Projects per year
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Profiles
Razieh BAKHSHANDEHSERAJI
- Unit of theoretical and structural physico-chemistry
- Technological Platform High Performance Computing
Person: Scientific Staff Visiting researcher
Tom Cardeynaels
- Namur Institute of Structured Matter
- Faculty of Sciences
- Unit of theoretical and structural physico-chemistry
Person: Scientific Staff Scolar PhD, Doctorate in Sciences
Projects
Multiresolution topological and non-covalent interaction analyses of electron density maps
1/03/20 → …
Project: Research
Preparation and physico-chemical characterization of (ionic) cocrystals of aryl hydantoins based on hydrogen, halogen, and chalcogen bonds
WOUTERS, J. & Leyssens, T.
1/01/20 → 31/12/23
Project: Research
Research Output
A Deep Blue B,N-Doped Heptacene Emitter That Shows Both Thermally Activated Delayed Fluorescence and Delayed Fluorescence by Triplet-Triplet Annihilation
Suresh, S. M., Duda, E., Hall, D., Yao, Z., Bagnich, S., Slawin, A. M. Z., Bässler, H., Beljonne, D., Buck, M., Olivier, Y., Köhler, A. & Zysman-Colman, E., 8 Apr 2020, In : Journal of the American Chemical Society. 142, 14, p. 6588-6599 12 p.Research output: Contribution to journal › Article
Computational studies of molecular materials for unconventional energy conversion: The challenge of light emission by thermally activated delayed fluorescence
Sanz-Rodrigo, J., Olivier, Y. & Sancho-García, J. C., 24 Feb 2020, In : Molecules. 25, 4, 12 p., 1006.Research output: Contribution to journal › Review article
Open Access
File
Exciton efficiency beyond the spin statistical limit in organic light emitting diodes based on anthracene derivatives
Sharma, N., Wong, M. Y., Hall, D., Spuling, E., Tenopala-Carmona, F., Privitera, A., Copley, G., Cordes, D. B., Slawin, A. M. Z., Murawski, C., Gather, M. C., Beljonne, D., Olivier, Y., Samuel, I. D. W. & Zysman-Colman, E., 21 Mar 2020, In : Journal of Materials Chemistry C. 8, 11, p. 3773-3783 11 p.Research output: Contribution to journal › Article
Activities
Chemistry Africa (Journal)
Laurence LEHERTE (Peer reviewer)
5 May 2020
Activity: Publication peer-review and editorial work types › Publication peer-review
Interpretation of Sum Frequency Generation Spectra of functionalized surfaces by first principles methods
Benoit CHAMPAGNE (Speaker)
15 Mar 2020 → 18 Mar 2020
Activity: Talk or presentation types › Invited talk
Molecules (Journal)
Laurence LEHERTE (Peer reviewer)
19 Feb 2020
Activity: Publication peer-review and editorial work types › Publication peer-review
Prizes
best oral communication award
MEINGUET, Celine (Recipient), 5 Jun 2013
Prize: Prize (including medals and awards)
Bourse de recherche scientifique de l'OTAN
LEHERTE, Laurence (Recipient), 1 Apr 1993
Prize: Fellowship awarded competitively
Financement FSR "Simulations de propriétés structurales, énergétiques et dynamiques d'assemblages supramoléculaires constitués de cycloextrines"
LEHERTE, Laurence (Recipient), 2001
Prize: Other distinction
Press / Media
Broadening TDO's base
Eduard Dolusic, Raphaël Frederick, Bernard Masereel & Johan Wouters
23/02/12
1 item of Media coverage
Press/Media: Expert Comment
Une avancée considérable contre la cancer
Eduard Dolusic, Raphaël Frederick, Bernard Masereel & Johan Wouters
7/02/12
1 item of Media coverage
Press/Media: Other
Cancer: Des chercheurs namurois innovent.
Eduard Dolusic, Raphaël Frederick, Bernard Masereel & Johan Wouters
3/02/12
1 item of Media coverage
Press/Media: Other
Datasets
CCDC 1897319: Experimental Crystal Structure Determination
Berthet, J. (Creator), Agouridas, L. (Creator), Chen, S. (Creator), Allouchi, H. (Creator), Melnyk, P. (Creator), CHAMPAGNE, B. (Contributor) & Delbaere, S. (Creator), University of Namur, 1 Dec 2019
DOI: 10.5517/ccdc.csd.cc21p9vx, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc21p9vx&sid=DataCite
Dataset
CCDC 1484037: Experimental Crystal Structure Determination
Van Cleuvenbergen, S. (Contributor), Stassen, I. (Contributor), Gobechiya, E. (Contributor), ZHANG, Y. (Contributor), Markey, K. (Contributor), De Vos, D. E. (Contributor), Kirschhock, C. (Contributor), CHAMPAGNE, B. (Contributor), Verbiest, T. (Contributor) & Van Der Veen, M. A. (Contributor), Cambridge Crystallographic Data Centre, 1 Jan 2016
DOI: 10.5517/ccdc.csd.cc1lt85v, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc1lt85v&sid=DataCite
Dataset
CCDC 793359: Experimental Crystal Structure Determination
Konishi, A. (Contributor), Hirao, Y. (Contributor), Nakano, M. (Contributor), Shimizu, A. (Contributor), BOTEK, E. (Contributor), CHAMPAGNE, B. (Contributor), Shiomi, D. (Contributor), Sato, K. (Contributor), Takui, T. (Contributor), Matsumoto, K. (Contributor), Kurata, H. (Contributor) & Kubo, T. (Contributor), Cambridge Crystallographic Data Centre, 1 Jan 2011
DOI: 10.5517/ccvmk77, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccvmk77&sid=DataCite
Dataset
Student theses
Analyse et modélisation de nouveaux inhibiteurs non nucléosidiques de la transcriptase inverse du virus de l'immunodéficience humaine de type 1 (VIH-1)
Author: Boland, S., 27 Feb 2004Supervisor: Durant, F. (Supervisor), Andre, J. (Jury), Hevesi, L. (Jury), Wouters, J. (Jury) & Burny, A. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences
File
Apport de la chimie calculatoire à la modélisation de diagrammes de phases.
Author: Fontaine, M., 2003Supervisor: Andre, J. (Supervisor), Perpete, É. (Jury), Sporken, R. (Jury), ADJIMAN, C. (External person) (Jury) & Charlot, M. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences
Approche structurale et fonctionnelle de la première enzyme de la voie de la sérine: PHGDH, une cible potentielle pour le traitement du cancer
Author: Themans, Q., 18 Oct 2019Supervisor: Wouters, J. (Supervisor), Leherte, L. (President), Unterlass, J. (External person) (Jury), Sirigu, S. (External person) (Jury) & Röhrig, U. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences
File