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Maximizing sustainable bioethanol production from food waste: progress in diverse pretreatment methods and integration of artificial intelligence 最大限度地利用食物垃圾生产可持续的生物乙醇:不同预处理方法的进展和人工智能的整合
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-13 DOI: 10.1039/D5SE00985E
Kalaiselvan Narasimman, Aryan Pillai, Anugraha Anand, Ananya Pillai and Thangavel Mathimani

Multifarious food wastes can be transformed into renewable, decentralized biofuels through optimized bioprocessing. In this context, converting food waste into bioethanol provides a sustainable solution for both solid waste management and the energy crisis. Bioethanol from pretreated food waste produces minimal CO2 and CO emissions, making it a climate-positive alternative to fossil fuels. Therefore, this review critically focuses on maximizing bioethanol production from food waste polysaccharides by shedding light on the progress of different pretreatment methods in the anaerobic fermentation (AF) process. First, this review comprehensively addresses the current scenario of food waste accumulation in India and worldwide and its mitigation strategies. Further, it extensively discusses various pretreatment methods for food waste, such as physical, chemical, physiological, and biological processes, to understand contemporary accomplishments. The integration of artificial intelligence techniques, such as artificial neural networks (ANNs), in the food waste-based bioethanol production was discussed. A detailed case study of per-annual food waste accumulation at the Vellore Institute of Technology (VIT), India, is included for bioethanol production under various climatic conditions. Eventually, the valorization of food waste for sustainable bioethanol production and the utilization of genetically engineered microbial cells for bioethanol production and their technical hurdles are articulated.

通过优化的生物处理,各种食物垃圾可以转化为可再生的分散式生物燃料。在这种情况下,将食物垃圾转化为生物乙醇为固体废物管理和能源危机提供了一个可持续的解决方案。从预处理的食物垃圾中提取的生物乙醇产生的二氧化碳和一氧化碳排放量最少,使其成为化石燃料的一种对气候有益的替代品。因此,本文将重点介绍厌氧发酵(AF)过程中不同预处理方法的研究进展,以最大限度地利用食物垃圾多糖生产生物乙醇。首先,本综述全面论述了印度和世界范围内食物浪费积累的现状及其缓解战略。此外,它还广泛讨论了食物垃圾的各种预处理方法,如物理,化学,生理和生物过程,以了解当代的成就。讨论了人工神经网络等人工智能技术在食品垃圾生物乙醇生产中的应用。印度Vellore理工学院(VIT)对每年食物垃圾积累的详细案例研究包括在各种气候条件下生产生物乙醇。最后,阐述了利用食物垃圾生产可持续生物乙醇和利用基因工程微生物细胞生产生物乙醇及其技术障碍。
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引用次数: 0
Construction and photo-thermal extraction catalytic oxidative desulfurization performance of Mo6–Ti-MOFs/g-C3N4 heterojunction catalysts Mo6-Ti-MOFs /g-C3N4异质结催化剂的构建及光热萃取催化氧化脱硫性能
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-13 DOI: 10.1039/D5SE01007A
Wenwen Ma, Lu Chen, Kexin Liang, Linjiao Yang, Ruidan Wang, Dong Li, Danyi Zhang, Mingda Li, Lian Kong and Zhen Zhao

Novel Lindqvist-type polyoxometalate (POM)-based catalysts Mo6–NH2-MIL-125/g-C3N4 have been synthesized via a solvent evaporation method and applied in the photo-thermal extraction catalytic oxidative desulfurization system (PTECODS). The structure, composition, and morphology of the catalysts were characterized using various techniques, including X-ray diffraction (XRD), Fourier transform infrared (FT-IR) spectroscopy, scanning electron microscopy (SEM), transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS), N2 adsorption–desorption, UV-visible spectroscopy, and others. Mo6 was uniformly dispersed and acted as an electron acceptor, effectively suppressing the recombination of electron–hole pairs under light irradiation. In PTECODS, with 0.03 g Mo6–NH2-MIL-125/g-C3N4 photocatalysts (Ti : Mo molar ratio of 1 : 0.5), an O/S ratio of 6 : 1, and [Bmim]PF6 as the extraction agent, the conversion efficiency of DBT approached 100% within 60 min at 70 °C upon exposure to visible light irradiation. The synergistic interactions between Mo6–NH2-MIL-125 and g-C3N4 and also between photocatalysis and thermocatalysis contributed to the enhanced oxidative desulfurization performance. The catalysts could be recycled at least eight times without a noticeable decrease in catalytic activity. Finally, a thorough discussion of the potential mechanisms underlying the photo-thermal extraction catalytic oxidative desulfurization process is presented.

