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A review of the effect of stability issues and wide-bandgap in the application of perovskite solar cells 钙钛矿太阳能电池应用中稳定性问题和宽带隙的影响综述
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-05-24 DOI: 10.1007/s40243-025-00307-9
Prince Tshepho Mokabane, Valantine Takwa Lukong, Tien-Chien Jen

Research into perovskite solar cells (PSC) is making significant progress toward contributing to renewable energy generation. With perovskite solar cells, power conversion efficiency above 25% has been reported, making it a promising technology. The existing module perovskite-based type cells indeed display the best performance of all the types available in the markets, even with the excess temperature conditions as concerns. However, the chances of perovskite-based types providing sustainable energy are low, and more work is still required. This article discusses predictions about workability issues and the existence of a high forbidden zone that came with PSCs. It then reviews the degradation mechanisms and solutions to overcome these stability problems. PSCs have a big commercialization issue, which may concern their stability because their productivity is unstable in real-time operation, especially under long run-time conditions. In addition, the review expands on how PSC materials effectively transport charges and how the various barriers present in PSCs are affected. The article goes into more detail on how perovskite crystal orientation has lately been significant, which modern design is suitable for perovskite solar cells, how different layers in perovskite cells are made, and what kind of materials are laid between electron transport layers (ETLs) and buffer layers. The final part of the article provides insight into the methods for overcoming degradation and enhancing the stability PSCs, which is crucial for commercialization.

钙钛矿太阳能电池(PSC)的研究在可再生能源发电方面取得了重大进展。据报道,钙钛矿太阳能电池的功率转换效率超过25%,是一项很有前途的技术。现有的基于钙钛矿的组件型电池确实显示出市场上所有类型电池的最佳性能,即使在温度过高的情况下也是如此。然而,以钙钛矿为基础的类型提供可持续能源的机会很低,仍然需要更多的工作。本文讨论了关于可操作性问题的预测以及psc所带来的高禁区的存在。然后回顾了降解机制和克服这些稳定性问题的解决方案。由于psc在实时运行中,特别是在长时间运行条件下,其生产率不稳定,因此存在很大的商业化问题,这可能会影响其稳定性。此外,该审查扩展了PSC材料如何有效地传输电荷以及PSC中存在的各种障碍如何受到影响。本文更详细地讨论了钙钛矿晶体取向最近是如何重要的,哪种现代设计适合钙钛矿太阳能电池,钙钛矿电池的不同层是如何制成的,以及在电子传输层(ETLs)和缓冲层之间铺设了什么样的材料。文章的最后一部分提供了深入了解的方法,以克服退化和提高稳定性的psc,这是至关重要的商业化。
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引用次数: 0
Efficient inverted HTL-free Sm2NiMnO6-based perovskite solar cell: a SCAPS-1D study 高效倒置无html的sm2nimno6基钙钛矿太阳能电池:SCAPS-1D研究
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-05-24 DOI: 10.1007/s40243-025-00308-8
Nassim Ahmed Mahammedi

The transition to sustainable energy has driven extensive research into perovskite solar cells (PSCs) as promising candidates for next-generation photovoltaics. Despite their remarkable efficiencies, the commercialization of PSCs remains hindered by lead toxicity and material instability. In this study, we investigate a lead-free samarium-based double perovskite oxide, Sm2NiMnO6 (SNMO), as the active absorber layer in an innovative inverted, hole transport layer (HTL)-free PSC architecture. Using SCAPS-1D simulations, we optimized the device configuration and achieved a power conversion efficiency (PCE) of 10.93%, with an open-circuit voltage (VOC) of 0.8 V, a short-circuit current density (JSC) of 16.46 mA cm−2, and a fill factor (FF) of 82.14%. Notably, increasing the SNMO absorber thickness enhanced light absorption in the red spectral region, shifting the external quantum efficiency (EQE) peak from 380 nm wavelength at a thickness of 50 nm to approximately  620 nm at 1 µm. Furthermore, we investigated various electron transport layers (ETLs) and found that the indium tin oxide (ITO) exhibited superior PV performances, boosting the PCE to ~ 12.6% due to its excellent conductivity and optimal energy band alignment with SNMO. These findings establish SNMO as a promising absorber material for environmentally friendly PSCs, paving the way for cheaper, simpler, scalable, and sustainable photovoltaic solutions. This work highlights the potential of HTL-free architectures to reduce costs and complexities while maintaining competitive efficiencies, marking a significant step forward in the development of lead-free solar technologies.

