Forskningsgrupper
Applied Theoretical Chemistry

A theoretical chemist is a person who wants to understand the structure, movement and reactions of molecules. In applied theoretical chemistry, we want to find equations and quantitative measures for what we observe. Our starting point is often nature, but we are also concerned with unexplained problems in the industry. New ideas from basic research have often created new industry.
The group of applied theoretical chemistry studies the structure of chemicals at equilibrium, like the structure of catalysts, as well as the conversion of systems between equilibrium states, like in fuel cells. Biological systems, as well as inorganic and organic systems are of interest. In order to understand the enormous amounts of chemical information that often is provided in complex situation, we develop chemometrics.
As a master or doctor degree student in our group, you become member of an international group with contacts all over the world, and can choose to specialize in several directions.
The group in applied theoretical chemistry offer Master degree in applied theoretical chemistry within natural science or the technological studies. The master degree has courses and projects related to our areas of research.
Publications
EECS aims to disseminate its research results to the scientific community through scientific publications. EECS researchers have published at the highest international level.
Projects
The research activity of EECS is organised around research projects. Currently, EECS is contributing to the following projects:
- Single-ISA Heterogeneous MAny-core Computer (SHMAC)
- NAnoSCale Engineering for Novel Computation using Evolution (NASCENCE)
- Partnership for Advanced Computing in Europe (PRACE)
Partners
Research and business partners associated with the research group of Applied Theoretical Chemistry:
Research partners
- DTU – Electrical engeneering
- MIT - CadLab
- IGE – Initiative for Globus in Europe
- EMI – European Middleware Initiative
Business partners