采用溶剂蒸发法合成了新型lindqvist型多金属氧酸盐(POM)基催化剂Mo6-NH2-MIL-125 /g-C3N4,并将其应用于光热萃取催化氧化脱硫系统(PTECODS)。采用x射线衍射(XRD)、傅里叶变换红外(FT-IR)光谱、扫描电子显微镜(SEM)、透射电子显微镜(TEM)、x射线光电子能谱(XPS)、N2吸附-解吸、紫外可见光谱等技术对催化剂的结构、组成和形貌进行了表征。Mo6均匀分散,充当电子受体,有效抑制光照射下电子-空穴对的复合。在PTECODS中,以0.03 g Mo6-NH2-MIL-125 /g- c3n4光催化剂(Ti: Mo摩尔比为1:5 .5)、O/S比为6:1、[Bmim]PF6为萃取剂,在70℃可见光照射下60 min内DBT的转化效率接近100%。Mo6-NH2-MIL-125与g-C3N4之间以及光催化与热催化之间的协同作用有助于提高氧化脱硫性能。催化剂可以循环使用至少8次,而催化活性没有明显下降。最后,对光热萃取催化氧化脱硫过程的潜在机理进行了深入的讨论。
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引用次数: 0
Feasibility of biofuel production from crop stubble/straw in Australia: challenges and opportunities 澳大利亚利用农作物残茬/秸秆生产生物燃料的可行性:挑战与机遇
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-13 DOI: 10.1039/D5SE00864F
M. A. Sattar, M. A. Hosen and M. Johnstone

This paper focuses on the feasibility of utilizing crop residues for biofuel production as a sustainable alternative, incorporating environmental benefits with renewable energy production. Crop stubble and straw management is a serious challenge in the world as well as in Australian agriculture. Retention and burning of crop residues are the main practices in Australia which have negative environmental consequences. This study explores technical, economic, and other challenges related to biofuel production, including feedstock collection, variability in crop residue composition, and infrastructure development. The opportunities to use Australia's abundant agricultural residues for biofuel production are critically reviewed in the context of practices and technologies. Different technological advancements in the transformation of crop residues (CRs) to biofuel are presented and analysed. The challenges and prospects of biofuel production from crop residues are discussed and analysed in this paper. From the literature, it is found that although challenges exist, investment in biofuel technology, infrastructure and supportive policies could change crop stubble from a waste product into a useful resource, fostering sustainable energy and agricultural practices in Australia. The utilisation of crop residues and biomass waste in Australia remains underdeveloped compared to global benchmarks but holds huge potential that can flourish with supportive policies and investment which can make Australia a regional leader in bioenergy. The adaptation of biofuel production from crop residues can alleviate negative sustainability implications of burning fossil fuels and support to achieve net zero 2050.