向可持续能源的过渡推动了对钙钛矿太阳能电池(PSCs)作为下一代光伏电池的有前途的候选者的广泛研究。尽管它们具有显著的效率,但由于铅毒性和材料不稳定性,PSCs的商业化仍然受到阻碍。在这项研究中,我们研究了一种无铅的钐基双钙钛矿氧化物Sm2NiMnO6 (SNMO)作为一种创新的倒置、空穴传输层(HTL)无PSC结构的活性吸收层。通过SCAPS-1D仿真,我们优化了器件配置,实现了10.93%的功率转换效率(PCE),开路电压(VOC)为0.8 V,短路电流密度(JSC)为16.46 mA cm−2,填充因子(FF)为82.14%。值得注意的是,增加SNMO吸收剂的厚度可以增强红色光谱区的光吸收,将外量子效率(EQE)峰从厚度为50 nm处的380 nm波长移动到厚度为1µm处的约620 nm。此外,我们研究了不同的电子传输层(etl),发现氧化铟锡(ITO)表现出优异的PV性能,由于其优异的导电性和与SNMO的最佳能带排列,PCE提高到~ 12.6%。这些发现确立了SNMO作为环境友好型psc的有前途的吸收材料,为更便宜、更简单、可扩展和可持续的光伏解决方案铺平了道路。这项工作强调了无html架构在保持竞争效率的同时降低成本和复杂性的潜力,标志着无铅太阳能技术的发展向前迈出了重要一步。
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引用次数: 0
Development of briquettes suitable for energy generation from residue of sorghum stalk and groundnut husk 高粱秸秆和花生壳渣发电用型煤的研制
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-05-24 DOI: 10.1007/s40243-025-00309-7
Godif Alene Geberehiet, Tesfaldet Gebregerges Gebreegziabher, Asmelash Gebrekidan Mekonen, Gebrehiwot Kunom Hagos, Tesfay Negassi Gebresilasie

Fossil fuels dominate the world's energy consumption, including transportation, chemicals, and materials generation. Conversely, using conventional energies has resulted in massive environmental damage and climate change. This study looks into developing briquettes from sorghum stalks and groundnut husks utilizing cow dung as a binder for fuel production using the low-pressure compaction method, an important renewable energy source. The briquettes were labeled with cow dung binder compositions (5–25%), ratios (75–95%), and particle sizes ranging from 1 to 3 mm. The raw materials were collected and cleaned, then sun-dried, followed by carbonized and ground using a mortar grinder. Design of Expert (DOE) software, Excel, and analysis of variance (ANOVA) were used to perform numerical and graphical data analyses. After briquetting, the proximate properties of the moisture content were 3.16%, fixed carbon 13.04%, volatile matter 80.20%, and ash 3.6%. The briquette had 51.56% carbon, 6.302% hydrogen, 0.0042% nitrogen, 42.134% oxygen, and 0.00093% sulfur. The calorific value of mixed briquettes varies from 20.08 to 24.36 MJ/kg. The maximum calorific value was achieved with a particle size of 1 mm and a 25% cow dung binder content, as a minimal particle size was preferred. According to the analysis, the created briquettes were smokeless, low in Ash content, and had a high Calorific value for burning above 17 MJ/kg for industrial driving and above 13 MJ/kg for household usage. The result of standardization on the diet of cow dung revealed that grain-fed dung offered a higher calorific value of 20 MJ/kg, while a higher shatter resistance of 90% was recorded using grass straw fed, which outlines the importance of diet on the efficiency of the binder. Developing briquettes from these biomasses can increase job prospects, decrease greenhouse gas emissions, and improve waste management.

