Promising Power Conversion Efficiency Research Articles

Regio- and Chemo-selective C-H Arylation of 3-Bromothiophene: A Synthesis Shortcut to Versatile π-Conjugated Building Blocks for Optoelectronic Materials.

Unlike traditional multi-step synthetic approaches, we developed a single-step synthesis of versatile π-conjugated building blocks bearing post-functionalizable C-H and C-Br bonds. Direct C-H arylation of 3-bromothiophene with various iodo(hetero)aryls was successfully carried out with good regio- and chemo-selectivity. Under optimized reaction conditions, 20 new compounds were facilely prepared in yields up to 91%. One of the obtained compounds was demonstrated to further extend its conjugation length using a succinct synthetic plan to create two symmetrical oligo(hetero)aryls (MLC01 and MLC02) that were fabricated as effective hole-transporting materials (HTM) for perovskite solar cells (PSC). PSC devices utilizing MLC01 as hole-transport layer displayed promising power conversion efficiencies of up to 17.01%.

Perovskite Solar Cells: Challenges Facing Polymeric Hole Selective Materials in p–i–n Configuration

AbstractPolymeric hole‐selective materials (P‐HSMs) offer advantages like solution processability, tunable energy levels, and improved mechanical stability, making them suitable for large‐scale and flexible substrates. Poly[bis(4‐phenyl) (2,4,6‐trimethylphenyl) amine] (PTAA) based p–i–n perovskite solar cells exhibit promising power conversion efficiency (PCE), but wettability, dopant, and cost challenges necessitate the development of advanced next‐generation P‐HSMs. To provide a clear understanding of the structural property with photovoltaic performance, this review classifies such newly developed P‐HSMs into five distinct structural categories. Specifically, this review discusses the current status, advancements, challenges, and prospects in structural design and synthetic variations, focusing on enhancing photovoltaic performance, wettability, mitigating surface defects, and stability. Notably, incorporating polar units into P‐HSMs enhances wettability and mitigates ion instabilities and uncoordinated lead defects. Promising structural designs like polymeric self‐assembled monolayers and in situ polymerized hole‐selective materials are examined. Despite performance advancements, emerging, P‐HSMs face significant challenges such as limited thermal stress analysis (55–85 °C) and scalability restricted to small‐scale devices. To bridge this gap, this review emphasizes the urgent need for prioritizing thermal stability testing and large‐scale device fabrication in future research, paving the way for commercial viability of P‐HSMs in p–i–n perovskite photovoltaics.

Novel Green Solvent for Sustainable Fabrication of Quasi‐2D Perovskite Solar Cells

AbstractDespite the remarkable advances in the field of perovskite photovoltaics, the use of toxic solvents for their fabrication poses a significant challenge to their scale‐up and commercialization. The vast majority of studies rely on using the highly hazardous N, N‐Dimethylformamide (DMF), with green alternatives remaining scarce. In this work, the use of glycerol formal (Gly‐F) is reported as a green solvent for fabricating quasi‐2D (n = 5) perovskite solar cells. Quasi‐2D perovskite films processed from Gly‐F exhibit a high degree of uniformity and a compact microstructure. When integrated into solar cells, the green solvent‐processed films reach a promising power conversion efficiency of 14.53%. This performance is lower than that of DMF‐based perovskites, most likely due to the presence of laterally oriented low n perovskite phases. Interestingly, while the performance of DMF‐based devices is rather irreproducible, the performance of Gly‐F‐based devices is robust and consistent. These results demonstrate the potential of Gly‐F‐ as a promising green alternative to DMF.

New family of two-dimensional A2B2C5 single-layer with high carrier mobilities and excellent conversion efficiency for solar cells

Screening high-performance two-dimensional (2D) materials with desirable direct band gaps and high mobility has attracted great interest due to their excellent application in 2D field effect transistors. Herein, we predicted a new family of nine-atomic A2B2C5 (A = Mg, Ba; B= Al, Ga, and In, C = S, Se) single-layer using first-principles calculations. The results indicate that the energies of this A2B2C5 single-layer are slightly lower than that of exfoliated single-layer Mg2Al2S5. Furthermore, most of the A2B2C5 single-layers host not only direct band gaps but also outstanding electron mobilities (up to ∼103 cm2V−1s−1), revealing a desirable range of near-infrared to visible light absorption. Importantly, single-layer Ba2Al2Se5 and Mg2Ga2Se5 are good donor materials, the corresponding Ba2Al2Se5/HfS2 and Mg2Ga2Se5/InS type-II heterostructures exhibit promising power conversion efficiencies of 22.3 % and 19.8 %, respectively. Our work provides some competitive A2B2C5 candidate single-layers for applying high-performance solar cells.

