Benoît Champagne (B Champagne)

Scopus Author ID Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 45

Top Venues

The journal of physical chemistry. B

The journal of physical chemistry. A

Physical chemistry chemical physics : PCCP

ChemistryOpen

University of Namur

Université de Namur (PHD)

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

Affiliation History

University of Namur Oct 1o 2012

Belgium

Full Professor :: Chemistry

Education History

Université de Namur Dec 22o 1992

Belgium

PHD :: Chemistry

Publications

Andrea Bonvicini, Kayn A Forbes, David L Andrews, Benoît Champagne
Hyper-Rayleigh scattering optical activity: Theory, symmetry considerations, and quantum chemistry applications. The Journal of chemical physics 158 (20) (2023)
Tárcius N Ramos, Benoît Champagne
Investigation of the Second Harmonic Generation at the Water-Vacuum Interface by Using Multi-Scale Modeling Methods. ChemistryOpen 12 (1) (2023)
Charlotte Bouquiaux, Frédéric Castet, Benoît Champagne
Influence of the Nature of the Lipid Building Blocks on the Second-Order Nonlinear Optical Responses of an Embedded Di-8-ANEPPS Probe. The journal of physical chemistry. B 127 (2) (2023)
Tárcius N Ramos, Benoît Champagne
Investigation of the Second Harmonic Generation at the Water-Vacuum Interface by Using Multi-Scale Modeling Methods. ChemistryOpen 12 (1) (2023)
Charlotte Bouquiaux, Frédéric Castet, Benoît Champagne
Influence of the Nature of the Lipid Building Blocks on the Second-Order Nonlinear Optical Responses of an Embedded Di-8-ANEPPS Probe. The journal of physical chemistry. B 127 (2) (2023)
Andrea Bonvicini, Benoît Champagne
Three-Dimensional Rotational Averaging Using Irreducible Sets of Linearly Independent Fundamental Isotropic Cartesian Tensors: A Computational Approach. Journal of chemical theory and computation (2023)
Carmelo Naim, Raphaël Vangheluwe, Isabelle Ledoux-Rak, Benoît Champagne, Claire Tonnelé, Mireille Blanchard-Desce, Eduard Matito, Frédéric Castet
Electric-field induced second harmonic generation responses of push-pull polyenic dyes: experimental and theoretical characterizations. Physical chemistry chemical physics : PCCP (2023)
Tárcius N Ramos, Benoît Champagne
Investigation of the Second Harmonic Generation at the Water-Vacuum Interface by Using Multi-Scale Modeling Methods. ChemistryOpen 12 (1) (2023)
François Mairesse, Lorenzo Maschio, Benoît Champagne
First-principles evaluation of the second harmonic generation response of reference organic and inorganic crystals. The Journal of chemical physics 158 (6) (2023)
Charlotte Bouquiaux, Frédéric Castet, Benoît Champagne
Influence of the Nature of the Lipid Building Blocks on the Second-Order Nonlinear Optical Responses of an Embedded Di-8-ANEPPS Probe. The journal of physical chemistry. B 127 (2) (2023)
Charlotte Bouquiaux, Frédéric Castet, Benoît Champagne
Influence of the Nature of the Lipid Building Blocks on the Second-Order Nonlinear Optical Responses of an Embedded Di-8-ANEPPS Probe. The journal of physical chemistry. B (2023)
S Paredis, Tom Cardeynaels, S Brebels, Jasper Deckers, S Kuila, A Lathouwers, Melissa Van Landeghem, Koen Vandewal, Andrew Danos, Andrew P Monkman, Benoît Champagne, Wouter Maes
Intramolecular locking and coumarin insertion: a stepwise approach for TADF design. Physical chemistry chemical physics : PCCP (2023)
Damien Mahaut, Guillaume Berionni, Benoît Champagne
9-Phosphatriptycene Derivatives: From Their Weak Basicity to Their Application in Frustrated Lewis Pair Chemistry. The journal of physical chemistry. A 126 (18) (2022)
Pierre Beaujean, Benoît Champagne
Unraveling the Symmetry Effects on the Second-Order Nonlinear Optical Responses of Molecular Switches: The Case of Ruthenium Complexes. Inorganic chemistry 61 (4) (2022)
Pierre Beaujean, Lionel Sanguinet, Vincent Rodriguez, Frédéric Castet, Benoît Champagne
Multi-State Second-Order Nonlinear Optical Switches Incorporating One to Three Benzazolo-Oxazolidine Units: A Quantum Chemistry Investigation. Molecules (Basel, Switzerland) 27 (9) (2022)