Graphical Abstract

化石燃料主导着世界能源消费,包括运输、化工和材料生产。相反,使用传统能源导致了巨大的环境破坏和气候变化。本研究着眼于利用牛粪作为粘合剂,利用低压压实法(一种重要的可再生能源)开发高粱秸秆和花生壳的压块。用牛粪粘结剂组成(5-25%)、比例(75-95%)和颗粒大小(1 - 3mm)标记型煤。原料被收集和清洗,然后晒干,然后碳化,用砂浆研磨机研磨。采用Design of Expert (DOE)软件、Excel和方差分析(ANOVA)进行数值和图形数据分析。成型后的近似性能为水分3.16%、固定碳13.04%、挥发物80.20%、灰分3.6%。该型煤含碳51.56%、氢6.302%、氮0.0042%、氧42.134%、硫0.00093%。混合型煤的热值在20.08 ~ 24.36 MJ/kg之间。当颗粒尺寸为1毫米,牛粪粘合剂含量为25%时,热值达到最大值,因为最小颗粒尺寸是优选的。分析表明,该型煤无烟,灰分含量低,燃烧热值高,工业用燃烧热值在17 MJ/kg以上,家用燃烧热值在13 MJ/kg以上。对牛粪日粮的标准化结果表明,以谷物为饲料的牛粪提供了20 MJ/kg的高热值,而以稻草为饲料的牛粪具有高达90%的抗破碎性,这概述了日粮对粘合剂效率的重要性。从这些生物质中开发成型燃料可以增加就业前景,减少温室气体排放,并改善废物管理。图形抽象
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引用次数: 0
Natural porogens for manufacturing of materials for high-temperature fuel cell applications 用于制造高温燃料电池材料的天然孔隙剂
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-05-12 DOI: 10.1007/s40243-025-00306-w
Gabriela Komorowska, Julia Kosińska, Tomasz Wejrzanowski, Anna Czajka, Remigiusz Nowacki, Anita Wojciechowska, Agnieszka Jastrzębska

The cathode in a molten carbonate fuel cell (MCFC) was made using the tape casting method from a slurry with a suitable chemical composition consisting of porogen, allowing it to achieve a porous structure. Currently used porogens in creating cathode structures are synthetic polymers, which release hazardous substances into the environment during thermal removal. Therefore, it is very important to find a safer alternative before industrial production of fuel cells begins and reduce its impact on the environment. The research aimed to analyze the possibility of using various porogens to obtain a fuel cell's cathode microstructure and compare them to a reference cathode. The electrodes were produced using cheap, accessible, and natural porogens. Chosen porogens were post-production waste materials such as wheat straw, hemp, and beet pulp. They were used solo or coupled to create the cathode of MCFC, thoroughly characterized in the context of morphology, structure, and chemical composition. After optimization, final MCFC cathodes were characterized by SEM, Archimedes porosimetry, gas porosimetry, and gas permeability. The highest power density (100 mW/cm2) was obtained for the cathode, which was made with starch and straw, while starch and PVB enabled the achievement of 90 mW/cm2 of the MCFC cathode.