Transition Metal‐Derived 2D Layered Perovskites: A Promising Alternative to Pb in Photovoltaic Systems

AbstractThe high sensitivity of 3D perovskites toward air and moisture hampers their commercialization due to material decomposition. Introducing their 2D counterparts may provide a remedy to these stability issues, as hydrophobic bulky organic cations can resist direct contact of [ sheets with moisture in the air. In addition to air and water stability, 2D perovskites offer tunable optoelectronic properties through structural modulation, similar to their 3D counterparts. In this study, six different transition metal (TM)‐based 2D hybrid halide perovskites are designed: , , , , , and as alternatives for Pb‐based perovskites. Analysis of structural and thermodynamic parameters demonstrate that these designed perovskite materials can form structurally and thermodynamically stable compounds. Additionally, optical properties analysis reveals that the intended compounds exhibit absorption maxima in the visible range of the electromagnetic spectrum. Among the designed compounds, shows a promising power conversion efficiency (PCE) of 19.63%. Thus, these designed 2D perovskite materials hold potential as substitutes for conventional 3D materials in photovoltaic applications.

Performance Enhancement via Numerical Modeling and Optimization of FASnI3 Perovskite Solar Cell

Perovskite-based solar cells are currently attracting growing interest from researchers and industry alike, thanks to the advantages of this type of solar cell, particularly in terms of manufacturing simplicity and the promising power conversion efficiency, which has recently reached remarkable levels. This paper focuses on numerical simulation to improve the performance of the Formamidinium Tin Iodide (FASnI3) solar cell configuration by using Cerium Dioxide (CeO2) as ETL and Poly (Triaryl Amine) (PTAA) as HTL. The simulation has been carried out using Solar Cell Capacitance Simulator (SCAPS-1D) tool under the spectrum of AM 1.5 G. An intensive modeling has been realized to improve the output parameters of the suggested configuration based on FASnI3 as absorber. The proposed structure (ITO/CeO2/FaSnI3/PTAA/Au) achieves a tremendous power conversion efficiency (PCE) of 39.24%, an open-circuit voltage (VOC) of 1.31 V, a short-circuit current density (JSC) of 33.7 mA/cm2 and a fill factor (FF) of 90.12%.

First principles study of structural and optoelectronic properties of semiconductor NaBeP[formula omitted]N[formula omitted] alloys for photovoltaic applications

In this paper, the structural and optoelectronic properties of semiconductor NaBePxN1−x (x=0,0.25,0.50,0.75 and 1) alloys in the half-Heusler structure were investigated using density functional theory with GGA approximation. The lattice parameter a, the formation energy Ef and the cohesive energy Ec were examined. The obtained results show that the lattice parameter as a function of x for NaBePxN1−x alloys obeys Vegard’s Law. The negative values of Ef and Ec indicate that NaBeN and NaBeP alloys have thermodynamic stability and strong chemical bonds, implying that they could be synthesized in future experimental research. The estimated optical properties revealed details for NaBePxN1−x alloys concerning the optoelectronic and photovoltaic applications. The high absorption α(x=0,1)≈1.6×106cm−1 and reflectivity coefficients (R(x=0,1)>55%), indicate their suitability for usage in optoelectronic devices. The promising power conversion efficiency (η≈15%) also predicts that the thermodynamically stable alloys NaBeN and NaBeP are good for solar cell applications.

Comparative Study of Quasi-Solid-State Dye-Sensitized Solar Cells Using Z907, N719, Photoactive Phenothiazine Dyes and PVDF-HFP Gel Polymer Electrolytes with Different Molecular Weights

