Reconstructing the perovskite surface with a homogeneous electric potential by reducing localized charge for efficient and durable perovskite solar cells

Runhao Chen , Jiankai Zhang , Yi Luo , Zebin Guo , Wenyi Wu , Xin Xu , Chengwen Huang , Hai Zhou

Energy Materials ›› 2026, Vol. 6 ›› Issue (7) : 600089

PDF
Energy Materials ›› 2026, Vol. 6 ›› Issue (7) :600089 DOI: 10.20517/energymater.2026.102
Article
Reconstructing the perovskite surface with a homogeneous electric potential by reducing localized charge for efficient and durable perovskite solar cells
Author information +
History +
PDF

Abstract

The non-radiative recombination induced by localized charges and inhomogeneous surface potential of perovskite film limits the advancement of stable and efficient perovskite solar cells (PSCs). Herein, for the first time, (Ferrocenylmethyl)trimethylammonium chloride (FTAC) is introduced to reconstruct the surface of the perovskite film. Calculations reveal Pb-N coordination between FTAC and the perovskite framework, accompanied by iodine-vacancy compensation, thereby leading to effective defect passivation and mitigating charge localization. Meanwhile, this reconstruction strategy ensures potential uniformity across the perovskite interface and a more p-type characteristic, thereby accelerating the charge transport in PSCs. As a result, FTAC-modified devices deliver an outstanding efficiency of 25.06% with a low voltage deficit of 0.32 V, a significant improvement over the 23.31% efficiency of control PSCs. In addition, the target devices display excellent stability, retaining 91.16% of their initial efficiency after 1,000 h aging at 85 °C in N2 and 88.67% after 1,000 h of continuous maximum power point tracking at 65 °C. In the present study, by reconstructing the perovskite film surface to achieve a homogeneous potential distribution, non-radiative recombination is effectively reduced, offering an innovative approach to boost PSC efficiency and device stability.

Keywords

Perovskite solar cells / non-radiative recombination / localized charges / surface potential / (ferrocenylmethyl)trimethylammonium chloride

Cite this article

Download citation ▾
Runhao Chen, Jiankai Zhang, Yi Luo, Zebin Guo, Wenyi Wu, Xin Xu, Chengwen Huang, Hai Zhou. Reconstructing the perovskite surface with a homogeneous electric potential by reducing localized charge for efficient and durable perovskite solar cells. Energy Materials, 2026, 6 (7) : 600089 DOI:10.20517/energymater.2026.102

登录浏览全文

4963

注册一个新账户 忘记密码

References

[1]

Kojima A,Shirai Y.Organometal halide perovskites as visible-light sensitizers for photovoltaic cells.J Am Chem Soc2009;131:6050-1

[2]

Zheng X,Zhang Y.Co-deposition of hole-selective contact and absorber for improving the processability of perovskite solar cells.Nat Energy2023;8:462-72

[3]

You S,Liu Y.Radical polymeric p-doping and grain modulation for stable, efficient perovskite solar modules.Science2023;379:288-94

[4]

Wu W,Jia L.Stable and uniform self-assembled organic diradical molecules for perovskite photovoltaics.Science2025;389:195-9

[5]

Ma B,Chen B.Thiol groups reutilization on chemical bath deposited tin oxide surface achieving interface anchoring and defects passivation for enhancing the performance and stability of perovskite solar cells.Small2025;21:e2408516

[6]

Shi P,Ding B.Oriented nucleation in formamidinium perovskite for photovoltaics.Nature2023;620:323-7

[7]

Li Y,Cai Y.Synergistic isothiourea-guanidine additive for achieving stable perovskite solar cells with a high certified quasi-steady-state output.Adv Mater2026;38:e14903

[8]

Yang Y,Ding Y.A thermotropic liquid crystal enables efficient and stable perovskite solar modules.Nat Energy2024;9:316-23

[9]

