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Updated: May 31, 2026

Novel Techniques for Observing Structural Dynamics of Photoresponsive Liquid Crystals
Published on: May 29, 2018
Computational spectroscopy and reaction dynamics
Pierre-Andre Cazade1, Stephan Lutz, Myung Won Lee
1Department of Chemistry, University of Basel, Klingelbergstrasse 80, CH-4056 Basel.
Abstract:
Physico- and bio-chemical processes on the femto- to picosecond time scale are ideally suited to be investigated with all-atom simulations. They include, amongst others, vibrational relaxation, ligand migration in sterically demanding environments (proteins, ices), or vibrational spectra. By comparing with experimental data, the results can be used to obtain an understanding of the mechanisms underlying the observations. Furthermore, most of these processes are sensitive to the intermolecular interactions. Therefore, detailed refinement of such interaction potentials is possible.
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