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Updated: Apr 18, 2026

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
Published on: May 27, 2020
Excited state dynamics of organic semi-conducting materials
Kenneth P Ghiggino1, Andrew J Tilley, Benjamin Robotham
1School of Chemistry, University of Melbourne, Melbourne, Victoria, Australia. ghiggino@unimelb.edu.au.
Abstract:
Time-resolved absorption and emission spectroscopy has been applied to investigate the dynamics of excited state processes in oligomer models for semi-conducting organic materials. Following the photo-excitation of a pentamer oligomer that is a model for the conjugated polymer MEH-PPV, an ultrafast component of a few picoseconds is observed for the decay of the initially formed transient species. Variable temperature absorption and emission spectra combined with X-ray crystallography and calculations support the assignment of this rapid relaxation process to an excited state conformational rearrangement from non-planar to more planar molecular configurations. The implications of the results for the overall photophysics of conjugated polymers are considered.
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