PMID- 37274941 OWN - NLM STAT- PubMed-not-MEDLINE LR - 20230607 IS - 2053-714X (Electronic) IS - 2095-5138 (Print) IS - 2053-714X (Linking) VI - 10 IP - 5 DP - 2023 May TI - Neglected acidity pitfall: boric acid-anchoring hole-selective contact for perovskite solar cells. PG - nwad057 LID - 10.1093/nsr/nwad057 [doi] LID - nwad057 AB - The spontaneous formation of self-assembly monolayer (SAM) on various substrates represents an effective strategy for interfacial engineering of optoelectronic devices. Hole-selective SAM is becoming popular among high-performance inverted perovskite solar cells (PSCs), but the presence of strong acidic anchors (such as -PO(3)H(2)) in state-of-the-art SAM is detrimental to device stability. Herein, we report for the first time that acidity-weakened boric acid can function as an alternative anchor to construct efficient SAM-based hole-selective contact (HSC) for PSCs. Theoretical calculations reveal that boric acid spontaneously chemisorbs onto indium tin oxide (ITO) surface with oxygen vacancies facilitating the adsorption progress. Spectroscopy and electrical measurements indicate that boric acid anchor significantly mitigates ITO corrosion. The excess boric acid containing molecules improves perovskite deposition and results in a coherent and well-passivated bottom interface, which boosts the fill factor (FF) performance for a variety of perovskite compositions. The optimal boric acid-anchoring HSC (MTPA-BA) can achieve power conversion efficiency close to 23% with a high FF of 85.2%. More importantly, the devices show improved stability: 90% of their initial efficiency is retained after 2400 h of storage (ISOS-D-1) or 400 h of operation (ISOS-L-1), which are 5-fold higher than those of phosphonic acid SAM-based devices. Acidity-weakened boric acid SAMs, which are friendly to ITO, exhibits well the great potential to improve the stability of the interface as well as the device. CI - (c) The Author(s) 2023. Published by Oxford University Press on behalf of China Science Publishing & Media Ltd. FAU - Guo, Huanxin AU - Guo H AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Liu, Cong AU - Liu C AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Hu, Honglong AU - Hu H AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Zhang, Shuo AU - Zhang S AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Ji, Xiaoyu AU - Ji X AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Cao, Xiao-Ming AU - Cao XM AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Ning, Zhijun AU - Ning Z AD - School of Physical Science and Technology, ShanghaiTech University, Shanghai 201210, China. FAU - Zhu, Wei-Hong AU - Zhu WH AUID- ORCID: 0000-0001-9103-166X AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Tian, He AU - Tian H AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. FAU - Wu, Yongzhen AU - Wu Y AUID- ORCID: 0000-0003-3000-403X AD - Key Laboratory for Advanced Materials and Joint International Research Laboratory of Precision Chemistry and Molecular Engineering, Feringa Nobel Prize Scientist Joint Research Center, Institute of Fine Chemicals, Frontiers Science Center for Materiobiology and Dynamic Chemistry, School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai 200237, China. LA - eng PT - Journal Article DEP - 20230303 PL - China TA - Natl Sci Rev JT - National science review JID - 101633095 PMC - PMC10237332 OTO - NOTNLM OT - acid-induced degradation OT - boric acid anchor OT - hole-selective contact OT - long-term stability OT - perovskite solar cells COIS- None declared. EDAT- 2023/06/05 19:10 MHDA- 2023/06/05 19:11 PMCR- 2023/03/03 CRDT- 2023/06/05 12:09 PHST- 2022/06/06 00:00 [received] PHST- 2022/08/06 00:00 [revised] PHST- 2022/08/31 00:00 [accepted] PHST- 2023/06/05 19:11 [medline] PHST- 2023/06/05 19:10 [pubmed] PHST- 2023/06/05 12:09 [entrez] PHST- 2023/03/03 00:00 [pmc-release] AID - nwad057 [pii] AID - 10.1093/nsr/nwad057 [doi] PST - epublish SO - Natl Sci Rev. 2023 Mar 3;10(5):nwad057. doi: 10.1093/nsr/nwad057. eCollection 2023 May.