The present study investigates the influence of photosensitizer selection and the polymer electrolyte composition on the performance of quasi-solid-state dye-sensitized solar cells (QsDSSCs). Two benchmark ruthenium dyes, N719 and Z907, alongside a novel photoactive phenothiazine dye were used. Each dye was incorporated into a QsDSSC architecture employing poly(vinylidene fluoride-co-hexafluoropropylene) (PVDF-HFP) as the gel electrolyte matrix, with varying molecular weights, to investigate their impacts on the overall device performance and long-term stability. Our results demonstrated that the N719 dye exhibited the highest power conversion efficiency (PCE), attributed to its strong absorption in the visible spectrum and efficient electron injection into the TiO2 photoanode. Z907, on the other hand, showed moderate PCE due to its broader absorption profile but slower electron injection kinetics. The phenothiazine dye revealed promising PCE, with tunable absorption properties and efficient charge transfer. Furthermore, the impact of PVDF-HFP polymer gel electrolytes with varying molecular weights on cell stability was explored. The QsDSSC incorporating the PVH80 polymer with the phenothiazine dye exhibited reduced dye desorption, due to the effective dye molecules’ immobilization by the gel matrix, and consequently enhanced long-term stability over 600 h. This comparative study sheds light on the interplay between dye selection, the polymer gel’s properties, and QsDSSCs’ performance. These insights are crucial in designing robust and efficient QsDSSCs for practical applications.

A High-Performance Organic Photovoltaic System with Versatile Solution Processability.

Recently developed organic photovoltaic (OPV) materials have simultaneously closed the gaps in efficiency, stability, and cost for single-junction devices. Nonetheless, the developed OPV materials still pose big challenges in meeting the requirements for practical applications, especially regarding the prevalent issues of solution processability. Herein, a highly efficient polymer donor, named DP3, incorporating an electron-rich benzo[1,2-b:4,5-b']dithiophene unit as well as two similar and simple acceptor units is presented. Its primary objective is to enhance the interchain and/or intrachain interactions and ultimately fine-tune bulk-heterojunction microstructure. The DP3:L8-BO system demonstrates the highest power conversion efficiency (PCE) of 19.12%. This system also exhibits high-performance devices with over 18% efficiencies for five batches with various molecular weights (23.6-80.8KDa), six different blend thicknesses (95-308nm), differenced coating speeds (3.0-29.1mmin-1), with promising PCEs of 18.65% and 15.53% for toluene-processed small-area (0.029cm2) cells and large-area (15.40cm2) modules, thereby demonstrating versatile solution processability of the designed DP3:L8-BO system that is a strong candidate for commercial applications.

Additive and interface passivation dual synergetic strategy enables reduced voltage loss in wide-bandgap perovskite solar cells

The open-circuit voltage (VOC) loss for wide-bandgap (WBG) perovskite solar cells (PSCs) is a significant obstacle to their further development. Herein, we introduce a dual approach involving mixed potassium thiocyanate and potassium chloride (KSCN+KCl) additives combined with 2-thiophene methylamine iodine (2-ThMAI) post-passivation strategy to mitigate VOC loss in WBG PSCs. In the mixed additives, KSCN can expand the grains and reduce the grain boundary, while KCl can inhibit the migration of halogen ions, effectively preventing phase segregation in WBG perovskites under the combination of both. However, due to the substantial energy level mismatch at the perovskite/electron transport layer (ETL) interface, suppressing phase segregation alone is insufficient to reduce the VOC loss. Therefore, introducing 2-ThMAI interface passivation could uniform spatial distribution of perovskite surface potential, promote energetic alignment at perovskite/electron transport layer interface, and further reduce the VOC loss. With these optimizations, the champion WBG PSCs achieved an enhanced VOC of 1.327 V and a promising power conversion efficiency (PCE) of 19.44 %. Additionally, these modified WBG PSCs retained 94 % of their initial efficiency after 500 hours of continuous light soaking at maximum power point tracking in ambient conditions.

High-Performance PM6:Y6-Based Ternary Solar Cells with Enhanced Open Circuit Voltage and Balanced Mobilities via Doping a Wide-Band-Gap Amorphous Acceptor.

Great progress has been made in organic solar cells (OSCs) in recent years, especially after the report of the highly efficient small-molecule electron acceptor Y6. However, the relatively low open circuit voltage (VOC) and unbalanced charge mobilities remain two issues that need to be resolved for further improvement in the performance of OSCs. Herein, a wide-band-gap amorphous acceptor IO-4Cl, which possessed a shallower lowest unoccupied molecular orbital (LUMO) energy level than Y6, was introduced into the PM6:Y6 binary system to construct a ternary device. The mechanism study revealed that the introduced IO-4Cl was alloyed with Y6 to prevent the overaggregation of Y6 and offer dual channels for effective hole transportation, resulting in balanced hole and electron mobilities. Taking these advantages, an enhanced VOC of 0.894 V and an improved fill factor of 75.58% were achieved in the optimized PM6:Y6:IO-4Cl-based ternary device, yielding a promising power conversion efficiency (PCE) of 17.49%, which surpassed the 16.72% efficiency of the PM6:Y6 binary device. This work provides an alternative solution to balance the charge mobilities of PM6:Y6-based devices by incorporating an amorphous high-performance LUMO A-D-A small molecule as the third compound.

