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authFullName_s : Denis Duflot

Theoretical study of the vibrational energy redistribution in CO and CO: N2 aggregates

Samuel del Fré , Alejandro Rivero Santamaría , Céline Toubin , Denis Duflot , Maurice Monnerville et al.
Biennial conference of the National Program "Physics and Chemistry of the Interstellar Medium" (PCMI), Oct 2022, Paris, France
Conference papers hal-03767811v1

Molecular dynamics investigation of the influence of surfactants on halogens propensity at the air-water interface

Rawan Abouhaidar , Céline Toubin , Denis Duflot
Journées plénières 2022 du GDR EMIE, Jun 2022, Dunkerque, France
Conference papers hal-03695128v1

The Atmospheric Oxidation of CH3I by the OH Radical: the Effect of Water Vapor

Sonia Taamalli , Maxime Infuso , Fatima Amhani , Abderrahman El Bakali , Florent Louis et al.
Twitter Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Conference poster hal-03810397v1

Étude théorique de la redistribution de l’énergie vibrationnelle dans des agrégats de CO

Samuel del Fré , Alejandro Rivero Santamaría , Céline Toubin , Denis Duflot , Maurice Monnerville et al.
Rencontres des Chimistes Théoriciens Francophones (RCTF 2022), Jun 2022, Bordeaux, France. , 2022
Conference poster hal-03706668v1

Etude théorique de la réactivité du chlore radicalaire avec les particules d’acides gras

Césaire Rostand Fotsing Kwetche , Stéphane Briquez , Céline Toubin , Denis Duflot
JTMS17 "Journées Théorie, Modélisation et Simulation 2017", Jun 2017, Paris, France. , 2017
Conference poster hal-01536236v1

Microwave Spectrum of 1-Cyano-3-fluoro-but-1-ene.

Samir Kassi , D. Grée , R. Grée , Denis Duflot , Denis Petitprez et al.
Journal of Molecular Spectroscopy, 2000, 202 (1), pp.19-23. ⟨10.1006/jmsp.2000.8123⟩
Journal articles istex hal-00880706v1

Photoionization of the Buckminsterfullerene Cation

Suzie Douix , Denis Duflot , Denis Cubaynes , Jean-Marc Bizau , Alexandre Giuliani et al.
12ème Soleil Users Meeting SUM, Jan 2017, Palaiseau, France
Conference papers hal-01654662v1

A complete theoretical study of the formation of H2CO and H3COH at the surface of interstellar grains

Denis Duflot , Phillip S. Peters , Céline Toubin , Cecilia Ceccarelli , C. Kahane et al.
Faraday Discussion 168 Astrochemistry of Dust, Ice and Gas, Apr 2014, Leiden, Netherlands. , 2014
Conference poster hal-01654696v1

Theoretical study of the Si + OH → SiO + H reaction

Fabrice Dayou , Alejandro Rivero Santamaría , Denis Duflot , Maurice Monnerville , Jesus Rubayo-Soneira et al.
12th workshop on Quantum Reactive Scattering (QRS12), Oct 2014, Oaxaca, Mexico
Conference papers hal-01654220v1

Fourier–transform microwave and millimeter–wave spectroscopy of CH2IBr in the ground vibrational state

Keisuke Taniguchi , S. Sakai , Hiroyuki Ozeki , Tomohito Obakayashi , W. C. Bailey et al.
Leopoldina-Symposium "Spectroscopy and Molecular Dynamics at the Limit", Sep 2013, Zurich, Switzerland. , 2013
Conference poster hal-01654676v1

Experimental scaling of plane-Born cross sections and ab initio assignments for electron-impact excitation and dissociation of XF 4 (X = C, Si, and Ge) molecules

Denis Duflot , M. Hoshino , P. Limão-Vieira , S. Ohtomi , H. Tanaka et al.
Journal of Chemical Physics, 2017, 146 (14), ⟨10.1063/1.4979299⟩
Journal articles hal-01634259v1

Experimental and theoretical investigation of organic aerosols

Antoine Roose , Céline Toubin , Sébastien Dusanter , Denis Duflot , Véronique Riffault et al.
5ème journée scientifique du Labex CaPPA, Mar 2019, Villeneuve d'Ascq, France
Conference papers hal-02964855v1

The K-shell spectra of tetrahydrofuran studied by electron energy loss spectroscopy and ab initio calculations

Denis Duflot , Jean-Pierre Flament , Jacques Heinesch , Marie-Jeanne Hubin-Franskin
Chemical Physics Letters, 2010, 495, pp.27-32. ⟨10.1016/J.CPLETT.2010.06.058⟩
Journal articles istex hal-00880768v1

Electronic excitation of C4F6 isomers by electron impact

K. Anzai , H. Kato , M. Hoshino , D. Mogi , T. Tanioka et al.
XXVII International Conference on Photonic, Electronic and Atomic Collisions (ICPEAC 2011), Jul 2011, Belfast, United Kingdom. pp.2050
Conference papers hal-00881220v1

Theoretical Investigation of the Formation of H2CO in the Interstellar Medium: An Example of a Water Assisted Reaction

Phillip S. Peters , Denis Duflot , L. Wiesenfeld , Céline Toubin
International Conference on the Physics and Chemistry of Ice, Sep 2010, Sapporo, Japan. pp.299-306
Conference papers hal-00880780v1

The H + CO ⇌ HCO reaction studied by ab initio benchmark calculations.

