communication dans un congrès
hal-03003208v1
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Theoretical study of the reaction of BrHgO + CO: An analogue of OH + CO38th Northeast Regional Meeting on Kinetics and Dynamics, Jan 2020, Cambridge, United States
Communication dans un congrès
hal-03066572v1
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Theoretical study of infrared spectra of iodide molecules on NaCl surfacesRéunion annuelle du GDR ThéMS, Dec 2020, Visioconférence, France
Communication dans un congrès
hal-03113811v1
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Thermal Reduction of Hg(II) in the Gaseous AtmosphereAmerican Geophysical Union Fall Meeting, Dec 2020, San Francisco, United States
Communication dans un congrès
hal-03053171v1
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Theoretical study of infrared spectra of iodide molecules on NaCl surfacesRéunion annuelle du GDR ThéMS (Dynamique quantique dans les systèmes moléculaires. Théorie modélisation simulation), Dec 2020, Montpellier, France
Communication dans un congrès
hal-03357783v1
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Chimie de l’iode : de la centrale à l’atmosphèreAtelier « Matériaux du nucléaire et transfert : approches expérimentale et théorique » du GDR SCINEE, Mar 2020, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03066563v1
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Atmospheric chemistry of iodous and iodic acids11th International Conference on Chemical Kinetics, Jun 2019, Orléans, France
Communication dans un congrès
hal-03053381v1
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Microhydration of HOIO: structural and thermochemical properties of HOIO + n H2O (n =1-4)17th Central European Symposium on Theoretical Chemistry, Sep 2019, Burg Schlaining, Austria
Communication dans un congrès
hal-03053212v1
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Chimie Atmosphérique de l'iode : de l'échelle moléculaire aux modèles de chimie transportCongrès National de la Recherche en IUT, Jun 2018, Aix en Provence, France
Communication dans un congrès
hal-03053384v1
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Thermochemical properties on reactivity of iodine-containing speciesGroupe de cinétique et de photochimie en phase gazeuse, Jun 2017, Douai, France
Communication dans un congrès
hal-03066629v1
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Atmospheric chemistry of iodine from molecular level to chemistry-transport modellingInternational Conference on Aerosol Cycle (ICAC), Mar 2017, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03053630v1
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Modelling of iodine atmospheric chemistryComputational chemistry for pollutant mitigation, Mar 2017, Rueil-Malmaison, France
Communication dans un congrès
hal-03053648v1
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Thermochemical properties of halogenated peroxy and alkoxy radicals of atmospheric interestCentral European Symposium on Theoretical Chemistry, Sep 2017, Wisla, Poland
Communication dans un congrès
hal-03053388v1
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Modélisation du comportement du ruthénium lors de son transport dans le circuit primaireJournées des thèses IRSN, Mar 2016, Le Croisic, France
Communication dans un congrès
hal-03070879v1
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Modeling ruthenium chemistry in primary circuit in severe accident conditions occurring to nuclear power plantMaterials Science and Engineering, Sep 2016, Darmstadt, Germany
Communication dans un congrès
hal-01372450v1
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Chimie-transport de l'iode radioactif dans l'atmosphère lors d'un accident nucléaireCongrès National de la Recherche en IUT, Jun 2016, Nantes, France
Communication dans un congrès
hal-03054300v1
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IRSN R&D Actions on FP Behaviour for RCS, Containment and FCVS in Severe Accident Conditions2016 24th International Conference on Nuclear Engineering, Jun 2016, Charlotte, United States. ⟨10.1115/ICONE24-61104⟩
Communication dans un congrès
hal-02897062v1
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Atmospheric chemistry of iodine from molecular level to chemistry-transport modellingXLII Congreso de Quimicos Teóricos de Expresión Latina, Nov 2016, Montevideo, Uruguay
Communication dans un congrès
hal-03053736v1
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Chemistry of caesium - CASPT2 and coupled cluster studiesXLII Congreso de Quimicos Teóricos de Expresión Latina, Nov 2016, Montevideo, Uruguay
Communication dans un congrès
hal-03053659v1
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Thermodynamic properties of iodine nitroxides (INOy)Groupe de cinétique et de photochimie en phase gazeuse, May 2016, Reims, France
Communication dans un congrès
hal-03066634v1
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Modelling of the fission products reactivity using quantum chemistry tools3ème Journée Scientifique du Labex CaPPA, Feb 2016, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03070882v1
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Reactivity of iodine (V) oxides: implications for atmospheric chemistry and nuclear safetyCentral European Symposium on Theoretical Chemistry, Sep 2015, Banská Bystrica, Slovakia
Communication dans un congrès
hal-03054302v1
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Modélisation du comportement du ruthénium lors de son transport dans le circuit primaireJournée des thèses IRSN, Apr 2015, L'Isle sur la Sorgue, France
Communication dans un congrès
hal-03070887v1