熔融碳酸盐燃料电池(MCFC)的阴极采用带式铸造方法,由含有多孔物质的合适化学成分的浆料制成,使其具有多孔结构。目前用于制造阴极结构的多孔材料是合成聚合物,在热去除过程中会释放有害物质到环境中。因此,在燃料电池开始工业化生产并减少其对环境的影响之前,找到一种更安全的替代品是非常重要的。该研究的目的是分析使用各种多孔材料获得燃料电池阴极微观结构的可能性,并将其与参考阴极进行比较。电极是用便宜、容易获得和天然的多孔素生产的。所选的破气孔剂是麦秸、大麻、甜菜浆等生产后废料。它们被单独或耦合用于制造MCFC阴极,并在形态、结构和化学成分方面进行了彻底的表征。优化后,采用SEM、阿基米德孔隙度法、气体孔隙度法和透气性对最终的MCFC阴极进行了表征。用淀粉和秸秆制备的MCFC阴极功率密度最高,为100 mW/cm2,而淀粉和PVB制备的MCFC阴极功率密度为90 mW/cm2。
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引用次数: 0
Enhanced proton conductivity of sulfonated poly(ether ether ketone) incorporating oxidized polyvinyl alcohol for high-performance proton exchange membranes 用于高性能质子交换膜的磺化聚(醚醚酮)与氧化聚乙烯醇结合增强质子传导性
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-04-24 DOI: 10.1007/s40243-025-00305-x
Mohamed A. Ben Ali, Mohamed A. Ben Moussa, Souhib Umer Ilyas, Rizwan Nasir, Dorra Ghorbel, Sherif M. A. S. Keshk

Alternative proton exchange membranes (PEMs) with high proton conductivity must be fabricated at reasonable costs to qualify as commercially used proton-exchange membrane fuel cells (PEMFCs). As a result, composite membranes containing sulfonated poly(ether ether ketone) (SPEEK) blended with various quantities of partially oxidized polyvinyl alcohol (OPVA) at 5 wt%, 10 wt%, and 20 wt% were developed for PEMs. At room temperature, the water uptake capacities of the SPEEK membranes containing 5, 10, and 20 wt% OPVA were 45%, 75%, and 109%, respectively. Correspondingly, the proton conductivities of SPEEK containing 5, 10, and 20 wt% OPVA were 22, 48, and 80 mS cm−1 at 110 °C, respectively. Compared with prestine SPEEK, OPVA/SPEEK have greater strength, stiffness, and thermal stability. The characterization results indicated that the strong hydrogen bond network that evolved between OPVA and SPEEK provided more jump sites for proton transfer. This study confirmed that OPVA/SPEEK membranes are effective as proton exchange membranes.

Graphical abstract

具有高质子导电性的替代质子交换膜(PEMs)必须以合理的成本制造才能成为商业使用的质子交换膜燃料电池(pemfc)。因此,采用磺化聚醚醚酮(SPEEK)与不同数量的部分氧化聚乙烯醇(OPVA)以5 wt%、10 wt%和20 wt%的比例共混的复合膜被开发用于PEMs。在室温下,含有5%、10%和20% OPVA的SPEEK膜的吸水率分别为45%、75%和109%。相应地,含有5%、10%和20% OPVA的SPEEK在110°C时的质子电导率分别为22、48和80 mS cm−1。与SPEEK相比,OPVA/SPEEK具有更高的强度、刚度和热稳定性。表征结果表明,OPVA和SPEEK之间形成的强氢键网络为质子转移提供了更多的跳跃位点。该研究证实了OPVA/SPEEK膜作为质子交换膜是有效的。图形抽象
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引用次数: 0
Correction: Carbon coated titanium dioxide (CC-TiO2) as an efficient anode material for sodium- ion batteries 更正:碳包覆二氧化钛(CC-TiO2)作为钠离子电池的有效阳极材料
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-04-17 DOI: 10.1007/s40243-025-00303-z
Rahul Kumar, Anagha Pradeep, Parag Bhargava
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引用次数: 0
Electrodeposition and characterization of C/Sn thin films as a high-performance anode for li-ion batteries: effect of pulsed electrodeposition parameters 高性能锂离子电池负极C/Sn薄膜的电沉积及表征:脉冲电沉积参数的影响
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-04-17 DOI: 10.1007/s40243-025-00302-0
R. Abdel-Karim, E. El-Sheikh, M. E. Mitwally