Phillip S Peters , Denis Duflot , Laurent Wiesenfeld , Céline Toubin
Journal of Chemical Physics, 2013, 139 (16), pp.164310. ⟨10.1063/1.4826171⟩
Journal articles hal-00880708v1

Ground state analytical ab initio intermolecular potential for the Cl2-water system

Laureline Hormain , Maurice Monnerville , Céline Toubin , Denis Duflot , Brigitte Pouilly et al.
Journal of Chemical Physics, 2015, 142, pp.144310. ⟨10.1063/1.4917028⟩
Journal articles hal-01225785v1

A global ab initio potential energy surface for the X 2Aʹ ground state of the Si + OH → SiO + H reaction

Fabrice Dayou , Denis Duflot , Alejandro Rivero-Santamaría , Maurice Monnerville
Journal of Chemical Physics, 2013, 139 (20), pp.204305. ⟨10.1063/1.4832324⟩
Journal articles hal-01231236v1
Image document

Valence shell direct double photodetachment in polyanions

Claire Brunet , Rodolphe Antoine , Philippe Dugourd , Denis Duflot , Francis Canon et al.
New Journal of Physics, 2013, 15 (6), pp.3024. ⟨10.1088/1367-2630/15/6/063024⟩
Journal articles hal-00880436v1

Molecular modeling of the interaction of halogenated molecules with the ice surface

Maurice Monnerville , Laureline Hormain , Denis Duflot , Stéphane Briquez , Brigitte Pouilly et al.
12th workshop on Quantum Reactive Scattering (QRS12), Oct 2014, Oaxaca, Mexico
Conference papers hal-01654223v1

Electronic excitation to low-lying states of GeF4 molecule by electron impact: A comparative study with CF4 and SiF4 molecules

S. Ohtomi , M Matsui , Y. Mochizuki , A Suga , M Hoshino et al.
XXIX International Conference on Photonic, Electronic and Atomic Collisions (ICPEAC2015), Jul 2015, Toledo, Spain. , 2015
Conference poster hal-01654791v1

Theoretical investigation of the reactivity of Cl radicals with fatty acids

Césaire Fotsing-Kwetche , Stéphane Briquez , Céline Toubin , Denis Duflot
Quatrième réunion annuelle du GDR ThéMS, Laboratoire PhLAM, UMR 8523 CNRS, Université de Lille, Dec 2016, Lille, France
Conference papers hal-01655711v1

Theoretical study of the adsorption of CH3I on ice and model sea-salt surfaces

Maxime Infuso , Florent Louis , Denis Duflot , Céline Toubin
2nd French-Slovak workshop on hot topics in physical chemistry and chemical physics – experiments and modelling, Sep 2022, Bratislava, Slovakia
Conference papers hal-03813998v1

Theoretical study of halogenated methyl hydroperoxides of atmospheric reactivity

Hana Mosbahi , Laura Esteves Fernandes , Zainab Srour , Maxime Infuso , Sonia Taamalli et al.
Latin American Conference EnvChemPSE 2022, Jul 2022, Mexico, Mexico
Conference poster hal-03810420v1

A Molecular Scale Investigation of Organic/Inorganic Ion Selectivity at the Air–Liquid Interface

Ozge Ozgurel , Denis Duflot , Michel Masella , Florent Réal , Celine Toubin et al.
ACS Earth and Space Chemistry, 2022, 6 (7), pp.1698-1716. ⟨10.1021/acsearthspacechem.1c00394⟩
Journal articles hal-03726342v1

Water-Induced Organization of Palmitic Acid at the Surface of a Model Sea Salt Particle: A Molecular Dynamics Study

Josip Lovrić , Denis Duflot , Maurice Monnerville , Céline Toubin , Stéphane Briquez et al.
Journal of Physical Chemistry A, 2016, 120, pp.10141-10149. ⟨10.1021/acs.jpca.6b07792⟩
Journal articles hal-01459136v1

Experimental and theoretical investigation of HO2 sticking on dicarboxylic acid aerosols

Antoine Roose , Céline Toubin , Sébastien Dusanter , Véronique Riffault , Denis Duflot et al.
GDR SUIE, Atelier Thématique "Séparation Phases Gazeuse / Particulaire de l'Aérosol, Dec 2018, Lille, France
Conference papers hal-02083980v1

Classical Molecular Dynamics Study of Small-Chain Carboxylic Acid Aerosol Particles

Antoine Roose , Céline Toubin , Sébastien Dusanter , Véronique Riffault , Denis Duflot et al.
ACS Earth and Space Chemistry, 2019, 3 (3), pp.380-389. ⟨10.1021/acsearthspacechem.8b00172⟩
Journal articles hal-02083941v1

Electronic state spectroscopy of 1,4-pentadiene as studied by VUV photoabsorption spectroscopy and ab initio calculations.

S. Sério , Y. Nunes , S.V. Hoffman , N.J. Mason , Denis Duflot et al.
Journal of Physical Chemistry A, 2012, 116 (31), pp.8176-84. ⟨10.1021/jp305905j⟩
Journal articles hal-00880634v1

Theoretical study of the HO2 sticking on glutaric acid aerosol surfaces

Antoine Roose , Denis Duflot , Céline Toubin , Sébastien Dusanter , Véronique Riffault et al.
Réunion annuelle du Groupe de Cinétique et Photochimie en Phase Gazeuse, Jun 2017, Douai, France
Conference poster hal-03146992v1