Aurélien Moncomble

Scopus Author ID ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2015-2024
Publications (10 Years): 8

Top Venues

RSC advances

Small (Weinheim an der Bergstrasse, Germany)

Journal of computational chemistry

Journal of molecular modeling

Université de Lille

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Université de Lille Sep 01 2011

France

Maître de conférences (Assistant Professor) :: Chimie

Publications

Pedro H M Andrade, Jérémy Dhainaut, Christophe Volkringer, Thierry Loiseau, Aurélien Moncomble, Matthieu Hureau, Alain Moissette
Stability of Iodine Species Trapped in Titanium-Based MOFs: MIL-125 and MIL-125_NH 2 . Small (Weinheim an der Bergstrasse, Germany) (2024)
Aurélien Moncomble, Jean-Paul Cornard
Orthogonal effect of exchange and correlation parameters in density functional theory to compute geometric and spectroscopic quantities. Journal of computational chemistry 45 (24) (2024)
Pedro H M Andrade, Jérémy Dhainaut, Christophe Volkringer, Thierry Loiseau, Aurélien Moncomble, Matthieu Hureau, Alain Moissette
Stability of Iodine Species Trapped in Titanium-Based MOFs: MIL-125 and MIL-125_NH 2 . Small (Weinheim an der Bergstrasse, Germany) 20 (35) (2024)
Aurélien Moncomble, Jean-Paul Cornard
Orthogonal effect of exchange and correlation parameters in density functional theory to compute geometric and spectroscopic quantities. Journal of computational chemistry (2024)
Lucas Mangold, Hubert Halleux, Sébastien Leclerc, Aurélien Moncomble, Gérard Cote, Alexandre Chagnes
New insights for titanium(iv) speciation in acidic media based on UV-visible and 31 P NMR spectroscopies and molecular modeling. RSC advances 11 (43) (2021)
Luc Labarrière, Aurélien Moncomble, Jean-Paul Cornard
pH dependency of the structural and photophysical properties of the atypical 2',3-dihydroxyflavone. RSC advances 10 (58) (2020)
Aurélien Moncomble, Cécilia Falantin, Jean-Paul Cornard
Electronic Spectroscopies Combined with Quantum Chemistry Calculations: Study of the Interactions of 3-Hydroxyflavone with Copper Ions. The journal of physical chemistry. B 122 (38) (2018)
Aurélien Moncomble, Jean-Paul Cornard, Michel Meyer
A quantum chemistry evaluation of the stereochemical activity of the lone pair in PbII complexes with sequestering ligands. Journal of molecular modeling 23 (1) (2017)
Fatima Rebih, Manuel Andreini, Aurélien Moncomble, Anne Harrison-Marchand, Jacques Maddaluno, Muriel Durandetti
Direct Carboxylation of Aryl Tosylates by CO2 Catalyzed by In situ-Generated Ni(0). Chemistry (Weinheim an der Bergstrasse, Germany) 22 (11) (2015)

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Publication Activity (10 Years)

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Aurélien Moncomble