On the Conformation of Dimeric Acceptors and Their Polymer Solar Cells with Efficiency over 18 %
Journal article, 2023

The determination of molecular conformations of oligomeric acceptors (OAs) and their impact on molecular packing are crucial for understanding the photovoltaic performance of their resulting polymer solar cells (PSCs) but have not been well studied yet. Herein, we synthesized two dimeric acceptor materials, DIBP3F-Se and DIBP3F-S, which bridged two segments of Y6-derivatives by selenophene and thiophene, respectively. Theoretical simulation and experimental 1D and 2D NMR spectroscopic studies prove that both dimers exhibit O-shaped conformations other than S- or U-shaped counter-ones. Notably, this O-shaped conformation is likely governed by a distinctive “conformational lock” mechanism, arising from the intensified intramolecular π–π interactions among their two terminal groups within the dimers. PSCs based on DIBP3F-Se deliver a maximum efficiency of 18.09 %, outperforming DIBP3F-S-based cells (16.11 %) and ranking among the highest efficiencies for OA-based PSCs. This work demonstrates a facile method to obtain OA conformations and highlights the potential of dimeric acceptors for high-performance PSCs.

Selenophene

Solar Cells

Molecular Conformation

Acceptor

Oligomer

Author

Jingnan Wu

Aalborg University

Chalmers, Chemistry and Chemical Engineering, Applied Chemistry

Zhaoheng Ling

King Abdullah University of Science and Technology (KAUST)

Leandro R. Franco

Karlstad University

Sang Young Jeong

Korea University

Zewdneh Genene Wolkeba

Chalmers, Chemistry and Chemical Engineering, Applied Chemistry

Josué Mena Gomez

Chalmers, Chemistry and Chemical Engineering, Applied Chemistry

Si Chen

King Abdullah University of Science and Technology (KAUST)

Cailing Chen

King Abdullah University of Science and Technology (KAUST)

C. Moyses Araujo

Karlstad University

Uppsala University

Cleber F.N. Marchiori

Karlstad University

Joost Kimpel

Chalmers, Chemistry and Chemical Engineering, Applied Chemistry

Xiaoming Chang

King Abdullah University of Science and Technology (KAUST)

Furkan H. Isikgor

King Abdullah University of Science and Technology (KAUST)

Qiaonan Chen

Chalmers, Chemistry and Chemical Engineering, Applied Chemistry

Hendrik Faber

King Abdullah University of Science and Technology (KAUST)

Yu Han

King Abdullah University of Science and Technology (KAUST)

Frédéric Laquai

King Abdullah University of Science and Technology (KAUST)

Maojie Zhang

Shandong University

Han Young Woo

Korea University

Donghong Yu

Aalborg University

Thomas D. Anthopoulos

King Abdullah University of Science and Technology (KAUST)

Ergang Wang

Chalmers, Chemistry and Chemical Engineering, Applied Chemistry

Angewandte Chemie - International Edition

1433-7851 (ISSN) 1521-3773 (eISSN)

Vol. 62 45 e202302888

Alkyl chain linked conjugated polymers for stable polymer solar cells

Swedish Research Council (VR) (2019-04683), 2020-01-01 -- 2023-12-31.

Next Generation Organic Solar Cells (OPV 2.0)

Swedish Research Council (VR) (2016-06146), 2017-01-01 -- 2022-12-31.

Swedish Research Council (VR) (2016-06146), 2017-01-01 -- 2022-12-31.

Swedish Research Council (VR) (2016-06146), 2017-01-01 -- 2022-12-31.

Subject Categories

Polymer Chemistry

Biochemistry and Molecular Biology

Biophysics

Organic Chemistry

DOI

10.1002/anie.202302888

PubMed

37380618

More information

Latest update

3/7/2024 9