Optimizing the miscibility for enhanced photovoltaic performance of non-fused ring electron acceptors through side-chain engineering†

IF 2.9 3区 化学 Q3 CHEMISTRY, PHYSICAL Physical Chemistry Chemical Physics Pub Date : 2025-03-04 DOI:10.1039/D5CP00267B
Yahui Bai, Linwei Xie, Zhihui Lin, Qi Ai, Fuwen Zhao and Dan He
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Abstract

Non-fused ring electron acceptors (NFREAs), notable for their simple and economical synthesis processes, play a pivotal role in the practical deployment of organic solar cells (OSCs). However, the power conversion efficiency (PCE) of NFREA based devices lags behind that of fused ring electron acceptors, because of the inferior charge transport and severe charge recombination in donor:NFREA blend films. In this study, we synthesized two novel NFREAs, A1C4-Cl and A1C6-Cl, featuring different alkyl side-chain lengths to optimize the miscibility between the donor and NFREAs for ideal morphology, taking into consideration that the morphology of donor:NFREA blend films has a significant influence on charge transport and recombination. The PBDB-T:A1C6-Cl based OSC exhibits better miscibility and more favourable phase separation, resulting in enhanced charge carrier mobilities and suppressed trap-assisted recombination. These improvements lead to a significant increase in short-circuit current density (JSC) and fill factor (FF), culminating in a PCE of 12.11% compared to PBDB-T:A1C4-Cl based devices. Our findings offer an effective approach to modulate the miscibility between donors and NFREAs, thereby enhancing the PCE of OSCs through the fine-tuning of alkyl side-chain lengths.

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通过侧链工程优化非熔合环电子受体的混相以增强光伏性能
非熔环电子受体(NFREAs)以其简单经济的合成工艺而著称,在有机太阳能电池(OSC)的实际应用中发挥着举足轻重的作用。然而,由于在供体:NFREAs 混合薄膜中存在较差的电荷传输和严重的电荷重组,基于 NFREAs 的器件的功率转换效率(PCE)落后于熔环电子受体。在本研究中,我们合成了两种新型 NFREAs--A1C4-Cl 和 A1C6-Cl,它们具有不同的烷基侧链长度,考虑到供体:NFREAs 混合薄膜的形态对电荷传输和电荷重组有重大影响,我们优化了供体和 NFREAs 之间的混溶性,以获得理想的形态。基于 PBDB-T:A1C6-Cl 的 OSC 具有更好的相溶性和更有利的相分离,从而提高了电荷载流子迁移率,抑制了陷阱辅助重组。这些改进显著提高了短路电流密度(JSC)和填充因子(FF),与基于 PBDB-T:A1C4-Cl 的器件相比,PCE 达到了 12.11%。我们的研究结果提供了一种有效的方法来调节供体和 NFREAs 之间的混溶性,从而通过微调烷基侧链长度来提高 OSC 的 PCE。
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来源期刊
Physical Chemistry Chemical Physics
Physical Chemistry Chemical Physics 化学-物理:原子、分子和化学物理
CiteScore
5.50
自引率
9.10%
发文量
2675
审稿时长
2.0 months
期刊介绍: Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.
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