Prediction of charge and energy transport in organic crystals with quantum chemical protocols employing the hopping model
As organic semiconductors gain more importance for application, research into their properties has become necessary. This work investigated the exciton and charge transport properties of organic semiconducting crystals. Based on a hopping approach, protocols have been developed for the calculation o...
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Format: | Doctoral Thesis |
Language: | English |
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2015
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Online Access: | https://opus.bibliothek.uni-wuerzburg.de/frontdoor/index/index/docId/11494 http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-114940 https://nbn-resolving.org/urn:nbn:de:bvb:20-opus-114940 https://opus.bibliothek.uni-wuerzburg.de/files/11494/stehr_vera_diss.pdf |