Regensburg 2007 – scientific programme

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HL: Fachverband Halbleiterphysik

HL 10: Organic semiconductors

HL 10.1: Talk

Monday, March 26, 2007, 14:45–15:00, H14

Temperature dependence and anisotropy of charge-carrier mobilities in crystalline durene — •Frank Ortmann, Karsten Hannewald, and Friedhelm Bechstedt — Institut für Festkörpertheorie und -optik, Friedrich-Schiller-Universität, Max-Wien-Platz 1, 07743 Jena

We report on the theoretical analysis of charge-carrier mobilities in durene crystals. The crystal is studied with DFT methods to examine structural, vibrational, and electronic properties. On that basis we employ a Holstein-Peierls model (see Hannewald et al. PRB 69, 075211 (2004); PRB 69, 075212 (2004)) to simulate the temperature dependence of the mobilities. The relation between the anisotropy of electron/hole mobilities and the band structure as well as lattice vibrations is discussed.