Impact of electron–phonon coupling on the quantum yield of photovoltaic devices

In describing the charge carriers’ separation mechanism in the organic solar cell, providing a method, which considers the impact of all parameters of interest on the same footing within an inexpensive numerical effort, could play an essential role. We use here a simple tight-binding model to describe the dissociation of the charge carriers and investigate their dependence on the physical parameters of the system. We demonstrate that the quantum yield of the cell is subtly controlled by the collective action of the Coulomb interaction of the electron–hole pair, electron–phonon coupling, and the geminate recombination of the charge carriers. This approach should help us understand the performance of organic solar cells and optimize their efficiency.