本文的重点是利用作物秸秆生产生物燃料的可行性,作为一种可持续的替代品,将环境效益与可再生能源生产相结合。农作物残茬和秸秆管理是世界以及澳大利亚农业面临的严峻挑战。在澳大利亚,作物残茬的保留和焚烧是对环境造成负面影响的主要做法。本研究探讨了与生物燃料生产相关的技术、经济和其他挑战,包括原料收集、作物残留物组成的可变性和基础设施发展。利用澳大利亚丰富的农业残留物生产生物燃料的机会在实践和技术的背景下进行了严格的审查。介绍并分析了作物残茬转化为生物燃料的不同技术进展。本文讨论和分析了利用作物残茬生产生物燃料的挑战和前景。从文献中,我们发现,尽管存在挑战,但对生物燃料技术、基础设施和支持性政策的投资可以将作物残茬从废物转变为有用的资源,促进澳大利亚的可持续能源和农业实践。与全球基准相比,澳大利亚的作物残茬和生物质废物的利用仍然不发达,但潜力巨大,可以通过支持性政策和投资蓬勃发展,使澳大利亚成为生物能源领域的区域领导者。适应从作物残茬生产生物燃料可以减轻燃烧化石燃料对可持续性的负面影响,并支持实现2050年的净零排放。
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引用次数: 0
Sustainable valorization of waste cooking oil via low-temperature transesterification using BaO/ZnO nanocatalyst: process optimization and mechanistic studies 用BaO/ZnO纳米催化剂低温酯交换处理废食用油:工艺优化及机理研究
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-13 DOI: 10.1039/D5SE00875A
Surajit Pradhan, Hiralal Pramanik and Yogesh Chandra Sharma

Biodiesel is widely regarded as a promising renewable energy source with minimal environmental impact. In our study, a novel catalyst, BaO/ZnO (BZO), was synthesized using a wet-impregnation method and used in biodiesel production from waste cooking oil. The synthesized catalysts were physico–chemically characterized using different analytical techniques, including TGA, XRD, FTIR, BET, XPS, HR-SEM, and HR-TEM. NMR analysis was employed to quantify the synthesized biodiesel. The Box–Behnken Design (BBD) model in the Response Surface Methodology (RSM) approach was implemented to optimize various reaction parameters involved in biodiesel production. The maximum biodiesel conversion of 97.3% and yield of 97.1% were obtained under optimized transesterification reaction conditions of 2.6 wt% catalyst loading at 39.9 °C reaction temperature with a MeOH to oil molar ratio of 10.9 : 1 for a reaction time of 29.8 min. In addition, the synthesized BZO catalyst was recyclable up to five times, suggesting higher catalytic efficacy and stability throughout the reaction. The turnover frequency of the proposed catalyst was found to be 15.52 h−1. Kinetic and thermodynamic studies revealed that the obtained values of activation energy (Ea), enthalpy of activation (ΔH#), and entropy of activation (ΔS#) were 37.64 kJ mol−1, 35.76 kJ mol−1, and −150.73 J mol−1 K−1, respectively. Moreover, various fuel properties like kinematic viscosity, calorific value, flash point, pour point, and cloud point were consistent with ASTM D-6751 international standards. A green metrics study demonstrates that the overall biodiesel production process is sustainable and environmentally friendly.

生物柴油被广泛认为是一种有前途的环境影响最小的可再生能源。本研究采用湿浸渍法合成了一种新型催化剂BaO/ZnO (BZO),并将其用于废食用油生产生物柴油。采用TGA、XRD、FTIR、BET、XPS、HR-SEM、HR-TEM等分析手段对合成的催化剂进行了理化表征。采用核磁共振分析对合成的生物柴油进行定量分析。采用响应面法(RSM)中的Box-Behnken设计(BBD)模型对生物柴油生产中涉及的各种反应参数进行了优化。优化反应条件为:催化剂用量为2.6 wt%,反应温度为39.9℃,甲醇与油的摩尔比为10.9:1,反应时间为29.8 min,转化率为97.3%,产率为97.1%。此外,合成的BZO催化剂可循环使用多达5次,表明在整个反应过程中具有较高的催化效率和稳定性。该催化剂的周转频率为15.52 h−1。动力学和热力学研究表明,得到的活化能(Ea)、活化焓(ΔH#)和活化熵(ΔS#)分别为37.64 kJ mol−1、35.76 kJ mol−1和- 150.73 J mol−1 K−1。此外,各种燃料特性,如运动粘度,热值,闪点,倾点和浊点符合ASTM D-6751国际标准。一项绿色指标研究表明,整个生物柴油生产过程是可持续和环保的。
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引用次数: 0
Advances and strategies in scalable coating techniques for flexible perovskite solar cells 柔性钙钛矿太阳能电池可扩展涂层技术的进展与策略
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-10 DOI: 10.1039/D5SE00873E
Hou-Chin Cha, Shih-Han Huang, Chia-Feng Li, Feng-Yu Tsai, Wei-Fang Su and Yu-Ching Huang