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Modelling of the behaviour of iodine oxidesGroupe de cinétique et de photochimie en phase gazeuse, Jun 2015, Nancy, France
Communication dans un congrès
hal-03066698v1
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Thermodynamic properties of some ruthenium gaseous speciesCongrès de la Société Chimique de France 2015, Jul 2015, Lille, France
Communication dans un congrès
hal-01218747v1
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Ab initio and DFT benchmarking of tungsten nanoclusters and tungsten hydridesStudentska vedecka Konferencia, PriF UK 2015, Apr 2015, Bratislava, Slovakia
Communication dans un congrès
hal-02506957v1
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A theoretical study of the microhydration processes of nitrogen iodine oxides: Implications for atmospheric chemistry and nuclear safetyCentral European Symposium on Theoretical Chemistry, Sep 2014, Nagybörzsöny, Hungary
Communication dans un congrès
hal-03054307v1
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Étude théorique du rôle du bore sur le comportement de l’iode dans le circuit primaire d’un réacteurJournée des thèses IRSN, Oct 2013, Presqu'ile de Giens, France
Communication dans un congrès
hal-03070892v1
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Atmospheric reactivity of iodoalkanes towards OH radicalsInternational Meeting on Atomic and Molecular Physics and Chemistry (IMAMPC), Jul 2013, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03058237v1
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A theoretical study of cesium borates compoundsInternational Meeting on Atomic and Molecular Physics and Chemistry (IMAMPC), Jul 2013, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03054315v1
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Applications of theoretical chemistry tools to nuclear safety issuesInternational Meeting on Atomic and Molecular Physics and Chemistry (IMAMPC), Jul 2013, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03058063v1
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Étude théorique du rôle du bore sur le comportement de l’iode dans le circuit primaire d’un réacteurJournées des thèses IRSN, Oct 2012, Le Croisic, France
Communication dans un congrès
hal-03070895v1
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Reactivity of iodoalkanes5th International Symposium on Non-equilibrium Processes, Plasma, Combustion, and Atmospheric Phenomena (NEPCAP), Oct 2012, Sochi, Russia
Communication dans un congrès
hal-03058250v1
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Etude théorique de processus environnementaux à l’échelle moléculaireSéminaire IRePSE Calculs scientifiques en environnement : modélisation, bases de données, moyens et applications, Apr 2012, Wimereux, France
Communication dans un congrès
hal-03070901v1
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Atmospheric degradation of two short-lived brominated hydrocarbons (CHBr 3 and CH 2 Br 2 )22nd International Symposium on Gas Kinetics, Jun 2012, Boulder, United States
Communication dans un congrès
insu-01142950v1
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Ability of theoretical chemistry to predict thermochemistry and reactivity of gaseous caesium species of nuclear safety interestWorld Association of Theoretical and Computational Chemists (WATOC), Jul 2011, Santiago de Compostela, Spain
Communication dans un congrès
hal-03058360v1
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Heavy iodine in spotlight4th Japan-Czech-Slovak Symposium for Theoretical and Computational Chemistry, May 2011, Byšice, Czech Republic
Communication dans un congrès
hal-03058367v1
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Atmospheric reactivity of iodoalkanes with OH radicalsGroupe de cinétique et de photochimie en phase gazeuse, May 2011, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03070911v1
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Etude de la solvatation de composés d'intérêt en sûreté nucléaire et en chimie atmosphérique par simulations de dynamique moléculaire classiqueGroupe de cinétique et de photochimie en phase gazeuse, Jun 2010, Wimereux, France
Communication dans un congrès
hal-03071042v1
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Réactivité des produits de fission en conditions accidentelles dans un réacteur nucléaire : approche expérimentale et théoriqueJournée sur la coopération scientifique IRSN/CNRS, Mar 2010, Cadarache, France
Communication dans un congrès
hal-03071605v1
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How to predict theoretical quantitative thermokinetic parameters: Application to halogenated systems of atmospheric interest237th American Chemical Society National Meeting, Mar 2009, Salt Lake City, United States
Communication dans un congrès
hal-03058416v1
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A Thermokinetic Theoretical Study of the Isomerization Processes in Toluene and o-Xylene Oxidation4th European Combustion Meeting, Apr 2009, Vienna, Austria
Communication dans un congrès
hal-03071619v1
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Towards affordable computational kinetics for combustion processes237th American Chemical Society National Meeting, Mar 2009, Salt Lake City, United States
Communication dans un congrès
hal-03058410v1
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Application of Computational Chemistry to Combustion Processes: Generation of Reliable Thermokinetic Data for the Aromatics Oxidation Mechanisms237th American Chemical Society National Meeting, Mar 2009, Salt Lake City, United States
Communication dans un congrès