A two-step electrodeposition approach was applied to deposit Sn/C layers on a Ni foam substrate. The first step was the deposition of the Sn layer using two electrodeposition modes (direct and pulsed electrodeposition) with different parameters (duty cycle, time on/off, and effective time). The second step was to deposit carbon on the Sn layer by direct electrodeposition. The surface morphology, chemical composition, and phases of deposited layers were investigated and the electrochemical behavior of Sn/Ni and C/Sn/Ni anodes was characterized. The pulsed electrodeposition technique with a lower duty cycle (15% duty cycle with time ratio ton/off = 3/17 for 2 min) produced more uniform and compacted deposits, compared to the non-uniform and dendritic morphology obtained after high duty cycles (50%) as well as direct electrodeposition. After the direct electrodeposition of carbon on the pulsed electrodeposited Sn, a uniform layer containing ~ 10% C, 38% Sn, 45% Ni, and 7% O, was detected. Analysis of this layer confirmed the presence of Ni, Sn, and amorphous C. Electrochemical characterization showed that the C/Sn/Ni anodes with a 94 Ω polarization resistance, a 0.105 V/decade anodic Tafel slope and 0.202 V/decade cathodic Tafel slope manifested the highest apparent and intrinsic catalytic activities. The peak current for the C/Sn/Ni samples was higher than the peak current for the Sn/Ni samples at all scan rates, indicating higher electrochemical reactivity. The linear relationship between the peak current and the scan rate's square root suggests that diffusion controls the charge transfer process.

采用两步电沉积法在Ni泡沫衬底上沉积Sn/C层。第一步是使用两种电沉积模式(直接电沉积和脉冲电沉积)沉积锡层,这些电沉积模式具有不同的参数(占空比、开/关时间和有效时间)。第二步是直接电沉积法在锡层上沉积碳。研究了沉积层的表面形貌、化学成分和物相,表征了Sn/Ni和C/Sn/Ni阳极的电化学行为。与高占空比(50%)和直接电沉积获得的不均匀和树枝状形貌相比,较低占空比(15%占空比,时间比ton/off = 3/17,持续2分钟)的脉冲电沉积技术产生了更均匀和致密的镀层。将碳直接电沉积在脉冲电沉积锡表面后,可得到一层含~ 10% C、38% Sn、45% Ni和7% O的均匀层。电化学表征表明,C/Sn/Ni阳极的极化电阻为94 Ω,阳极Tafel斜率为0.105 V/ 10年,阴极Tafel斜率为0.202 V/ 10年,表现出最高的表观和本然催化活性。在所有扫描速率下,C/Sn/Ni样品的峰值电流均高于Sn/Ni样品的峰值电流,表明更高的电化学反应活性。峰值电流与扫描速率平方根之间的线性关系表明,扩散控制着电荷转移过程。
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引用次数: 0
An experimental and computational investigation of Thulium doped TiO2 as n-type material for potential application in bulk heterojunction organic solar cells 掺铥TiO2作为n型材料在体异质结有机太阳能电池中应用的实验和计算研究
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-03-28 DOI: 10.1007/s40243-025-00304-y
Dieketseng Tsotetsi, David O. Idisi, Nicholas Rono, Edson L. Meyer, Evans M. Benecha, Pontsho Mbule, Mokhotjwa Dhlamini

