Litcius/Paper detail

Stabilizing buried interface by bilateral bond strength equilibrium strategy toward efficient perovskite photovoltaics

Jike Ding, Yunxiao Liao, Hao Liu, Yong Ding, Quanxing Ma, Mengjia Li, Zuoling Zhang, Jiajia Zhang, Jianxin Tang, Jiang Sheng, Jiangzhao Chen, Cong Chen

2025Nature Communications14 citationsDOIOpen Access PDF

Abstract

The NiOx/perovskite interface in p-i-n inverted perovskite solar cells (PSCs) suffers from trap-assisted nonradiative recombination, chemical reactions and weak adhesion. The self-assembled molecules are usually designed to address the above issues. However, absonant bilateral bond strength with NiOx and perovskite hinders the realization of efficient and stable PSCs. Herein, a bilateral bond strength equilibrium strategy is proposed to stabilize the buried interface in inverted PSCs through functional group and spatial conformation engineering. 1-(benzothiaxole-2-ylthio)succnic acid (BTSA) is adsorbed on the surface of NiOx through the S atom, π-ring, and N atom in the benzothiazole, making benzothiazole ring parallel to the NiOx surface, which is beneficial for passivating bilateral defects and improving hole transport. This strategy leads to effective interfacial defect passivation, interfacial chemical reaction suppression and ameliorated electrical properties of NiOx films, enabling 1.53 eV PSCs and large-area module (764 cm2) with a PCE of 26.98% (certified 26.65%) and 21.98%, respectively. The mismatched bilateral bond strength between NiOx and perovskite hinders the development of inverted perovskite solar cells. Here, authors adsorb 1-(benzothiaxole-2-ylthio)succinic acid on NiOx surface for passivating bilateral defects and achieve maximum efficiency close to 27% in stable devices.

Topics & Concepts

Perovskite (structure)Materials sciencePhotovoltaicsChemical physicsAdsorptionMoleculeChemical bondOptoelectronicsAtom (system on chip)Bond strengthRealization (probability)Energy conversion efficiencyChemical stabilityInterface (matter)Electronic structureNanotechnologyBond lengthPerovskite solar cellRing (chemistry)Layer (electronics)Chemical equilibriumCatalysisChemical engineeringStructural stabilityChemical reactionPerovskite Materials and ApplicationsQuantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin Films