Perovskite solar cells (PSCs) have emerged as leading candidates for next-generation photovoltaics owing to their outstanding power conversion efficiencies (PCEs), low-cost materials, and compatibility with low-temperature, solution-based fabrication techniques. While certified PCEs of 27.0% have been reached on rigid substrates, transitioning to scalable, flexible architectures introduces new challenges. This review highlights recent advancements in flexible PSCs (F-PSCs), including the development of low-temperature-processed charge transport materials, flexible transparent electrodes, and encapsulation strategies that maintain mechanical robustness under deformation. Scalable deposition techniques, such as blade coating, slot-die coating, and spray coating, are also discussed, with respect to film uniformity, process control, and compatibility with roll-to-roll (R2R) manufacturing. The integration of solvent and additive engineering, along with interfacial modifications, is shown to be critical in optimizing film morphology and enhancing device performance. Notably, recent studies report flexible perovskite modules achieving PCEs exceeding 17% across active areas larger than 100 cm2. Beyond the PCE, this review addresses critical issues in ensuring long-term operational stability, including mechanical reliability and environmental degradation from moisture, oxygen, light, and thermal stress. Strategies such as multi-cation perovskite formulations, advanced interfacial modification, and high-barrier encapsulants are evaluated for their role in enhancing long-term operational stability. Finally, we provide a forward-looking perspective on the technical gaps and collaborative efforts required, across materials science, engineering, and industrial scale-up, to enable the commercial application of F-PSCs.

钙钛矿太阳能电池(PSCs)由于其出色的功率转换效率(pce)、低成本材料以及与低温、基于溶液的制造技术的兼容性,已成为下一代光伏电池的主要候选者。虽然在刚性基板上的认证pce达到了27.0%,但向可扩展、灵活的架构过渡带来了新的挑战。本文重点介绍了柔性PSCs (F-PSCs)的最新进展,包括低温加工电荷传输材料、柔性透明电极和在变形下保持机械坚固性的封装策略的发展。可扩展的沉积技术,如刀片涂层,槽模涂层和喷涂涂层,也讨论了关于薄膜均匀性,过程控制,以及与卷对卷(R2R)制造的兼容性。溶剂和添加剂工程的集成,以及界面修饰,被证明是优化膜形态和提高器件性能的关键。值得注意的是,最近的研究报告称,柔性钙钛矿组件在大于100平方厘米的活动区域内的pce超过17%。除了PCE,本综述还解决了确保长期运行稳定性的关键问题,包括机械可靠性和潮湿、氧气、光和热应力等环境退化问题。对多阳离子钙钛矿配方、高级界面改性和高阻隔封装剂等策略在提高长期运行稳定性方面的作用进行了评估。最后,我们对材料科学、工程和工业规模扩大所需的技术差距和合作努力提供了前瞻性的观点,以实现f - psc的商业应用。
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引用次数: 0
Quantitative sustainability assessment of e-fuels for maritime transport 海上运输用电子燃料的定量可持续性评估
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-10 DOI: 10.1039/D5SE00821B
Francesco Zanobetti, Andrea Bernardi, Gianmaria Pio, Diego Freire Ordóñez, David Danaci, Benoît Chachuat, Valerio Cozzani and Nilay Shah

