Our group combines experiments and simulations to approach the question of imperfect organic semiconductors. In particular, we are interested in mixtures, the effects of defects, and control of traps. We combine first-principles electronic structure calculations and experiments to verify and validate our Monte Carlo charge dynamics simulations. We will outline significant results, covering field effect transistors and organic solar cells, including addressing key assumptions in the role of disorder and defects.

Monte Carlo charge dynamics simulations of imperfect organic semiconductors: Drawing from first-principles and experiment to accurately describe realistic devices

244th National Meeting (2012)

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