Thomas Schlesier, University of Mainz, Germany
Untersuchung der Dynamik von Wasserstoffbrücken-bindungen mittels molekulardynamischer Simulationen
Heike Fliegl, Forschungszentrum Karlsruhe, Germany
Towards solar cells - TDDFT study on an unusually stable Ru(II) complex
Michael Diedenhofen, COSMOlogic Leverkusen, Germany
COSMO and COSMO-RS Fluid Phase Property Prediction based on Quantum Chemistry
Claudia Roos, University of Mainz, Germany
Vibronische Spektren von Rylen-Farbstoffen
John F. Stanton, University of Texas, Austin, USA
Coupled-cluster theory and quasidiabaticity: Motivation, analytic coupling constants and a few applications
Peter R. Schreiner, University of Gießen, Germany
Herausforderungen bei der Berechnung organischer Moleküle
Kirk Peterson, University of Washington State, USA
The use of explicitly correlated methods for accurate potential energy surfaces
Christoph van Wüllen, Technical University of Kaiserslautern, Germany
Quantenchemische Untersuchungen zu Metallkatalysierten Michael-Additionen
Dage Sundholm, University of Helsinki, Finland
Ab initio computational methods for studies of self-assembled semiconductor quantum dots
Robert Berger, University of Frankfurt, Germany
Vibronic structure methods for large molecular systems
Gabriele Cazzoli, University of Bologna, Italy
Interplay of theory and experiment in rotational spectroscopy
Francesco Evangelista, University of Georgia, Athens, USA
Triples excitations in state-specific multireference coupled cluster theory