Reducing the carbon intensity of maritime transport is essential to achieve global emission reduction targets. Electro-fuels (e-fuels) represent a promising cleaner alternative to conventional marine fossil fuels, offering potential lifecycle greenhouse gas reductions when synthesised from renewable electricity and low-carbon feedstocks. While techno-economic and environmental assessments of e-fuels exist, their broader sustainability implications, spanning technological, economic, environmental and safety factors together, remain largely unexplored. This study introduces a quantitative framework to assess the sustainability of ship fuel systems that integrates key performance indicators (KPIs) across these four areas. A case study is conducted to compare the sustainability of carbon-based e-fuels (e-methanol and e-diesel) and carbon-free e-fuels (hydrogen and ammonia) against marine diesel oil (MDO) under multiple decision-making perspectives. The robustness of the overall sustainability-based ranking of fuel alternatives, as derived under each perspective, against uncertainties in the individual KPIs is confirmed via sensitivity analysis. Environmental and safety aspects are found to be critical in comparing the sustainability of alternative fuels. Both e-methanol and e-diesel achieve higher overall sustainability than MDO, irrespective of the decision-making perspective. Ammonia and hydrogen are hindered by safety concerns in the short term, although ammonia also shows long-term potential for sustainable shipping subject to appropriate risk management and the implementation of inherently safer design measures. Overall, the proposed framework enables a comprehensive assessment of alternative fuel systems for cleaner shipping, guiding future sustainability-driven policy and technology development.

降低海上运输的碳强度对实现全球减排目标至关重要。电燃料(e-fuels)是传统海洋化石燃料的一种有前景的更清洁替代品,当由可再生电力和低碳原料合成时,可以提供潜在的生命周期温室气体减排。虽然对电动燃料进行了技术经济和环境评估,但其更广泛的可持续性影响,包括技术、经济、环境和安全因素,在很大程度上仍未得到探索。本研究引入了一个量化框架来评估船舶燃料系统的可持续性,该框架整合了这四个领域的关键绩效指标(kpi)。在多个决策视角下,对碳基电子燃料(e-甲醇和e-柴油)和无碳电子燃料(氢和氨)与船用柴油(MDO)的可持续性进行了案例研究。在每个角度下得出的基于可持续性的燃料替代品总体排名,相对于单个kpi的不确定性,其稳健性通过敏感性分析得到了证实。在比较各种替代燃料的可持续性时,环境和安全方面被认为是至关重要的。无论决策角度如何,e-甲醇和e-柴油的整体可持续性都高于MDO。氨和氢在短期内受到安全问题的阻碍,尽管在适当的风险管理和实施本质上更安全的设计措施的情况下,氨也显示出可持续航运的长期潜力。总的来说,拟议的框架能够全面评估替代燃料系统,以实现更清洁的航运,指导未来可持续发展驱动的政策和技术发展。
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引用次数: 0
Cation solvation engineering for enhanced CO2 electroreduction 强化CO2电还原的阳离子溶剂化工程
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-10 DOI: 10.1039/D5SE01163A
Haoran Zhang, Tianxiang Yan, Akhmat Fauzi, Jianlong Lin, Yaxin Jin, Yihan Xu, Zhanpeng Liang, Tribidasari A. Ivandini and Sheng Zhang

Electrochemical CO2 reduction (CO2RR) holds promise for carbon-neutral fuel production but is hindered by the competing hydrogen evolution reaction (HER) and slow kinetics. This study investigates how cationic solvation engineering with 18-crown-6 ether (18C6) impacts CO2RR by selectively coordinating potassium ions (K+). 18C6 disrupts the K+ hydration shell, shifting the proton source from water to bicarbonate, suppressing HER, and enhancing CO2RR. Experimental results show a 7.3-fold increase in CO faradaic efficiency (FE) with optimized 18C6 concentrations in 1 M KHCO3. The non-monotonic relationship between CO production rates and 18C6 concentration highlights the balance between water and bicarbonate protonation processes. In situ ATR-FTIR and Raman analyses reveal reduced water adsorption and enhanced carbonate interactions at the electrode interface. Temperature-dependent electrochemical impedance spectroscopy demonstrates a lowered desolvation energy barrier (83.4 vs. 32.1 kJ mol−1), indicating facilitated dehydration of solvated K+. This work provides insights into the mechanistic role of cationic solvation, offering a strategy for improving CO2RR efficiency.

