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PdO-resisted oxidation and enhanced hydration promotion of nitrogen electrooxidation to nitrate pdo抗氧化和增强水化促进氮电氧化成硝酸盐
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-03-01 Epub Date: 2025-09-12 DOI: 10.1016/j.esci.2025.100473
Tieliang Li , Chuanqi Cheng , Shuhe Han , Ying Gao , Kaiwen Yang , Bin Zhang , Yifu Yu
The electrocatalytic nitrogen oxidation reaction (NOR) provides a sustainable strategy for nitrate production. However, the challenges of inert nitrogen and competing oxygen evolution reaction severely limit NOR performance. To overcome these challenges, we propose a cooperative system of a superficially armed Pd@PdO electrocatalyst for NOR in a water-in-salt electrolyte. The thin PdO layer efficiently prevents the deep oxidation of Pd to PdO2, maintaining the high activity of NOR. Moreover, the water-in-salt electrolyte with a strengthened hydration effect weakens water activity and interrupts hydrogen-bond networks, thus retarding competitive oxygen evolution and accelerating the mass transfer of nitrogen. Therefore, the nitrate yield rate and Faradaic efficiency increase 2.3 and 14.4 times, respectively. Electrochemical in situ spectroscopies unveil the reaction mechanism of nitrogen electrooxidation over the Pd@PdO catalyst. This work provides a foundational strategy for the rational design of electrocatalysts and electrolytes aimed at efficient nitrate electrosynthesis.
电催化氮氧化反应(NOR)为硝酸盐生产提供了一种可持续的策略。然而,惰性氮和竞争性析氧反应的挑战严重限制了NOR的性能。为了克服这些挑战,我们提出了一种表面武装Pd@PdO盐包水电解质中NOR电催化剂的合作系统。薄的PdO层有效地防止了Pd深度氧化成PdO2,保持了NOR的高活性。此外,水合作用增强的盐中水电解质削弱了水的活度,破坏了氢键网络,从而延缓了竞争性氧的析出,加速了氮的传质。硝态氮产率和法拉第效率分别提高2.3倍和14.4倍。电化学原位光谱揭示了Pd@PdO催化剂上氮电氧化的反应机理。这项工作为合理设计电催化剂和电解质以实现高效的硝酸盐电合成提供了基础策略。
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引用次数: 0
30 years of AI for electrocatalysis: Where we are and what’s next? 人工智能电催化30年:我们在哪里,下一步是什么?
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-03-01 Epub Date: 2025-12-17 DOI: 10.1016/j.esci.2025.100515
Haotian Chen , Enno Kätelhön , Yuanyuan Lu , Jun Cheng , Zhong-Qun Tian , Richard G. Compton
Artificial Intelligence (AI) has evolved over the past three decades from the initial pioneering stage to become a transformative force in electrocatalytic research yet is far from realizing its full potential. This review traces foundational applications of AI to electrocatalysis in the 1990s to highlight the integration of AI into the full catalyst development workflow in the last five years, from material design and synthesis to characterization and performance evaluation, and ultimately to knowledge extraction. Emphasis is placed on critical but often partially recognized or neglected bottlenecks: the scale gap between atomistic simulations and macroscopic performance, inverse electrocatalyst design, physical consistency and interpretability of machine learning models, automated experiments, and the scarcity of high-quality, well validated experimental data. Cutting edge solutions such as exascale computing, machine learning interatomic potentials (MLIPs), physics-informed machine learning (PIML), generative models (variational autoencoders, diffusion models, and large language models), and FAIR-compliant data are discussed. This review highlights that the progress of AI for electrocatalysis is inherently data-centric, driven by advances in data-quality, FAIR-compliant infrastructure, and data-driven workflows that connect experiment, simulations, and machine learning. Beyond technical perspectives, this review also emphasizes the importance of interdisciplinary collaboration, industrial relevance, and cautions in respect of hyping. By identifying challenges and highlighting emerging breakthroughs, this work offers a roadmap for advancing AI-driven electrocatalysis towards more predictive, interpretable, and scalable discovery.
