Probing the invisible charge transfer states for low-offset organic photovoltaics
Jun Yan a b, Liming Liu a, Mohammed Azzouzi b c, Flurin Eisner c d, Jolanda Müller b, Sean Koh b, Wenzhi Ma a, Enas Moustafa b e, Hanbo Yang b, Jenny Nelson b
a Guangdong Basic Research Center of Excellence for Aggregate Science, School of Science and Engineering, The Chinese University of Hong Kong (Shenzhen), Shenzhen, Guangdong, 518172, P.R. China
b Department of Physics, Imperial College London, London, SW7 2BZ, UK
c Laboratory for Computational Molecular Design (LCMD), Institute of Chemical Sciences and Engineering, Ecole Polytechnique Federal de Lausanne (EPFL), 1015 Lausanne, Switzerland
d School of Engineering and Materials Science, Queen Mary University of London, London, UK.
e Renewable Energy Science and Engineering Department, Faculty of Postgraduate Studies for Advanced Sciences, Beni-Suef University, Beni Suef, 62511, Egypt.
Proceedings of International Conference on Hybrid and Organic Photovoltaics (HOPV26)
Uppsala, Sweden, 2026 May 18th - 20th
Organizers: Gerrit Boschloo, Ellen Moons, Feng Gao and Anders Hagfeldt
Oral, Jun Yan, presentation 010
Publication date: 11th March 2026

The property of charge transfer (CT) state determines the charge generation yield, energy losses, and charge collection efficiency, hence is the key to properly understand the operation of organic photovoltaics (OPVs). OPVs based on nonfullerene acceptors (NFAs) often possess reduced offset between local excitonic state (LE) and CT state, leading to invisible CT state emission from typical photoluminescence (PL) and electroluminescence (EL) experiments. The invisibility of CT state makes it difficult to access its physical properties in low-offset NFA OPVs, therefore hindering the further development of OPV devices to reach 20% power conversion efficiency. Here, we propose a method to probe the “invisible CT states” using a newly developed model framework coupled with PL and EL experiments. Through modelling fitting, we are able to extract the excited state properties of both LE and CT states, which allows us to draw correlations between offset and the properties of CT states. This work offers a method to access the properties of CT states in low-offset OPVs, and provides insights into the understanding of charge generation, energy losses, as well as charge collection.

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