The Energetic Landscape in Non-fullerene Acceptor Organic Solar Cells Determines the Device Performance
Frédéric Laquai a
a KAUST Solar Center, King Abdullah University of Science and Technology, Thuwal, Saudi Arabia., Al-Jabriah, Yanbu Arabia Saudita, Yanbu, Saudi Arabia
Materials for Sustainable Development Conference (MATSUS)
Proceedings of Materials for Sustainable Development Conference (MAT-SUS) (NFM22)
#BRIGHT - Recent Breakthroughs in Organic Photovoltaics
Barcelona, Spain, 2022 October 24th - 28th
Organizers: Thomas Anthopoulos and Safa Shoaee
Invited Speaker, Frédéric Laquai, presentation 160
DOI: https://doi.org/10.29363/nanoge.nfm.2022.160
Publication date: 11th July 2022

In bulk heterojunction organic solar cells, the energetic landscape at the donor-acceptor interface provides the driving force for charge separation. The mechanism leading to efficient charge separation in fullerene-based blends has been intensively investigated, however with the recent advent of high-efficiency non-fullerene acceptors (NFAs) now surpassing 19% power conversion efficiency, the previous findings have to be revisited for NFA-based systems. In this presentation, I will discuss our latest insights into the photophysical processes governing charge separation, recombination, and energetic (voltage) losses in novel NFA-based systems studied by steady-state and advanced transient spectroscopy techniques. I will address the question, how the interfacial energy offsets control exciton dissociation and charge separation in binary and ternary blends of polymer or small molecular donors with novel NFAs, including photoactive layers using state-of-the-art Y-type acceptors. Generally, it appears that it is primarily the ionization energy (IE) offset that limits the exciton-to-charge transfer (CT) state conversion in many low-bandgap NFA-based systems, while the subsequent separation of the CT state into free charges is barrier-less. Sizeable IE offsets of 0.4-0.5 eV are required to ensure quantitative exciton-to-CT state conversion. The underlying reasons of this limitation, their implications for future donor and acceptor material design strategies, and novel computational (in-silico) approaches to material design will be discussed.

This work was supported by the KAUST Office of Sponsored Research (OSR) under award nos. OSR-2018-CARF/CCF-3079 and OSR-CRG2018-3746. Funding from the BMBF grant InterPhase and MESOMERIE (grant nos. FKZ 13N13661, FKZ 13N13656) and the European Union Horizon 2020 research and innovation program ‘Widening materials models’ under grant agreement no. 646259 (MOSTOPHOS) is acknowledged, as well as funding from the European Union’s Horizon 2020 research and innovation program under the Marie Skłodowska-Curie grant agreement no. 844655 (SMOLAC).

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