Tárcius N Ramos, Benoît Champagne
Investigation of the Second Harmonic Generation at the Water-Vacuum Interface by Using Multi-Scale Modeling Methods. ChemistryOpen (2022)
Freddy Zutterman, Vincent Liégeois, Benoît Champagne
TDDFT Investigation of the Raman and Resonant Raman Spectra of Fluorescent Protein Chromophore Models. The journal of physical chemistry. B 126 (18) (2022)
Frédéric Castet, Claire Tonnelé, Luca Muccioli, Benoît Champagne
Predicting the Second-Order Nonlinear Optical Responses of Organic Materials: The Role of Dynamics. Accounts of chemical research (2022)
Pierre Beaujean, Benoît Champagne, Stefan Grimme, Marc de Wergifosse
All-Atom Quantum Mechanical Calculation of the Second-Harmonic Generation of Fluorescent Proteins. The journal of physical chemistry letters 12 (39) (2021)
Jean Quertinmont, Pierre Beaujean, Julien Stiennon, Youssef Aidibi, Philippe Leriche, Vincent Rodriguez, Lionel Sanguinet, Benoît Champagne
Combining Benzazolo-Oxazolidine Twins toward Multi-state Nonlinear Optical Switches. The journal of physical chemistry. B 125 (15) (2021)
Jasper Deckers, Tom Cardeynaels, Laurence Lutsen, Benoît Champagne, Wouter Maes
Heavy-Atom-Free Bay-Substituted Perylene Diimide Donor-Acceptor Photosensitizers. Chemphyschem : a European journal of chemical physics and physical chemistry 22 (14) (2021)
Abel Idrice Adjieufack, Vincent Liégeois, Ibrahim Mbouombouo Ndassa, Benoît Champagne
Topological investigation of the reaction mechanism of glycerol carbonate decomposition by bond evolution theory. RSC advances 11 (17) (2021)
Tárcius N Ramos, Frédéric Castet, Benoît Champagne
Second Harmonic Generation Responses of Ion Pairs Forming Dimeric Aggregates. The journal of physical chemistry. B 125 (13) (2021)
Laura Le Bras, Yves L Dory, Benoît Champagne
Computational prediction of the supramolecular self-assembling properties of organic molecules: the role of conformational flexibility of amide moieties. Physical chemistry chemical physics : PCCP 23 (36) (2021)
Charlotte Bouquiaux, Frédéric Castet, Benoît Champagne
Unravelling the Effects of Cholesterol on the Second-Order Nonlinear Optical Responses of Di-8-ANEPPS Dye Embedded in Phosphatidylcholine Lipid Bilayers. The journal of physical chemistry. B 125 (36) (2021)
Laurie Lescos, Pierre Beaujean, Claire Tonnelé, Philippe Aurel, Mireille Blanchard-Desce, Vincent Rodriguez, Marc de Wergifosse, Benoît Champagne, Luca Muccioli, Frédéric Castet
Self-assembling, structure and nonlinear optical properties of fluorescent organic nanoparticles in water. Physical chemistry chemical physics : PCCP 23 (41) (2021)
Tárcius N Ramos, Sylvio Canuto, Benoît Champagne
Unraveling the Electric Field-Induced Second Harmonic Generation Responses of Stilbazolium Ion Pairs Complexes in Solution Using a Multiscale Simulation Method. Journal of chemical information and modeling 60 (10) (2020)
Jasper Deckers, Tom Cardeynaels, Huguette Penxten, Anitha Ethirajan, Marcel Ameloot, Mikalai Kruk, Benoît Champagne, Wouter Maes
Near-Infrared BODIPY-Acridine Dyads Acting as Heavy-Atom-Free Dual-Functioning Photosensitizers. Chemistry (Weinheim an der Bergstrasse, Germany) 26 (66) (2020)
Jean Quertinmont, Tom Leyssens, Johan Wouters, Benoît Champagne
Unraveling the Effects of Co-Crystallization on the UV/Vis Absorption Spectra of an N-Salicylideneaniline Derivative. A Computational RI-CC2 Investigation. Molecules (Basel, Switzerland) 25 (19) (2020)
Jakob Seibert, Benoît Champagne, Stefan Grimme, Marc de Wergifosse
Dynamic Structural Effects on the Second-Harmonic Generation of Tryptophane-Rich Peptides and Gramicidin A. The journal of physical chemistry. B 124 (13) (2020)
Charlotte Bouquiaux, Claire Tonnelé, Frédéric Castet, Benoît Champagne
Second-Order Nonlinear Optical Properties of an Amphiphilic Dye Embedded in a Lipid Bilayer. A Combined Molecular Dynamics-Quantum Chemistry Study. The journal of physical chemistry. B 124 (11) (2020)
