University of Twente
Faculty of Science and Technology
Carre building, CR 4047
P.O. Box 217
7500 AE Enschede
In our group we exploit numerical techniques, based upon first-principles quantum mechanical methods such as density functional theory, to model the structure and electronic structure of materials with appealing (opto)electronic or (electro)chemical properties. Of particular interest are materials that either have unusual physical properties, a lower dimensionality, or have potential for applications in electronics, solar energy, or solar fuels.