Articles with public access mandates - Celine TOUBINLearn more
Not available anywhere: 3
A Molecular Scale Investigation of Organic/Inorganic Ion Selectivity at the Air–Liquid Interface
O Ozgurel, D Duflot, M Masella, F Réal, C Toubin
ACS Earth and Space Chemistry 6 (7), 1698-1716, 2022
Mandates: Agence Nationale de la Recherche
Unraveling Aqueous Alcohol Freezing: new theoretical tools from graph theory to extract molecular processes in MD simulations
R AbouHaidar, S Bougueroua, D Duflot, MP Gaigeot, BE Wyslouzil, ...
Faraday Discussions, 2024
Mandates: Agence Nationale de la Recherche
Combined theoretical and experimental investigations of peroxy radical uptake on organic aerosols.
A Roose, S Dusanter, C Toubin, D Duflot, V Riffault
Geophysical Research Abstracts 21, 2019
Mandates: Agence Nationale de la Recherche
Available somewhere: 13
Organics in environmental ices: sources, chemistry, and impacts
VF McNeill, AM Grannas, JPD Abbatt, M Ammann, P Ariya, ...
Atmospheric Chemistry and Physics 12 (20), 9653-9678, 2012
Mandates: Swiss National Science Foundation
Thermal desorption of interstellar ices: A review on the controlling parameters and their implications from snowlines to chemical complexity
M Minissale, Y Aikawa, E Bergin, M Bertin, WA Brown, S Cazaux, ...
ACS Earth and Space Chemistry 6 (3), 597-630, 2022
Mandates: European Commission, Agence Nationale de la Recherche, Government of Italy
Theoretical determination of binding energies of small molecules on interstellar ice surfaces
D Duflot, C Toubin, M Monnerville
Frontiers in Astronomy and Space Sciences 8, 645243, 2021
Mandates: Agence Nationale de la Recherche
Perturbation of the surface of amorphous solid water by the adsorption of polycyclic aromatic hydrocarbons
E Michoulier, C Toubin, A Simon, J Mascetti, C Aupetit, JA Noble
The Journal of Physical Chemistry C 124 (5), 2994-3001, 2019
Mandates: Agence Nationale de la Recherche
Classical molecular dynamics study of small-chain carboxylic acid aerosol particles
A Roose, C Toubin, S Dusanter, V Riffault, D Duflot
ACS Earth and Space Chemistry 3 (3), 380-389, 2019
Mandates: Agence Nationale de la Recherche
Understanding water interactions with organic surfaces: environmental molecular beam and molecular dynamics studies of the water–butanol system
SM Johansson, J Lovrić, X Kong, ES Thomson, P Papagiannakopoulos, ...
Physical Chemistry Chemical Physics 21 (3), 1141-1151, 2019
Mandates: Swedish Research Council for Environment, Agricultural Sciences and Spatial …
Rapid Water Transport through Organic Layers on Ice
X Kong, C Toubin, A Habartova, E Pluharova, M Roeselova, ...
The Journal of Physical Chemistry A 122 (21), 4861-4868, 2018
Mandates: Swedish Research Council
Simulating core electron binding energies of halogenated species adsorbed on ice surfaces and in solution via relativistic quantum embedding calculations
RA Opoku, C Toubin, ASP Gomes
Physical Chemistry Chemical Physics 24 (23), 14390-14407, 2022
Mandates: German Research Foundation, Agence Nationale de la Recherche
Theoretical characterization of the kinetics of the multiphase ozonolysis of an aqueous maleic acid droplet
R AbouHaidar, D Duflot, C Toubin
Aerosol Science and Technology 58 (4), 337-355, 2024
Mandates: Agence Nationale de la Recherche
QM/MM Study of the H2 Formation on the Surface of a Water Ice Grain Doped With Formaldehyde: Molecular Dynamics and Reaction Kinetics
B Kerkeni, M Boukallaba, M Hechmi, D Duflot, C Toubin
Frontiers in Astronomy and Space Sciences 9, 807649, 2022
Mandates: Agence Nationale de la Recherche
Predictive simulations of core electron binding energies of halogenated species adsorbed on ice surfaces from relativistic quantum embedding calculations
RA Opoku, C Toubin, ASP Gomes
arXiv preprint arXiv:2111.13909, 2021
Mandates: German Research Foundation, Agence Nationale de la Recherche
Ab Initio Molecular Dynamics Calculations on NO Oxidation over Oxygen-Functionalized Highly Oriented Pyrolytic Graphite
GA Alou Angulo, A Rivero Santamaría, C Toubin, M Monnerville
The Journal of Physical Chemistry C 128 (42), 17894-17904, 2024
Mandates: Agence Nationale de la Recherche
AstroChemical Newsletter# 53
E Michoulier, C Toubin, A Simon, J Mascetti, C Aupetit, JA Noble
J Phys Chem 100 (124), 2994, 2020
Mandates: UK Science and Technology Facilities Council
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