Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells

Abstract Suppressing deep-level defects at the perovskite bulk and surface is indispensable for reducing the non-radiative recombination losses and improving efficiency and stability of perovskite solar cells (PSCs). In this study, two Lewis bases based on chalcogen-thiophene (n-Bu4S) and selenophen...

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Main Authors: Muhammad Azam, Yao Ma, Boxue Zhang, Xiangfeng Shao, Zhongquan Wan, Huaibiao Zeng, Haomiao Yin, Junsheng Luo, Chunyang Jia
Format: Article
Language:English
Published: Nature Portfolio 2025-01-01
Series:Nature Communications
Online Access:https://doi.org/10.1038/s41467-025-55815-z
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author Muhammad Azam
Yao Ma
Boxue Zhang
Xiangfeng Shao
Zhongquan Wan
Huaibiao Zeng
Haomiao Yin
Junsheng Luo
Chunyang Jia
author_facet Muhammad Azam
Yao Ma
Boxue Zhang
Xiangfeng Shao
Zhongquan Wan
Huaibiao Zeng
Haomiao Yin
Junsheng Luo
Chunyang Jia
author_sort Muhammad Azam
collection DOAJ
description Abstract Suppressing deep-level defects at the perovskite bulk and surface is indispensable for reducing the non-radiative recombination losses and improving efficiency and stability of perovskite solar cells (PSCs). In this study, two Lewis bases based on chalcogen-thiophene (n-Bu4S) and selenophene (n-Bu4Se) having tetra-pyridine as bridge are developed to passivate defects in perovskite film. The uncoordinated Pb2+ and iodine vacancy defects can interact with chalcogen-concave group and pyridine group through the formation of the Lewis acid-base adduct, particularly both the defects can be surrounded by concave molecules, resulting in effective suppression charge recombination. This approach enables a power conversion efficiency (PCE) as high as 25.37% (25.18% certified) for n-i-p PSCs with stable operation at 65 °C and 1-sun illumination for 1300 hours in N2 (ISOS-L-2 protocol), retaining 94% of the initial efficiency. Our work provides insight into the bowl-shaped Lewis base in defects passivation by coordinated strategy for high-performance photovoltaic devices.
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institution Kabale University
issn 2041-1723
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publishDate 2025-01-01
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spelling doaj-art-64ae719e7d7d4af9b516074bcede1e192025-01-12T12:29:40ZengNature PortfolioNature Communications2041-17232025-01-0116111110.1038/s41467-025-55815-zTailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cellsMuhammad Azam0Yao Ma1Boxue Zhang2Xiangfeng Shao3Zhongquan Wan4Huaibiao Zeng5Haomiao Yin6Junsheng Luo7Chunyang Jia8National Key Laboratory of Electronic Films and Integrated Devices, School of Integrated Circuit Science and Engineering, University of Electronic Science and Technology of ChinaState Key Laboratory of Applied Organic Chemistry, Lanzhou UniversityInstitut de Recherche de Chimie Paris (IRCP) UMR8247, Chimie ParisTech, PSL University CNRSState Key Laboratory of Applied Organic Chemistry, Lanzhou UniversityNational Key Laboratory of Electronic Films and Integrated Devices, School of Integrated Circuit Science and Engineering, University of Electronic Science and Technology of ChinaNational Key Laboratory of Electronic Films and Integrated Devices, School of Integrated Circuit Science and Engineering, University of Electronic Science and Technology of ChinaNational Key Laboratory of Electronic Films and Integrated Devices, School of Integrated Circuit Science and Engineering, University of Electronic Science and Technology of ChinaNational Key Laboratory of Electronic Films and Integrated Devices, School of Integrated Circuit Science and Engineering, University of Electronic Science and Technology of ChinaNational Key Laboratory of Electronic Films and Integrated Devices, School of Integrated Circuit Science and Engineering, University of Electronic Science and Technology of ChinaAbstract Suppressing deep-level defects at the perovskite bulk and surface is indispensable for reducing the non-radiative recombination losses and improving efficiency and stability of perovskite solar cells (PSCs). In this study, two Lewis bases based on chalcogen-thiophene (n-Bu4S) and selenophene (n-Bu4Se) having tetra-pyridine as bridge are developed to passivate defects in perovskite film. The uncoordinated Pb2+ and iodine vacancy defects can interact with chalcogen-concave group and pyridine group through the formation of the Lewis acid-base adduct, particularly both the defects can be surrounded by concave molecules, resulting in effective suppression charge recombination. This approach enables a power conversion efficiency (PCE) as high as 25.37% (25.18% certified) for n-i-p PSCs with stable operation at 65 °C and 1-sun illumination for 1300 hours in N2 (ISOS-L-2 protocol), retaining 94% of the initial efficiency. Our work provides insight into the bowl-shaped Lewis base in defects passivation by coordinated strategy for high-performance photovoltaic devices.https://doi.org/10.1038/s41467-025-55815-z
spellingShingle Muhammad Azam
Yao Ma
Boxue Zhang
Xiangfeng Shao
Zhongquan Wan
Huaibiao Zeng
Haomiao Yin
Junsheng Luo
Chunyang Jia
Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells
Nature Communications
title Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells
title_full Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells
title_fullStr Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells
title_full_unstemmed Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells
title_short Tailoring pyridine bridged chalcogen-concave molecules for defects passivation enables efficient and stable perovskite solar cells
title_sort tailoring pyridine bridged chalcogen concave molecules for defects passivation enables efficient and stable perovskite solar cells
url https://doi.org/10.1038/s41467-025-55815-z
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