Green M,Yoshita M.Solar cell efficiency tables (Version 66).Prog Photovolt Res Appl2025;33:795-810

[10]

Yang B,Di Giacomo F.Interfacial passivation engineering of perovskite solar cells with fill factor over 82% and outstanding operational stability on n-i-p architecture.ACS Energy Lett2021;6:3916-23

[11]

Li Y,Lim EL,Bi D.Recent progress of critical interface engineering for highly efficient and stable perovskite solar cells.Adv Energy Mater2022;12:2102730

[12]

Oliver RDJ,Peña-camargo F.Understanding and suppressing non-radiative losses in methylammonium-free wide-bandgap perovskite solar cells.Energy Environ Sci2022;15:714-26

[13]

You S,Gao J.Bifunctional hole-shuttle molecule for improved interfacial energy level alignment and defect passivation in perovskite solar cells.Nat Energy2023;8:515-25

[14]

Duan H,Liu X.Electron-donor/-acceptor ratio-guided molecular engineering for buried interface optimization in n-i-p perovskite solar cells.Energy Mater2026;6

[15]

Wang WT,Zhou N.Water- and heat-activated dynamic passivation for perovskite photovoltaics.Nature2024;632:294-300

[16]

Ding B,Peng J.Dopant-additive synergism enhances perovskite solar modules.Nature2024;628:299-305 PMCID:PMC11006611

[17]

Chen X,Wei H.Minimizing the buried interfacial energy loss using a fluorine-substituted small molecule for 25.92%-efficiency and stable inverted perovskite solar cells.Energy Environ Sci2024;17:7342-54

[18]

Shi X,Dou Y.Air-processed perovskite solar cells with >25% efficiency and high stability enabled by crystallization modulation and holistic passivation.Adv Mater2024;36:e2402785

[19]

Zhang Z,Jiang X.Suppression of phase segregation in wide-bandgap perovskites with thiocyanate ions for perovskite/organic tandems with 25.06% efficiency.Nat Energy2024;9:592-601

[20]

Li H,Zhu M.Nanosurface-reconstructed perovskite for highly efficient and stable active-matrix light-emitting diode display.Nat Nanotechnol2024;19:638-45

[21]

Shao W,Fu S.Tailoring perovskite surface potential and chelation advances efficient solar cells.Adv Mater2024;36:e2310080

[22]

Tao M,Zhang K.Molecule-triggered strain regulation and interfacial passivation for efficient inverted perovskite solar cells.Joule2024;8:3142-52

[23]

Pan Y,Sun Z.Surface chemical polishing and passivation minimize non-radiative recombination for all-perovskite tandem solar cells.Nat Commun2024;15:7335 PMCID:PMC11347601

[24]

Zhu X,Mo K.A Surface-reconstructed bilayer heterojunction enables efficient and stable inverted perovskite solar cells.Adv Mater2024;36:e2409340

[25]

Nie J,Wang J,Zhang Y.Recent progress in regulating surface potential for high-efficiency perovskite solar cells.ACS Energy Lett2024;9:1674-81

[26]

Zhou J,Tian W.Homogenizing hole-selective contacts for centimeter-square flexible perovskite/Cu(In,Ga)Se2 tandems.Sci Adv2025;11:eadz2781.[DOI:10.1126/sciadv.adz2781

[27]

Ou K,Xiang J.Importance of passivation efficiency of the passivator for efficient printable mesoscopic perovskite solar cells.J Energy Chem2025;106:438-45

[28]

Xu Y,Liu S.Surface potential homogenization improves perovskite solar cell performance.Adv Energy Mater2025;15:2404755

[29]

Huang H,Liu B.Regulating bifacial surface potential of perovskite film enables efficient perovskite solar cells universal for different charge transport layers.Small2025;21:e2412129

[30]

Chang Q,Xu W.Ferrocene-induced perpetual recovery on all elemental defects in perovskite solar cells.Angew Chem Int Ed2021;60:25567-74

