Computational Quantum Chemistry: From spectra of metal complexes to radiation damage of biomolecules

Sauer, S. P. A. (Invited speaker)

Department of Chemistry

Activity: Talk or presentation types › Lecture and oral contribution

Description

Quantum chemical calculations have today found widespread applications. In my presentation I want to illustrate this with examples from my own research focusing on the interplay between calculations and experiment. The examples will range from perturbed angular correlation (PAC), nuclear magnetic resonance (NMR) or electron paramagnetic resonance (EPR) spectroscopy studies on transition metal complexes, over NMR studies of various organic compounds to UV/Vis spectra of organic dyes and the calculation of rate constants for the reactions of OH-radicals with DNA nucleobases.

Period	29 Mar 2017
Held at	Institut for Fysik, Kemi og Farmaci, Syddansk Universitet, Denmark
Degree of Recognition	International