hal-03058375v1
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Numerical and Experimental Study of NCN Mechanism: Contribution to Prompt-NO Formation4th European Combustion Meeting, Apr 2009, Vienna, Austria
Communication dans un congrès
hal-03071611v1
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Réactivité hétérogène du dioxyde d’azote sur des particules minéralesJournées Interdisciplinaires de la Qualité de l’Air (JIQA), Feb 2008, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03065914v1
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Cinétique d’incorporation du dioxyde d’azote par des surfaces solides de chlorure de sodium et de sulfate d’ammoniumGroupe de cinétique et de photochimie en phase gazeuse, Jun 2008, Strasbourg, France
Communication dans un congrès
hal-03071625v1
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Heterogeneous interactions of NO2 with solid (NH4)2SO4 surfacesEuropean Aerosol Conference, Sep 2007, Salzburg, Austria
Communication dans un congrès
hal-03058432v1
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Réactivité Hétérogène du dioxyde d’azote sur des pastilles de chlorure de sodiumGroupe de cinétique et de photochimie en phase gazeuse, Jun 2007, Marseille, France
Communication dans un congrès
hal-03071716v1
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Heterogeneous interaction of NO2 on mineral particles and aqueous surfacesECO-NET Meeting, May 2007, Szeged, Hungary
Communication dans un congrès
hal-03071709v1
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Réactivité Hétérogène du dioxyde d’azote sur des surfaces aqueusesJournées Interdisciplinaires de la Qualité de l’Air (JIQA), Jan 2007, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03058543v1
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Heterogeneous atmospheric aerosol chemistry: laboratory studies, ECO-NET Meeting, May 2007, Szeged, Hungary
Communication dans un congrès
hal-03071713v1
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Interactions of gas-phase phenolic compounds with aqueous aerosols: implications for tropospheric chemistry15th IUAPPA Regional Conference, Sep 2006, Lille, France
Communication dans un congrès
hal-03058549v1
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Cinétique d’incorporation du dioxyde d’azote dans des solutions aqueusesJournées Nord-Européennes des Jeunes Chercheurs, Apr 2006, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03079156v1
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Etudes des interactions du dioxyde d'azote avec des particules de sulfate d'ammoniumGroupe de cinétique et de photochimie en phase gazeuse, May 2006, Nancy, France
Communication dans un congrès
hal-03065917v1
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Estimation de paramètres cinétiques de réactions d’intérêt combustionnel par des méthodes de chimie quantiqueAvancées dans le domaine de la cinétique chimique de combustion, May 2005, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03079161v1
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Comment estimer des paramètres cinétiques de réactions d’intérêt atmosphérique par des méthodes de chimie quantique ?Workshop Interface Spectroscopie Chimie, Apr 2005, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03058555v1
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Cinétique d’incorporation de dérivés phénoliques dans les aérosols aqueux : Implications atmosphériquesJournées Nord-Européennes des Jeunes Chercheurs, Mar 2004, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03079186v1
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Uptake Measurements of Phenolic Compounds by Water Droplets and Determination of their Henry’s Law Constants Over the Temperature Range 278-303 K: Implications for Tropospheric Multiphase Chemistry18th International Symposium on Gas Kinetics, Aug 2004, Bristol, United Kingdom
Communication dans un congrès
hal-03058566v1
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Cinétique d’incorporation de composés phénoliques dans les surfaces liquides aqueuses2ème Journée Interdisciplinaire Qualité de l’Air (JIQA), Jan 2004, Villeneuve d'Ascq, France
Communication dans un congrès
hal-03079197v1
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Temperature Dependence of the Mass Accommodation Coefficients and Henry’s Law Constants of Phenolic Derivative: Implications for Tropospheric Multiphase ChemistryEuropean Geophysical Union, Apr 2004, Nice, France
Communication dans un congrès
hal-03079178v1
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Cinétique d’incorporation du benzaldéhyde dans les surfaces liquides aqueusesGroupe de cinétique et de photochimie en phase gazeuse, Jun 2003, Orléans, France
Communication dans un congrès
hal-03079209v1
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How to Predict Kinetic Parameters Using the Combination of Electronic Structure Calculations and Transition State Theory223rd American Chemical Society National Meeting, Apr 2002, Orlando, United States
Communication dans un congrès
hal-03079581v1
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Effect of Bromine Substitution on the Lifetimes and Ozone Depletion Potentials of Organic CompoundsHalon Options Technical Working Conference (HOTWC 2002), Apr 2002, Gaithersburg, United States
Communication dans un congrès
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Application of Computational Kinetics to Combustion Problems223rd American Chemical Society National Meeting, Apr 2002, Orlando, United States
Communication dans un congrès
