分子ブリッジによる埋設界面制御で高効率・高安定ペロブスカイト太陽電池を実現 (Researchers Achieve Efficient and Stable Perovskite Solar Cells Through Molecular Bridge Regulation of Buried Interface)

2026-03-06 中国科学院(CAS)

中国科学院大連化学物理研究所(DICP)のYANG Dong教授らと湖北大学WU Congcong教授らの研究チームは、ペロブスカイト太陽電池の埋もれた界面を分子ブリッジで制御する新しい手法を提案し、高効率と高安定性を同時に実現した。電子輸送層SnO₂とペロブスカイト層の界面に4-アミノブチルホスホン酸(4-ABPA)を導入すると、ホスホン酸基がSnO₂表面とP-O-Sn共有結合で結合し、アミノ基がペロブスカイト格子中のPb²⁺やI⁻と配位して安定な分子ブリッジを形成する。これにより欠陥が効果的にパッシベーションされ、結晶配向や結晶性が向上し、界面ピンホールや残留応力が低減した。さらにエネルギー準位整合が改善され、キャリア寿命や発光強度も向上。電圧損失は31 mVまで低減し、変換効率はn-i-p構造で25.56%、p-i-n構造で26.45%を達成した。デバイスは長期安定性も高く、1440時間動作後も83.91%、2600時間保存後も91.59%の性能を維持した。

<関連情報>

ペロブスカイト太陽電池における埋め込み界面の分子架橋制御 Molecular Bridge Regulation of Buried Interface in Perovskite Solar Cells

Zezhu Zhou, Ruixia Yang, Biao Zhang, Zefeng Zhuang, Jiawei Wang, Ruijie Li, Hong Liu, Xin Zhou, Congcong Wu, Dong Yang
Advanced Materials  Published: 22 February 2026
DOI:https://doi.org/10.1002/adma.202519267

ABSTRACT

Defects at the buried interface represent a critical challenge that impedes further improvements in both the performance and scalable manufacturing of perovskite solar cells (PSCs). Defect formation, lattice mismatch, and energy-level misalignment at this interface aggravate nonradiative recombination and accelerate photothermal degradation, thereby limiting both efficiency and operational stability. Here, we employ interface engineering using multifunctional molecules to suppress defect formation. To minimize redundant material screening, we combine theoretical calculations with experimental validation to identify 4-aminobutylphosphonic acid (4-ABPA) for modifying the interface between the perovskite layer and the electrode. Both simulation and experimental results demonstrate 4-ABPA as a multifunctional molecular bridge that simultaneously anchors to the charge transport layer and interacts with the perovskite lattice. And its role in dynamically regulating perovskite crystallization and enhancing interfacial performance is uncovered. The dual-site chemical binding regulates crystallization, alleviates residual stress, suppresses interfacial defects, and optimizes energy-level alignment at the buried interface. As a result, voltage loss is reduced to 31 mV, enabling power conversion efficiencies of 25.56% in n–i–p and 26.45% in p–i–n architectures with negligible hysteresis. The modified devices also exhibit outstanding durability, retaining 83.91% of their initial performance under 1440 h of continuous operation and 91.59% after 2600 h of ambient storage. Our work establishes a systematic and universal buried-interface engineering strategy to further enhance efficiency and stability, thereby advancing the mass production of perovskite devices.

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