Fingerprint The fingerprint is based on mining the text of the scientific documents related to the associated persons. Based on that an index of weighted terms is created, which defines the key subjects of research unit

Molecules Chemical Compounds
Derivatives Chemical Compounds
molecules Physics & Astronomy
Density functional theory Chemical Compounds
Catalysts Chemical Compounds
Metals Chemical Compounds
Optical properties Chemical Compounds
Carbon Chemical Compounds

Network Recent external collaboration on country level. Dive into details by clicking on the dots.

Projects 1971 2022

Research Output 1966 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: Research - peer-reviewArticle

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

Opening Pandora’s Box: Chirality, Polymorphism, and Stoichiometric Diversity in Flurbiprofen/Proline Cocrystals

Tumanova, N., Tumanov, N., Robeyns, K., Fischer, F., Fusaro, L., Morelle, F., Ban, V., Hautier, G., Filinchuk, Y., Wouters, J., Leyssens, T. & Emmerling, F. 4 Jan 2018 In : Crystal Growth & Design. 18, 2, p. 954-961 8 p.

Research output: Research - peer-reviewArticle

Pandora
polymorphism
grinding
chirality
boxes

Activities 1987 2018

16th Belgian Organic Synthesis Symposium

Berionni, G. (Participant)
Jul 2018

Activity: Participating in or organising an eventParticipation in conference

ChemCYS 2018

Berionni, G. (Poster)
Feb 2018

Activity: Participating in or organising an eventParticipation in conference

Prizes

Best Communication Prize

Grégoire Rondelet (Recipient), 4 Feb 2015

Prize: Prize (including medals and awards)

best oral communication award

Céline Meinguet (Recipient), 5 Jun 2013

Prize: Prize (including medals and awards)

Bourse de recherche scientifique de l'OTAN

Laurence Leherte (Recipient), 1 Apr 1993

Prize: Fellowship awarded competitively

Press / Media

3D Printing Improves X-Ray Diffraction Experiments

Nikolay Tumanov

7/07/17

1 item of media coverage

Press / Media: Expert Comment

3-D-printed jars in ball-milling experiments

Nikolay Tumanov

27/06/17

1 item of media coverage

Press / Media: Other

Student theses

2-Acylaminothiazole cholecystokinin receptor ligands: pharmacophore model for non-peptide agonists of the cholecystokinin-A receptor

Author: Voordijk, S., 1999

Supervisor: Durant, F. (Supervisor)

Student thesis: Doc typesDoctor of Sciences

3D Assembly of Nanostructured ZnO: Synthesis Design, Formation Mechanism, Hierarchy and Photocatalytic Properties

Author: Wang, Q., 18 Jan 2013

Supervisor: Su, B. L. (Supervisor), Lanners, S. (Jury), Colomer, J. (Jury), Aprile, C. (President), Liu, Z. (Jury) & Van Tendeloo, G. (Jury)

Student thesis: Doc typesDoctor of Sciences

Activation des selenoacetals par des acides de Lewis, réactions avec des allylsilanes et des allylstannanes.

Author: Hermans, B., 1995

Student thesis: Doc typesDoctor of Sciences