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Theoretical Study of the Reactivity of H Atoms with a Series of Halomethanes in the Temperature Range of Combustion Interest17th International Symposium on Gas Kinetics, Aug 2002, Essen, Germany
Communication dans un congrès
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General expression for the effective mass in the 1-D treatment of tunneling corrections222nd American Chemical Society National Meeting, Aug 2001, Chicago, United States
Communication dans un congrès
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Ab Initio Studies of the Kinetics of the Reactions of OH Radicals with a Series of Haloalkanes5th International Conference on Chemical Kinetics, Jul 2001, Gaithersburg, United States
Communication dans un congrès
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Etude théorique de la réactivité d’une série d’halogénométhanes avec des atomes d’hydrogèneGroupe de cinétique et de photochimie en phase gazeuse, Jun 2001, Villeneuve d'Ascq, France
Communication dans un congrès
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A Frugal Quantum Chemist Approach to Computational Kinetics220th American Chemical Society National Meeting, Aug 2000, Washington DC, United States
Communication dans un congrès
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An Ab initio-Based Screening Tool for the Atmospheric Lifetimes of Halon ReplacementsHalon Options Technical Working Conference (HOTWC 2000), May 2000, Albuquerque, United States
Communication dans un congrès
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Ab Initio Quantum Chemical Treatment of the Kinetics of H-atom Abstraction Reactions: Implementation and Application of a Theoretical Screening Tool for Atmospheric Chemistry219th American Chemical Society National Meeting, Mar 2000, San Francisco, United States
Communication dans un congrès
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Development of a computational chemistry screening tool for the prediction of environmental properties of halogenated organics4th Annual Green Chemistry and Engineering Conference, Jun 2000, Washington DC, United States
Communication dans un congrès
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Heterogeneous processes of BrO radical on solid surfaces of seasaltsSymposium 2000 Eurotrac-2 "Transport and chemical transformation in the troposphere", Mar 2000, Garmisch-Partenkirchen, Germany
Communication dans un congrès
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Heterogeneous loss of BrO radicals on solid surfaces3rd Workshop of the Eurotrac-2 Subproject "Chemical Mechanism Development", Sep 1999, Aachen, Germany
Communication dans un congrès
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Etude théorique ab initio de la cinétique des réactions du méthane avec les radicaux XO (X = F et Cl) dans la gamme de température 250 – 2500 KGroupe de cinétique et de photochimie en phase gazeuse, Jun 1999, Paris, France
Communication dans un congrès
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Laboratory Studies for Elucidating the Environmental Effects of Naturally Occurring and Anthropogenic Trace GasesAmerican Geophysical Union Spring Meeting, Jun 1999, Boston, United States
Communication dans un congrès
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Ab Initio Study of the Mechanisms Governing the Gas-Phase Reaction between the OH radical and the Hydrofluoroether CHF2OCHF23rd Congress of the International Society for Theoretical Chemical Physics, Nov 1999, Mexico, Mexico
Communication dans un congrès
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Etudes expérimentale et théorique ab initio de la réaction des atomes de fluor avec les halogénométhanes de type CHCl3-xFx (x = 0, 1, 2 ou 3)Groupe de cinétique et de photochimie en phase gazeuse, Jun 1997, Paris, France
Communication dans un congrès
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Experimental and ab Initio Theoretical Studies of the Reactions between Fluorine Atoms and a Series of Halogenated Methanes4th International Conference on Chemical Kinetics, Jul 1997, Gaithersburg, United States
Communication dans un congrès
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Etude cinétique de la réaction des atomes de fluor avec le trifluorométhane CHF3. Approches expérimentale et théoriqueGroupe de cinétique et de photochimie en phase gazeuse, Jun 1995, Paris, France
Communication dans un congrès
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Etude des processus de dégradation thermique de quelques composés organiques volatils d’intérêt industriel10th World Clean Air Congress and Exhibition, May 1995, Helsinki, Finlande
Communication dans un congrès
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Kinetics of the Reactions of Atomic Chlorine with Halomethanes of Type CHCl3-xFx13th International Symposium on Gas Kinetics, Sep 1994, Dublin, Ireland
Communication dans un congrès
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Etude cinétique des processus de dégradation thermique de quelques solvants organiques entre 600 et 900 °C en vue de leur incinérationJournées Internationales sur les Flammes, Mar 1994, Biarritz, France
Communication dans un congrès
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L’incinération par chauffage électrique : une nouvelle technique de traitement thermique des effluents gazeux9th World Clean Air Congress and Exhibition, Aug 1992, Montréal, Canada
Communication dans un congrès
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Rate Constant Calculation of Benzylperoxy Radical IsomerizationEditors K. Han and T. Chu. Reaction Rate Constant Computations: Theories and Applications, pp.34-54, 2013
Chapitre d'ouvrage
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