电化学CO2还原技术(CO2RR)为碳中性燃料生产带来了希望,但受到析氢反应(HER)和慢动力学的阻碍。本研究考察了18冠-6醚(18C6)的阳离子溶剂化工程如何通过选择性配位钾离子(K+)影响CO2RR。18C6破坏K+水合壳,将质子源从水转移到碳酸氢盐,抑制HER,增强CO2RR。实验结果表明,在1 M KHCO3中,优化后的18C6浓度可使CO的法拉第效率(FE)提高7.3倍。CO产率与18C6浓度之间的非单调关系强调了水和碳酸氢盐质子化过程之间的平衡。原位ATR-FTIR和拉曼分析显示,电极界面上的水吸附减少,碳酸盐相互作用增强。温度相关的电化学阻抗谱显示了较低的脱溶能势阱(83.4 vs. 32.1 kJ mol−1),表明溶剂化的K+更容易脱水。这项工作为阳离子溶剂化的机理作用提供了见解,为提高CO2RR效率提供了策略。
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引用次数: 0
Ultrafast synthesis of NiCo alloy catalysts by Joule heating for the electrocatalytic hydrogen evolution reaction 焦耳加热超快合成镍合金催化剂的电催化析氢反应
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-09 DOI: 10.1039/D5SE01158B
Wence Ma, Zhiyuan Niu, Haidong Wang, Jinlong Li, Kaixin Zhu, Weiguang Ma and Xu Zong

Identifying effective synthesis strategies that can obtain high-performance electrocatalysts is pivotal to realizing a hydrogen economy. Nickel–cobalt (NiCo) alloy electrocatalysts are promising candidates for the hydrogen evolution reaction (HER), but the traditional approach for synthesizing NiCo alloy electrocatalysts is generally time-consuming, and the physiochemical features of the resulting NiCo are unsatisfactory. Herein, we report the ultrafast synthesis of NiCo alloy nanocatalysts with a Joule heating (JH) approach. We show that ultrasmall NiCo alloy nanoparticles that are uniformly and intimately distributed on carbon cloth can be obtained in just 0.6 seconds using the JH approach, while the NiCo catalysts prepared by traditional thermal treatment exhibit agglomerated and large particles. The as-prepared NiCo alloy electrocatalyst with JH shows favorable activity for the HER with low overpotentials of 83 and 220 mV to achieve current densities of 10 and 100 mA cm−2, respectively, outperforming the NiCo alloy electrocatalysts prepared using traditional approaches. Moreover, the NiCo alloy electrocatalyst maintains excellent stability during the long-term reaction for 200 h, demonstrating its potential for large-scale deployment.

确定能够获得高性能电催化剂的有效合成策略是实现氢经济的关键。镍钴(NiCo)合金电催化剂是析氢反应(HER)的理想催化剂,但传统的NiCo合金电催化剂合成方法耗时长,且所得NiCo的理化性质不理想。本文报道了用焦耳加热(JH)方法超快合成镍合金纳米催化剂。研究表明,采用JH方法可以在0.6秒内获得均匀且紧密分布在碳布上的超小型镍合金纳米颗粒,而传统热处理制备的镍合金催化剂则表现出团聚和大颗粒。用JH制备的NiCo合金电催化剂在83和220 mV的低过电位下表现出良好的HER活性,电流密度分别为10和100 mA cm−2,优于传统方法制备的NiCo合金电催化剂。此外,NiCo合金电催化剂在200 h的长时间反应中保持了优异的稳定性,显示了其大规模部署的潜力。
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引用次数: 0
Recent advances in transition metal dichalcogenide-based heterostructured materials for electrochemical water splitting applications 电化学水分解用过渡金属二硫族化合物异质结构材料的研究进展
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-08 DOI: 10.1039/D5SE00870K
Angappan Jayanthi and Subramaniam Jayabal

