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TU Dresden » Faculty of Mechanical Science and Engineering » Institute for Materials Science » Chair of Materials Science and Nanotechnology

» presentations   » 2016.03.11

How Morphology Affects the Charge Transport: A Case Study for C60

Sebastian Schellhammer, Frank Ortmann, and Gianaurelio Cuniberti

DPG Frühjahrstagung der Sektion Kondensierte Materie (SKM)

2016.03.11; Regensburg, Germany

We present a computational algorithm for the construction of arbitrarily ordered films ranging from amorphous to polycrystalline and highly crystalline. We demonstrate its application for a systematic study of the electron mobility in C60 systems depending on the degree of ordering which is based on a full parameterization of the electronic properties. Additionally, we present a generalization for other molecular materials such as pentacene as well as organic blends.

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