H.-J. Werner

Theoretical Chemistry Group

We develop new high-level electronic structure methods for computing energies and other properties of large molecules and molecular clusters. These methods are made available in the Molpro quantum chemistry program, which is used by many research groups world-wide. In our group the methods are applied to study chemical reaction mechanisms and dynamics, spectroscopic properties of molecules, and non-covalent intermolecular interactions.

Hans-Joachim Werner

Dieses Bild zeigt Werner
Prof. Dr.

H.-J. Werner

Former head of the Institute, Group Leader (retired)