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In this study, two small dipole\u2010functionalized molecules, 1,4\u2010di(thiophen\u20102\u2010yl)benzene and 1,4\u2010di(thiazol\u20102\u2010yl)benzene, were synthesized and effectively anchored onto perovskite surfaces via Lewis acid\u2010base interactions to improve the quality of perovskite grain boundaries and reduce non\u2010radiative recombination. The dual\u2010passivation\u2010site dipole\u2010functionalized molecules strategically modulate the interfaces, establishing a gradient energy level alignment, that facilitates carrier extraction and transport. As a result, the optimal n\u2010i\u2010p PSC achieved a champion power conversion efficiency (PCE) of 25.85% alongside enhanced operational stability under simulated 1\u2010sun illumination over 1200\u00a0h. A large\u2010area device with an area of 1 cm\n                    <jats:sup>2<\/jats:sup>\n                    also exhibited a PCE of 24.79%. Our study provides fundamental insights into the role of dipole molecules in defect passivation for further development of interfacial engineering strategies for high\u2010performance perovskite optoelectronic devices.\n                  <\/jats:p>","DOI":"10.1002\/anie.202509529","type":"journal-article","created":{"date-parts":[[2025,8,11]],"date-time":"2025-08-11T07:19:36Z","timestamp":1754896776000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":20,"title":["Tailoring Dual\u2010Site Defect Passivation Molecules to Minimize Buried Interface Energy Loss for Highly Efficient and Stable Perovskite Solar Cells"],"prefix":"10.1002","volume":"64","author":[{"given":"Deng","family":"Wang","sequence":"first","affiliation":[{"name":"Key Laboratory of Environmentally Friendly Functional Materials and Devices Lingnan Normal University Zhanjiang  Guangdong 524048 China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yongchun","family":"Li","sequence":"additional","affiliation":[{"name":"Department of Materials Science and Engineering Southern University of Science and Technology Shenzhen  Guangdong 518055 China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Wenjing","family":"Li","sequence":"additional","affiliation":[{"name":"College of Materials Science &amp; 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