Personal profile

Education/Academic qualification

Doctor of Science, University of Namur

Fingerprint Fingerprint is based on mining the text of the person's scientific documents to create an index of weighted terms, which defines the key subjects of each individual researcher.

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Molecules Chemical Compounds
molecules Physics & Astronomy
Density functional theory Chemical Compounds
Optical properties Chemical Compounds
density functional theory Physics & Astronomy
optical properties Physics & Astronomy
electronics Physics & Astronomy
Derivatives Chemical Compounds

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Projects 1971 2021

Research Output 1989 2018

Assessing the Structure of Octastate Molecular Switches Using 1H NMR Density Functional Theory Calculations

Hadj Mohamed, S., Quertinmont, J., Delbaere, S., Sanguinet, L. & Champagne, B. 25 Jan 2018 In : The Journal of Physical Chemistry C. 122, 3, p. 1800-1808 9 p.

Research output: Contribution to journalArticle

switches
density functional theory
nuclear magnetic resonance
protons
Density functional theory
Open Access
File
Excited states
Molecules
Geometry
geometry
electronics

Quantum Chemical Methods for Predicting and Interpreting Second-Order Nonlinear Optical Properties: From Small to Extended π-Conjugated Molecules

Champagne, B., Beaujean, P., De Wergifosse, M., Hidalgo Cardenuto, M., Liégeois, V. & Castet, F. 2018 Frontiers of Quantum Chemistry. Wojcik, M., Nakatsuji, H., Kirtman, B. & Ozaki, Y. (eds.). Singapore: Springer, p. 117-138 21 p.

Research output: Contribution in Book/Catalog/Report/Conference proceedingChapter (peer-reviewed)

Optical properties
Molecules
Quantum chemistry
Electron correlations
Solvation
Open Access
Bond length
Density functional theory
Switches
salicylideneaniline
functionals
Stereochemistry
Chemical shift
Carboxylic acids
Esters
Nuclear magnetic resonance

Activities 1998 2018

Thesis

Apport de la chimie quantique pour la simulation des spectres d'absorption UV/Visible des catalyseurs de polymérisation des oléfines

Author: Cavillot, V., 26 Aug 2004

Supervisor: Andre, J. (Jury), Houssiau, L. (Jury), BENVENUTI, F. (Jury), Devaux, J. (Jury), François, P. (Jury) & Champagne, B. (Supervisor)

Student thesis: Doc typesDoctor of Sciences

A vibrational Raman Optical Activity study of helical oligomers

Author: Liégeois, V., 2006

Supervisor: Champagne, B. (Supervisor)

Student thesis: DEA typesDEA in Chemistry

Conception de nanosenseurs à base de matrices silicées mésoporeuses hautement structurées pour le dosage des ions mercuriques

Author: Nivarlet, N., 5 Oct 2007

Supervisor: Krief, A. (Jury), Lepere, M. (Jury), Walcarius, A. (Jury), Su, B. L. (Supervisor) & Champagne, B. (Jury)

Student thesis: Doc typesDoctor of Sciences