Exploring the Bi Layer Approach to Analyzing Lead-Free Perovskite Solar Cells' Numerical Aspects for High Efficiency

In the past decades the metal halide perovskites gained tremendous attention from researchers because of its excellent visible light absorption and promising power conversion efficiencies. But due its toxic nature and concerned ecological hazards it can’t be commercialized on a large scale. So there was a need to introduce a new toxic free alternative. According to this paper a volume lead free perovskite structure is quantitative investigated using SCAPS (1−D) software. A new approach is used in which The lead-free active layer CH3NH3SnI3 is encased in two bilayers of a simultaneous simulation that investigates the hole transport layer (HTL) and electron transport layer (ETL) and fine-tunes their respective thicknesses as well as the absorber layer to attain the best possible performance for the suggested structure. Furthermore, a number of parameters influencing electrical properties were studied statistically, including the effect of different rear connections, temperature changes, doping concentration in the absorber layer, defect states at interfaces, and the overall density of defects. The optimal configuration yielded an open circuit voltage (Voc) of 0.96V, a short circuit current density (Jsc) of 32mA/cm2, a Fill Factor of 82.02, and a power conversion efficiency of 26.09% under standard AM1.5 G conditions.

Thermal Stability Analysis of Formamidinium–Cesium‐Based Lead Halide Perovskite Solar Cells Fabricated under Air Ambient Conditions

The instability of perovskite solar cells (PSCs) remains a major bottleneck for their commercialization, with thermal instability posing a major concern, given the inevitable presence of heat in photovoltaic devices. Mixed‐cation/halide perovskites demonstrate enhanced stability and efficiency compared to single‐cation/halide perovskites. Identifying the optimal perovskite composition capable of withstanding high temperatures for longer durations is crucial for the development of thermally stable PSCs. This study provides valuable insights into the optimization of mixed‐cation/halide perovskites to enhance the thermal and structural stability of perovskite films. By systematically varying the Cs content in FA1−yCsyPb(I0.85Br0.15)3 (0 < y < 25)‐based perovskite, it is observed that controlling the Cs content allows precise modulation of crystal orientation in perovskite film with 10% Cs obtained as the optimal value. The perovskite film containing 10% Cs not only exhibits reduced microstrain but also demonstrates enhanced thermal stability during testing at 85 °C under controlled humidity. Furthermore, planar PSCs are fabricated using FA0.90Cs0.10Pb(I0.85Br0.15)3 as the absorber layer and TOP‐3 as the hole‐transporting material, achieving a promising power conversion efficiency (PCE) of 17.70%. Impressively, the unencapsulated devices retain 95% of their initial PCE after 1000 h of dark storage under ambient conditions.

Multi‐Selenophene Strategy Enables Dimeric Acceptors‐Based Organic Solar Cells with over 18.5% Efficiency

AbstractDimeric acceptor (DMA) becomes a promising alternative to small‐molecular and polymeric acceptor‐based organic solar cells (OSCs) due to its well‐defined chemical structure, high batch‐to‐batch reproducibility, and low molecular diffusion properties. However, DMAs usually exhibit blueshifted absorptions, limiting their photon utilization abilities. Herein, multi‐selenophene strategies are adopted to develop redshifted DMAs. From monomer (YSe) to dimers (DYSe‐1 and DYSe‐2), reduced electron reorganization energies and exciton binding energies enable the efficient charge dynamics in the DMAs‐based OSCs. Together with their effective absorption extending to ≈920 nm, DYSe‐1‐ and DYSe‐2‐ based OSCs exhibit outstanding short‐circuit current densities (JSCs) over 27 mA cm−2, which are the best among DMAs. Besides, compared with the YSe‐based device, both DMA‐based devices have higher electroluminescence quantum efficiencies and thus reduce nonradiative recombination loss (ΔE3), contributing to their reduced energy losses. The resultant open‐circuit voltages (VOCs) of DYSe‐1‐ and DYSe‐2‐ based OSCs are ≈0.88 V, which, combining their super JSC values, lead to the promising power conversion efficiencies of 18.56% and 18.22%, respectively. These results are among the best in DMAs‐based OSCs and highlight the great potential of the multi‐selenophene strategy for the development of redshifted DMAs with high performance.