[31]

Hu B,Yang Y.Tailored multi-functional molecular chain-based ferrocene derivative for efficient and stable perovskite solar cells.Nano Energy2023;118:109022

[32]

Vanin F,Gao D.Modulating perovskite surface energetics through tuneable ferrocene interlayers for high-performance perovskite solar cells.Angew Chem Int Ed2025;64:e202424041

[33]

Webb T,Westbrook RJ.A multifaceted ferrocene interlayer for highly stable and efficient lithium doped spiro‐OMeTAD‐based perovskite solar cells.Adv Energy Mater2022;12:2200666

[34]

Perdew JP,Ernzerhof M.Generalized gradient approximation made simple.Phys Rev Lett1996;77:3865-8

[35]

Kresse G.Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set.Phys Rev B Condens Matter1996;54:11169-86

[36]

Kresse G.From ultrasoft pseudopotentials to the projector augmented-wave method.Phys Rev B1999;59:1758-75

[37]

Oner SM,Yordanli MS,Deger C.Surface defect formation and passivation in formamidinium lead triiodide (FAPbI3) perovskite solar cell absorbers.J Phys Chem Lett2022;13:324-30

[38]

Yang S,Dou Y.Investigation of the effect of molecules containing sulfonamide moiety adsorbed on the FAPbI3 perovskite surface: a first-principles study.Molecules2025;30:2463 PMCID:PMC12156441

[39]

Xia J,Nazeeruddin MK.Efficient and stable perovskite solar cells by tailoring of interfaces.Adv Mater2023;35:e2211324

[40]

Tao J,Wang Z.Suppressing non-radiative recombination for efficient and stable perovskite solar cells.Energy Environ Sci2025;18:509-44

[41]

Jiang Q.Rapid advances enabling high-performance inverted perovskite solar cells.Nat Rev Mater2024;9:399-419

[42]

Lu Y,Yu Y.Constructing an n/n+ homojunction in a monolithic perovskite film for boosting charge collection in inverted perovskite photovoltaics.Energy Environ Sci2021;14:4048-58

[43]

Li Z,Wu X.Organometallic-functionalized interfaces for highly efficient inverted perovskite solar cells.Science2022;376:416-20

[44]

Zhang Y,Sun Y,Su Z.An MBene modulating the buried SnO2/perovskite interface in perovskite solar cells.Angew Chem Int Ed2024;63:e202404385

[45]

Chen H,Chen B.Quantum-size-tuned heterostructures enable efficient and stable inverted perovskite solar cells.Nat Photon2022;16:352-8

[46]

Masi S,Mora-seró I.Stabilization of black perovskite phase in FAPbI3 and CsPbI3.ACS Energy Lett2020;5:1974-85

[47]

Teale S,Chen B,Grancini G.Molecular cation and low-dimensional perovskite surface passivation in perovskite solar cells.Nat Energy2024;9:779-92

[48]

Wang H,Wang X,Luo J.Phenyltrimethylammonium chloride additive for highly efficient and stable FAPbI3 perovskite solar cells.Nano Energy2024;123:109423

[49]

Zhang J.Multifunctional dopamine-assisted preparation of efficient and stable perovskite solar cells.J Energy Chem2021;54:291-300

[50]

Lin Y,Lv S.A Nd@C82-polymer interface for efficient and stable perovskite solar cells.Nature2025;642:78-84

[51]

Zhao C,Hu X.Ambient blade-coated perovskite solar cells with high reverse bias stability enabled by polymeric hole transporter design.Nat Commun2025;16:10355 PMCID:PMC12644531

[52]

Xu Y,Zhang Z,Lin H.Evolved photovoltaic performance of MAPbI3 and FAPbI3-based perovskite solar cells in low-temperatures.Energy Mater2024;4:400034

PDF

4

Accesses

0

Citation

Detail

Sections
Recommended

/

〈 〉