人工智能(AI)在过去三十年中从最初的先驱阶段发展成为电催化研究的变革力量,但远未充分发挥其潜力。本文回顾了20世纪90年代人工智能在电催化领域的基础应用,重点介绍了过去五年人工智能在催化剂开发工作流程中的整合,从材料设计和合成到表征和性能评估,最终到知识提取。重点放在关键但经常被部分认识或忽视的瓶颈上:原子模拟和宏观性能之间的尺度差距,反电催化剂设计,机器学习模型的物理一致性和可解释性,自动化实验,以及高质量,良好验证的实验数据的稀缺性。讨论了诸如百亿亿次计算、机器学习原子间势(MLIPs)、物理信息机器学习(PIML)、生成模型(变分自编码器、扩散模型和大型语言模型)和fair兼容数据等前沿解决方案。这篇综述强调了人工智能在电催化方面的进展本质上是以数据为中心的,这是由数据质量、符合fair标准的基础设施以及连接实验、模拟和机器学习的数据驱动工作流程的进步所驱动的。除了技术角度,这篇综述还强调了跨学科合作、工业相关性的重要性,并在炒作方面提出了警告。通过识别挑战和突出新兴突破,这项工作为推动人工智能驱动的电催化向更具预测性、可解释性和可扩展性的发现方向发展提供了路线图。
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引用次数: 0
Grain boundary hinge structure design for upcycling of cathode materials from spent lithium-ion batteries 废锂离子电池正极材料升级回收的晶界铰链结构设计
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-03-01 Epub Date: 2025-09-16 DOI: 10.1016/j.esci.2025.100476
Zitong Fei , Haocheng Ji , Enhua Dong , Liang Luo , Guanghui Jiang , Pengfei Yan , Qi Meng , Peng Dong , Guangmin Zhou , Yingjie Zhang
The recycling of spent lithium-ion batteries in a scientific and efficient manner is expected to address resource scarcity and reduce environmental pollution. Currently, conventional direct regeneration methods are difficult to simultaneously repair the particles, crystal structure, and interface of spent Lithium cobalt oxide (LCO) in three dimensions. This work adopts a "disintegrate-mend" reshaping approach to construct a localized heterogeneous hinge structure, grain boundary gradient crystal phases, and uniform polycrystalline particles, thereby achieving a unique structure for regenerated LCO materials. This design overcomes the limitations of uneven degradation in spent LCO, enhances the three-dimensional electron shuttle behaviour of the regenerated material, suppresses the redox activity of lattice oxygen, and optimizes spin-orbital coupling effects. Consequently, the regenerated LCO material demonstrates exceptionally high discharge capacity, with an initial discharge specific capacity of 228.94 mAh g−1. Moreover, the soft-packed batteries demonstrate outstanding cycle stability, with capacity retentions of 95.94% after 500 cycles.
科学高效地回收利用废旧锂离子电池有望解决资源短缺问题,减少环境污染。目前,传统的直接再生方法难以同时对废钴酸锂(LCO)的颗粒、晶体结构和界面进行三维修复。本工作采用“崩解-修补”重塑方法,构建局部非均质铰链结构、晶界梯度晶相、均匀多晶颗粒,从而实现再生LCO材料的独特结构。该设计克服了废LCO降解不均匀的局限性,增强了再生材料的三维电子穿梭行为,抑制了晶格氧的氧化还原活性,并优化了自旋轨道耦合效应。因此,再生LCO材料表现出异常高的放电容量,初始放电比容量为228.94 mAh g−1。此外,软包装电池表现出出色的循环稳定性,500次循环后容量保持率为95.94%。
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引用次数: 0
Bioinspired triboelectric-driven multisensory framework with autonomous cross-modal adaptation 具有自主跨模态适应的仿生摩擦电驱动多感官框架
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-03-01 Epub Date: 2025-10-09 DOI: 10.1016/j.esci.2025.100482
Yao Xiong , Yang Liu , Jiahong Yang , Mingxia Chen , Zhong Lin Wang , Qijun Sun
The human multisensory neural network supports advanced cognitive functions through cross-modal integration, recognition, and imagination by synergistically processing visual, tactile, auditory, olfactory, and gustatory stimuli. This biological mechanism generates comprehensive environmental representations through dynamic sensory interactions rather than isolated processing. In this study, a bioinspired multisensory framework is developed, integrating triboelectric sensors with artificial vision, tactile receptors, auditory interfaces, and simulated olfactory/gustatory modules. The system employs a distributed multisensory framework for biomimetic hierarchical processing of multimodal data perception, storage, and fusion. Through cross-modal learning, the system establishes effective associations among different sensory inputs, achieving 97.12% accuracy in tactile-visual recognition and 94.62% accuracy in auditory-visual-olfactory-gustatory reconfiguration. Beyond empirical learning, the framework also demonstrates non-empirical human-like cognitive functions, such as association, inference, and creative pattern generation. The proposed multisensory cross-modal system establishes a versatile framework with significant technological advantages of energy-efficient cognition, adaptive processing, and cognitive scalability. The bioinspired cross-modal reconfiguration combining with triboelectric sensing provides technical innovation and methodological impact to establishing new paradigm for energy-autonomy robotic perception.