Anti-Solvent-Free Fabrication of Stable FA0.9Cs0.1PbI3 Perovskite Solar Cells with Efficiency Exceeding 24.0% through a Naphthalene-Based Passivator.

The anti-solvent-free fabrication of high-efficiency perovskite solar cells (PSCs) holds immense significance for the transition from laboratory-scale to large-scale commercial applications. However, the device performance is severely hindered by the increased occurrence of surface defects resulting from the lack of control over nucleation and crystallization of perovskite using anti-solvent methods. In this study, 2-(naphthalen-2-yl)ethylamine hydriodide (NEAI) is employed as the surface passivator for perovskite films without using any anti-solvent. Naphthalene demonstrates strong π-π conjugation, which aids in the efficient extraction of charge carriers. Additionally, the naphthalene-ring moieties form a tight attachment to the perovskite surface. After NEAI treatment, FA and I vacancies are selectively occupied by NEA+ and I- in NEAI respectively, thus effectively passivating the surface defects and isolating the surface from moisture. Ultimately, the optimized NEAI-treated device achieves a promising power conversion efficiency (PCE) of 24.19% (with a certified efficiency of 23.94%), featuring a high fill factor of 83.53%. It stands out as one of the reported high PCEs achieved for PSCs using the spin-coating technique without the need for any anti-solvent so far. Furthermore, the NEAI-treated device can maintain ≈87% of its initial PCE after 2000h in ambient air with a relative humidity of 30%±5%.

Boosting optoelectronic performance of (FA)X(MA)1-XPbI3 perovskite solar cells: Via FAI post-treatment engineering

Complex composition engineering of mixed-cations perovskite (FAxMA1-xPbI3) has recently supported rapid progress in perovskite solar cells (PSCs). Nevertheless, it is insufficient to embed and accommodate formamidinium (FA) cation into the MAPbI3 lattice structure via existing methods, leaving behind masses of FA or lead halide content and deteriorating photovoltaic performance. Herein, we present facile surface engineering via post-treated methodology, the surface of CH3NH3PbI3 (MAPbI3) films post-treated with formamidinium iodide (FAI) solution and that results get mixed-cation FAxMA1-xPbI3 perovskite films. The mixed-cation-based FAXMA1-XPbI3 perovskite with significant and large grain size, uniform and compact morphology, highly crystallization, and consequently reducing defect density of the perovskite films can be produced via the present method. It is observed that the film, post-treated with FAI-2, shows results in a very stable and highly crystalline lattice structure with attributes such as extended carrier lifetime, better electron transport, and decreased defect density. The optimized device demonstrates a promising power conversion efficiency (PCE) of 21.89%, and higher than that of the non-treated (19.08%) devices. Furthermore, the devices based on the novel FAI-post-treatment engineering exhibit significantly enhanced stability compared to non-treated devices. Therefore, this approach provides a novel methodology that offers a simple method for producing superior mixed perovskite films, potentially paving the way for the future exploitation of the boosted performance of perovskite solar cells.

Over 19 % Efficiency Organic Solar Cells Enabled by Manipulating the Intermolecular Interactions through Side Chain Fluorine Functionalization.

Fluorine side chain functionalization of non-fullerene acceptors (NFAs) represents an effective strategy for enhancing the performance of organic solar cells (OSCs). However, a knowledge gap persists regarding the relationship between structural changes induced by fluorine functionalization and the resultant impact on device performance. In this work, varying amounts of fluorine atoms were introduced into the outer side chains of Y-series NFAs to construct two acceptors named BTP-F0 and BTP-F5. Theoretical and experimental investigations reveal that side-chain fluorination significantly increase the overall average electrostatic potential (ESP) and charge balance factor, thereby effectively improving the ESP-induced intermolecular electrostatic interaction, and thus precisely tuning the molecular packing and bulk-heterojunction morphology. Therefore, the BTP-F5-based OSC exhibited enhanced crystallinity, domain purity, reduced domain spacing, and optimized phase distribution in the vertical direction. This facilitates exciton diffusion, suppresses charge recombination, and improves charge extraction. Consequently, the promising power conversion efficiency (PCE) of 17.3 % and 19.2 % were achieved in BTP-F5-based binary and ternary devices, respectively, surpassing the PCE of 16.1 % for BTP-F0-based OSCs. This work establishes a structure-performance relationship and demonstrates that fluorine functionalization of the outer side chains of Y-series NFAs is a compelling strategy for achieving ideal phase separation for highly efficient OSCs.