Solar energy harvesting and conversion has attracted a lot of scientific interest because solar energy is believed to be clean and sustainable. In this study, we report the synthesis of porous TiO2 by sol-gel method and later doped with Thulium rare earth ions (Tm3+) for potential application in organic solar cells as electron transport layers (ETL). Additionally, density functional theory (DFT) calculation was performed with CASTEP computational suite to explore further the optoelectronic and charge transfer mechanisms in the Tm(III)-doped TiO2 nanomaterials. Thereafter, the experimental material’s band gap values were extracted and used in the numerical simulation of the designed organic solar cell with a general configuration of FTO/TiO2/PBDB-T/ITIC/Cu2O/Ag, via SCAPS-1D numerical simulator. The experimental results showed a steady reduction in the band gap of TiO2 with increased Tm3+ doping. The electrical conductivity properties showed an enhanced feature when TiO2 was doped with Tm3+ nanoparticles. The calculated band gap from the density functional theory study shows a similar decreasing band gap trend with that of the experimental data, suggesting the transport properties from DFT are sufficient to describe the experimental data. The electronic transfer behaviour is analogous to metal-metal and metal-oxides transport features, which can be attributed to Ti – Tm and Tm – O – Ti hybridizations, as indicated in the orbital state alignment. The best performing modelled device with Tm(III)-doped TiO2 (1.0 mol%) as ETL attained a PCE of 21.83%, Voc of 1.54 V, Jsc of 31.87 mA cm− 2 and FF of 44.44% which was attributed to better charge transfer characteristics and effective band alignment between the ETL and absorber, thus, better efficiency. The study proposes that Tm(III)-doped TiO2 can act as a suitable n-type material that can propel the realisation of high-performance OSCs for commercialization in the future.

由于太阳能被认为是清洁和可持续的,太阳能的收集和转换已经引起了很多科学界的兴趣。在这项研究中,我们报道了通过溶胶-凝胶法合成多孔TiO2,然后掺杂铥稀土离子(Tm3+),用于有机太阳能电池的电子传输层(ETL)。此外,利用CASTEP计算套件进行密度泛函理论(DFT)计算,进一步探索Tm(III)掺杂TiO2纳米材料的光电和电荷转移机制。然后,提取实验材料的带隙值,并利用SCAPS-1D数值模拟器对设计的FTO/TiO2/PBDB-T/ITIC/Cu2O/Ag一般构型的有机太阳能电池进行数值模拟。实验结果表明,随着Tm3+掺杂量的增加,TiO2的带隙逐渐减小。在TiO2中掺杂Tm3+纳米粒子后,TiO2的电导率有所提高。密度泛函理论计算的带隙与实验数据的带隙减小趋势相似,表明DFT的输运性质足以描述实验数据。电子转移行为类似于金属-金属和金属-氧化物的输运特征,这可以归因于Ti - Tm和Tm - O - Ti杂化,如轨道态排列所示。以Tm(III)掺杂TiO2 (1.0 mol%)作为ETL的模型器件性能最好,PCE为21.83%,Voc为1.54 V, Jsc为31.87 mA cm - 2, FF为44.44%,这是由于ETL与吸收剂之间具有更好的电荷转移特性和有效的波段定向,因此效率更高。该研究提出,Tm(III)掺杂TiO2可以作为一种合适的n型材料,可以推动未来实现高性能OSCs的商业化。
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引用次数: 0
Improvement of the efficiency and stability of solar cells using grating and hole-transferring nickel oxide-graphene oxide double-layer 利用光栅和空穴转移氧化镍-氧化石墨烯双层提高太阳能电池的效率和稳定性
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-03-07 DOI: 10.1007/s40243-025-00301-1
Ali Farmani, Anis Omidniaee

This work improved energy efficiency, stability and energy stability in organic and organic perovskite solar cells, by using titanium dioxide as anti-reflective coating on silver. The use of graphene oxide-nickel oxide layer as a hole-transporting layer enhanced carrier mobility in addition to incrementing stability. The outcomes that have been meticulously extracted and analyzed from the finite-difference time-domain (FDTD) simulations provide compelling evidence that this particular methodology can be adeptly utilized to significantly enhance the capability to attain a remarkably broad absorption spectrum across a wide range of wavelengths, specifically those identified frorm 200 nm to 900 nm, which are of critical importance in solar cell applications. Optical analysis was conducted by Maxwell method. Dielectric plasmonic wire grating was proposed to increase optical absorbance and achieve maximum current. The electrical analysis of the structure was based on Poisson’s equations. Optical analysis of the inorganic halide perovskite revealed current density, open circuit voltage, fill factor, and power of 34.294 mA/cm2, 1.04 V, 0.83369817, and 1.64 mA/cm2. The energy conversion efficiency was also 29.3%.

