In this presentation, we first discuss the electronic and optical processes that take place in solar cells based on organic pi-conjugated materials.  In the second part, we describe how a combined quantum-chemical/molecular simulations approach allows us to gain a better understanding of: (i) the local morphology at the organic-organic interfaces present in the active layers; and (ii) the charge-separation mechanism at those interfaces.

Combined quantum-chemical/molecular simulations approach to the description of electronic and optical processes in organic solar cells

243rd National Meeting (2012)

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