Emna Cherni, Abel Idrice Adjieufack, Benoît Champagne, Manef Abderrabba, Sameh Ayadi, Vincent Liégeois
Density Functional Theory Investigation of the Binding of ThioTEPA to Purine Bases: Thermodynamics and Bond Evolution Theory Analysis. The journal of physical chemistry. A 124 (20) (2020)
Marc de Wergifosse, Jakob Seibert, Benoît Champagne, Stefan Grimme
Are Fully Conjugated Expanded Indenofluorenes Analogues and Diindeno[n]thiophene Derivatives Diradicals? A Simplified (Spin-Flip) Time-Dependent Density Functional Theory [(SF-)sTD-DFT] Study. The journal of physical chemistry. A 123 (45) (2019)
Conrard Giresse Tetsassi Feugmo, Vincent Liégeois, Yves Caudano, Francesca Cecchet, Benoît Champagne
Probing alkylsilane molecular structure on amorphous silica surfaces by sum frequency generation vibrational spectroscopy: First-principles calculations. The Journal of chemical physics 150 (7) (2019)
Emna Rtibi, Manef Abderrabba, Sameh Ayadi, Benoît Champagne
Theoretical Assessment of the Second-Order Nonlinear Optical Responses of Lindqvist-Type Organoimido Polyoxometalates. Inorganic chemistry 58 (16) (2019)
Jean Quertinmont, Tom Leyssens, Johan Wouters, Benoît Champagne
Periodic DFT Study of the Effects of Co-Crystallization on a N-Salicylideneaniline Molecular Switch. Chemphyschem : a European journal of chemical physics and physical chemistry 20 (19) (2019)
Abel Idrice Adjieufack, Vincent Liégeois, Ibrahim Ndassa Mboumbouo, Joseph Ketcha Mbadcam, Benoît Champagne
Intramolecular [3 + 2] Cycloaddition Reactions of Unsaturated Nitrile Oxides. A Study from the Perspective of Bond Evolution Theory (BET). The journal of physical chemistry. A 122 (37) (2018)
Freddy Zutterman, Orian Louant, Gabriel Mercier, Tom Leyssens, Benoît Champagne
Predicting Keto-Enol Equilibrium from Combining UV/Visible Absorption Spectroscopy with Quantum Chemical Calculations of Vibronic Structures for Many Excited States. A Case Study on Salicylideneanilines. The journal of physical chemistry. A 122 (24) (2018)
Marc de Wergifosse, Edith Botek, Evelien De Meulenaere, Koen Clays, Benoît Champagne
ONIOM Investigation of the Second-Order Nonlinear Optical Responses of Fluorescent Proteins. The journal of physical chemistry. B 122 (19) (2018)
Tatiana Woller, Paul Geerlings, Frank De Proft, Benoît Champagne, Mercedes Alonso
Aromaticity as a Guiding Concept for Spectroscopic Features and Nonlinear Optical Properties of Porphyrinoids. Molecules (Basel, Switzerland) 23 (6) (2018)
Takanori Nagami, Jun-Ya Fujiyoshi, Takayoshi Tonami, Ken-Ichiro Watanabe, Masaki Yamane, Kenji Okada, Ryohei Kishi, Masayoshi Nakano, Benoît Champagne, Vincent Liégeois
Evaluation of Aromaticity for Open-Shell Singlet Dicyclopenta-Fused Acenes and Polyacenes Based on a Magnetically Induced Current. Chemistry (Weinheim an der Bergstrasse, Germany) 24 (51) (2018)
Orian Louant, Benoît Champagne, Vincent Liégeois
Investigation of the Electronic Excited-State Equilibrium Geometries of Three Molecules Undergoing ESIPT: A RI-CC2 and TDDFT Study. The journal of physical chemistry. A 122 (4) (2018)
Slim Hadj Mohamed, Benoît Champagne, Mahmoud Trabelsi
DFT Investigation of the Diastereoselectivity of the MX2 and MX3 Lewis-Acid-Catalyzed Mukaiyama Aldol Reaction between C,O,O-Tris(trimethylsilyl)ketene Acetal and Aldehydes. The journal of physical chemistry. A 122 (8) (2018)
Benoît Champagne, Vincent Liégeois, Joseph G Fripiat, Frank E Harris
Electronic Band Structure of Helical Polyisocyanides. The journal of physical chemistry. A 121 (41) (2017)
Masayoshi Nakano, Kotaro Fukuda, Soichi Ito, Hiroshi Matsui, Takanori Nagami, Shota Takamuku, Yasutaka Kitagawa, Benoît Champagne
Diradical and Ionic Characters of Open-Shell Singlet Molecular Systems. The journal of physical chemistry. A 121 (4) (2017)

Benoît Champagne.css-eqlu8i{font-size:small;padding-left:4px;} (B Champagne)

Publication Activity (10 Years)

Top Topics

Top Venues

Benoît Champagne (B Champagne)