Exploring renewable and sustainable energy materials as substitutes for fossil fuels presents a promising approach for addressing global challenges such as energy scarcity and environmental degradation. Transition metal dichalcogenide (TMD)-based heterostructured materials have emerged as promising electrocatalysts, garnering increasing interest due to their high efficiency in the hydrogen evolution reaction (HER) and/or oxygen evolution reaction (OER). This review provides an outline of the current advancements in using TMD-based heterostructured materials as electrocatalysts for the HER and OER. We begin with a comprehensive introduction to the fundamentals of electrochemical water splitting, followed by an overview of various TMD-based heterostructure combinations, a summary of the different synthesis techniques, and a discussion of the characterization methods employed for these materials. Moreover, special attention is given to structure–performance relationship strategies aimed at enhancing the electrocatalytic activity and durability of TMD-based heterostructured materials for the HER and OER. Finally, we discuss the existing challenges and provide insights into future prospects for TMD-based heterostructured materials as electrocatalysts in water-splitting technologies.

探索可再生和可持续能源材料作为化石燃料的替代品,为解决能源短缺和环境退化等全球挑战提供了一种有希望的方法。基于过渡金属二硫化物(TMD)的异质结构材料已成为一种很有前途的电催化剂,由于其在析氢反应(HER)和析氧反应(OER)中的高效率而引起越来越多的关注。本文综述了基于tmd的异质结构材料作为HER和OER电催化剂的研究进展。我们首先全面介绍了电化学水分解的基本原理,然后概述了各种基于tmd的异质结构组合,总结了不同的合成技术,并讨论了用于这些材料的表征方法。此外,本文还特别关注了结构-性能关系策略,旨在提高基于tmd的异质结构材料在HER和OER中的电催化活性和耐久性。最后,我们讨论了目前存在的挑战,并展望了基于tmd的异质结构材料在水分解技术中作为电催化剂的未来前景。
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引用次数: 0
Computational modelling of metal-supported SOFCs: current approaches and future opportunities 金属支持sofc的计算建模:当前的方法和未来的机会
IF 4.1 3区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2025-10-08 DOI: 10.1039/D5SE01161B
Axel Savikko, Buse Bilbey and Muhammad Imran Asghar

Metal-supported solid oxide fuel cells (MS-SOFCs) have recently emerged as a promising configuration to reduce material costs and increase the mechanical robustness of solid oxide technologies. Recently, experimental research has focused on addressing fabrication challenges and degradation mechanisms. Computational modelling of MS-SOFCs remains limited, although there are potential benefits to simulation based analysis and optimization. This paper presents the current status of MS-SOFC research, with particular attention to support structures and degradation mechanisms. The paper also presents a foundation for modelling SOFCs at the cell scale, and highlights recent literature that could be adapted for MS-SOFC research. In addition to conventional computational modelling, the potential of data-driven methods such as surrogate models is reviewed for future work. This is the first focused review on computational approaches for MS-SOFCs, providing a foundation for future modelling and optimization of these emerging cell architectures.

金属支撑固体氧化物燃料电池(MS-SOFCs)最近成为一种很有前途的配置,可以降低材料成本,提高固体氧化物技术的机械稳健性。最近,实验研究的重点是解决制造挑战和降解机制。MS-SOFCs的计算建模仍然有限,尽管基于仿真的分析和优化有潜在的好处。本文介绍了MS-SOFC的研究现状,重点介绍了支撑结构和降解机制。本文还介绍了在细胞尺度上对sofc进行建模的基础,并强调了可用于MS-SOFC研究的最新文献。除了传统的计算建模,数据驱动的方法,如代理模型的潜力,为未来的工作进行了审查。这是对ms - sofc计算方法的首次重点回顾,为这些新兴细胞结构的未来建模和优化提供了基础。
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Sustainable Energy & Fuels
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