Over 19 % Efficiency Organic Solar Cells Enabled by Manipulating the Intermolecular Interactions through Side Chain Fluorine Functionalization

AbstractFluorine side chain functionalization of non‐fullerene acceptors (NFAs) represents an effective strategy for enhancing the performance of organic solar cells (OSCs). However, a knowledge gap persists regarding the relationship between structural changes induced by fluorine functionalization and the resultant impact on device performance. In this work, varying amounts of fluorine atoms were introduced into the outer side chains of Y‐series NFAs to construct two acceptors named BTP‐F0 and BTP‐F5. Theoretical and experimental investigations reveal that side‐chain fluorination significantly increase the overall average electrostatic potential (ESP) and charge balance factor, thereby effectively improving the ESP‐induced intermolecular electrostatic interaction, and thus precisely tuning the molecular packing and bulk‐heterojunction morphology. Therefore, the BTP‐F5‐based OSC exhibited enhanced crystallinity, domain purity, reduced domain spacing, and optimized phase distribution in the vertical direction. This facilitates exciton diffusion, suppresses charge recombination, and improves charge extraction. Consequently, the promising power conversion efficiency (PCE) of 17.3 % and 19.2 % were achieved in BTP‐F5‐based binary and ternary devices, respectively, surpassing the PCE of 16.1 % for BTP‐F0‐based OSCs. This work establishes a structure‐performance relationship and demonstrates that fluorine functionalization of the outer side chains of Y‐series NFAs is a compelling strategy for achieving ideal phase separation for highly efficient OSCs.

Two‐dimensional Bimetal‐Embedded Expanded Phthalocyanine Monolayers: A Class of Multifunctional Materials with Fascinating Properties

AbstractThe expanded phthalocyanine (EPc) single‐layer sheets with embedded double transition metals (labeled as TM2EPc) are predicted to be a novel class of highly stable 2D materials with a series of fascinating properties by means of systematic first‐principles calculations, molecular dynamics, and Monte Carlo simulations. Excitingly, the ferromagnetic Cr2EPc and antiferromagnetic Mn2– and Fe2–EPc have high magnetic transition temperatures of 223 (TC), 217 (TN), and 325 K (TN), respectively. This makes them promising candidates for low‐dimensional spintronic applications. Unexpectedly, V2EPc is an antiferromagnetic metal with Dirac cone, while ferromagnetic Cr2EPc exhibits Dirac half‐metallicity. The ultra‐high Fermi velocities near Dirac cones render them promising candidates for applications in high‐speed nanoelectronics and spintronics. Several architectured type‐II heterojunctions show promising power conversion efficiency with maximum 25.19% for Ni2EPc/2H‐WSe2, which has great potential in excitonic solar cell applications. Diverse promising properties endow this class of materials multifunction, which paves the way towards the future applications in nanoelectronics, spintronics, optoelectronics, and photovoltaics.

Polydentate Ligand Reinforced Chelating to Stabilize Buried Interface toward High-Performance Perovskite Solar Cells.

The instability of the buried interface poses a serious challenge for commercializing perovskite photovoltaic technology. Herein, we report a polydentate ligand reinforced chelating strategy to strengthen the stability of buried interface by managing interfacial defects and stress. The bis(2,2,2-trifluoroethyl) (methoxycarbonylmethyl)phosphonate (BTP) is employed to manipulate the buried interface. The C=O, P=O and two -CF3 functional groups in BTP synergistically passivate the defects from the surface of SnO2 and the bottom surface of the perovskite layer. Moreover, The BTP modification contributes to mitigated interfacial residual tensile stress, promoted perovskite crystallization, and reduced interfacial energy barrier. The multidentate ligand modulation strategy is appropriate for different perovskite compositions. Due to much reduced nonradiative recombination and heightened interface contact, the device with BTP yields a promising power conversion efficiency (PCE) of 24.63 %, which is one of the highest efficiencies ever reported for devices fabricated in the air environment. The unencapsulated BTP-modified devices degrade to 98.6 % and 84.2 % of their initial PCE values after over 3000 h of aging in the ambient environment and after 1728 h of thermal stress, respectively. This work provides insights into strengthening the stability of the buried interface by engineering multidentate chelating ligand molecules.