本工作通过在银上使用二氧化钛作为抗反射涂层,提高了有机和有机钙钛矿太阳能电池的能效、稳定性和能量稳定性。使用氧化石墨烯-氧化镍层作为空穴传输层,除了增加稳定性外,还增强了载流子迁移率。从时域有限差分(FDTD)模拟中精心提取和分析的结果提供了令人信服的证据,表明这种特殊的方法可以熟练地用于显著增强在宽波长范围内获得非常宽的吸收光谱的能力,特别是那些从200 nm到900 nm的吸收光谱,这在太阳能电池应用中至关重要。采用麦克斯韦法进行光学分析。为了提高光吸光度,实现最大电流,提出了介质等离子体线光栅。结构的电分析是基于泊松方程的。光学分析显示,无机卤化物钙钛矿的电流密度、开路电压、填充系数和功率分别为34.294 mA/cm2、1.04 V、0.83369817和1.64 mA/cm2。能量转换效率为29.3%。
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引用次数: 0
Stability and charge transport analysis of high-performance PM6:Y7 nonfullerene organic solar cells using the metal–insulator–metal model 基于金属-绝缘体-金属模型的高性能PM6:Y7非富勒烯有机太阳能电池稳定性和电荷输运分析
IF 3.6 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-03-05 DOI: 10.1007/s40243-025-00300-2
Liliana Fernanda Hernández-García, Luis Reséndiz, Magaly Ramírez-Como, Angel Sacramento, Víctor Cabrera, Magali Estrada, Josep Pallarès, Lluis F. Marsal

Non-fullerene acceptors are promising materials for organic solar cells because of their flexibility and low cost; however, their long-term stability remains a critical challenge. In this study, we investigate the degradation mechanisms of conventionally structured solar cells (ITO/PEDOT: PSS/PM6/Y7/PDINO/Ag) under different environmental conditions: nitrogen preservation, encapsulation, and air exposure. Using the metal-insulator-metal (MIM) model, we simulate the current-voltage characteristics and extract key parameters to understand the physical mechanisms governing device degradation. The results show that air exposure primarily affects the anode interface, reducing the interfacial dipole energy and shifting the Fermi-level alignment of PEDOT: PSS, which is crucial for efficient hole extraction. This process leads to a deterioration in the hole transport properties over time, significantly affecting device performance. In contrast, the cathodic interface remains stable, suggesting that degradation is largely driven by changes in the hole transport layer. These findings provide critical insights into the interfacial degradation mechanisms of the NFA-based solar cells. Understanding these effects will aid in the development of strategies to enhance the stability and efficiency of organic photovoltaic devices for long-term operation.

非富勒烯受体因其灵活性和低成本而成为有机太阳能电池的重要材料;然而,它们的长期稳定性仍然是一个重大挑战。在这项研究中,我们研究了传统结构的太阳能电池(ITO/PEDOT: PSS/PM6/Y7/PDINO/Ag)在不同环境条件下的降解机制:氮气保存、封装和空气暴露。利用金属-绝缘体-金属(MIM)模型,我们模拟了电流-电压特性并提取了关键参数,以了解控制器件退化的物理机制。结果表明,空气暴露主要影响阳极界面,降低了界面偶极子能量,改变了PEDOT: PSS的费米能级排列,这对有效提取空穴至关重要。随着时间的推移,这一过程会导致空穴传输特性的恶化,从而严重影响器件的性能。相比之下,阴极界面保持稳定,这表明降解主要是由空穴传输层的变化驱动的。这些发现为nfa基太阳能电池的界面降解机制提供了重要的见解。了解这些影响将有助于制定策略,以提高有机光伏器件长期运行的稳定性和效率。
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Materials for Renewable and Sustainable Energy
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