Welcome to the Center for Molecular Modeling

The Center for Molecular Modeling focuses on frontier research in six major areas - chemical kinetics in nanoporous materials, computational material research on the nanoscale, spectroscopy, many-particle physics, model development & bio- and organic chemistry. Our multidisciplinary research team is currently composed of about 35 researchers from the Faculties of Sciences (WE05) and Engineering and Architecture (EA17, EA10) of Ghent University.

New A1-publications

I. Yarulina, S. Bailleul, A. Pustovarenko, J. Ruiz-Martinez, K. De Wispelaere, J. Hajek, B.M. Weckhuysen, K. Houben, M. Baldus, V. Van Speybroeck, F. Kapteijn, J. Gascon, ChemCatChem, 8, 19, 3057–3063, 2016
J. Jaeken, S. Cottenier, Computer Physics Communications, 207, 445–451, 2016
T. Furuncuoğlu, B. Kura, S. Catak, H. Goossens, V. Van Speybroeck, M. Waroquier, V. Aviyente, European Polymer Journal, 83, 67–76, 2016


Dr. Kurt Lejaeghere nominated for EOS Pipet 2016
Dr. Kurt Lejaeghere is nominated for the EOS Pipet 2016 award, an initiative of EOS Science Magazine, highlighting the most promising young scientists of the year. The nomination follows Kurt's paper in Science, entitled 'Reproducibility in density... more
Lecture by Prof. Chris G. Van de Walle
On September 26 2016 Prof. Chris G. Van de Walle (Materials Department, University of California, CA, USA) will give a lecture entitled 'Hydrogen interactions with materials: from semiconductors to hydrogen storage'. When: September 26 2016 at... more