人类多感觉神经网络通过协同处理视觉、触觉、听觉、嗅觉和味觉刺激,通过跨模态整合、识别和想象来支持高级认知功能。这种生物机制通过动态的感官互动而不是孤立的处理产生全面的环境表征。在这项研究中,开发了一个生物启发的多感官框架,将摩擦电传感器与人工视觉、触觉受体、听觉接口和模拟嗅觉/味觉模块集成在一起。该系统采用分布式多感官框架,对多模态数据感知、存储和融合进行仿生分层处理。通过跨模态学习,系统在不同的感官输入之间建立有效的关联,触觉-视觉识别的准确率达到97.12%,听觉-视觉-嗅觉-味觉重构的准确率达到94.62%。除了经验学习之外,该框架还展示了非经验的类人认知功能,如联想、推理和创造性模式生成。所提出的多感官跨模态系统建立了一个具有节能认知、自适应加工和认知可扩展性等显著技术优势的通用框架。结合摩擦电传感的仿生跨模态重构为建立能量自主机器人感知新范式提供了技术创新和方法上的影响。
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引用次数: 0
Relay orbital hybridization on MnMoO4 catalysts for durable lithium–oxygen batteries 耐用锂氧电池用MnMoO4催化剂的中继轨道杂化
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-03-01 Epub Date: 2025-06-18 DOI: 10.1016/j.esci.2025.100434
Yichuan Dou , Lanling Zhao , Jun Wang , Songze Li , Yiming Zhang , Ruifeng Li , Mingzhu Gao , Ce Zhang , Zaiping Guo
MnMoO4 holds great promise as a cathode material for lithium–oxygen batteries (LOBs), but its poor conductivity and weak interaction with oxygenated intermediates substantially impede its electrocatalytic properties. Herein, electron-deficient P atoms were incorporated with MnMoO4 hollow nanospheres (P-doped MnMoO4) to realize internal orbital interactions between Mo 4d and P 3p, activating external orbital hybridization between catalysts and LiO2 during cycling. This relay orbital hybridization not only promoted charge transfer but also optimized the adsorption and desorption abilities of catalysts toward LiO2, thereby reducing the reaction energy barriers. Consequently, LOBs with P-doped MnMoO4 cathode catalysts sustained steady operation for 380 cycles under 1000 mA g−1, which is even better than some of their noble metal counterparts and points to their commercial promise for use in future large-scale applications. This work provides general guidance for constructing relay orbital hybridization through P doping on catalysts for LOBs and other electrocatalytic systems.
作为锂氧电池(lob)的正极材料,MnMoO4具有很大的前景,但其导电性差和与含氧中间体的弱相互作用极大地阻碍了其电催化性能。本文将缺电子的P原子与MnMoO4空心纳米球(P掺杂MnMoO4)结合,实现了mo4d和p3p之间的内轨道相互作用,激活了催化剂与LiO2在循环过程中的外轨道杂化。这种接力轨道杂化不仅促进了电荷转移,而且优化了催化剂对LiO2的吸附和解吸能力,从而降低了反应能垒。因此,掺杂p的MnMoO4阴极催化剂的lob在1000 mA g−1下持续稳定运行380个循环,甚至比一些贵金属催化剂更好,并指出其在未来大规模应用中的商业前景。这项工作为通过在lob和其他电催化体系催化剂上掺杂P来构建接力轨道杂化提供了一般指导。
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引用次数: 0
Regulating lower hubbard band for tandem electrocatalytic lithium polysulfides conversion 串联电催化锂多硫化物转化的调节下轨带
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-01-01 Epub Date: 2025-11-11 DOI: 10.1016/j.esci.2025.100497
Pan Zeng , Wanhai Zhou , Bin Su , Yinqi Hu , ChengWei Du , Xiaoqin Li , Cheng Yuan , Genlin Liu , Xiaofeng Zhao , Wei Luo , Rajeev Ahuja , Qingyuan Wang , Dongliang Chao , Liang Zhang
Catalytic conversion of lithium polysulfides (LiPSs) is a promising avenue to suppress the shuttle effect and enhance the redox kinetics of lithium–sulfur (Li–S) batteries. However, the consecutive multiple LiPSs redox reactions make the activity prediction of electrocatalysts elusive. Herein, we propose a lower Hubbard band (LHB) descriptor to regulate tandem electrocatalytic LiPSs conversion for fast and robust Li–S batteries. Combined with theoretical calculations, the catalytic activity is jointly determined by the balance between LHB center position (ƐLHB) and LHB width (ꞷLHB). As a proof of concept, Fe3O4@FeP shows a balance of possessing a close ƐLHB to the Fermi level and a wide ꞷLHB simultaneously. An accelerated tandem electrocatalytic LiPSs conversion is achieved, where a close ƐLHB to Fermi level (with Fe3O4 as the active center) benefits the adsorption of long-chain LiPSs and catalyzes S8-to-Li2S4 process, while a wide ꞷLHB (with FeP as the active center) subsequently contributes to catalyze the Li2S4-to-Li2S reaction. Consequently, the elaborate Li–S batteries deliver outstanding cycle stability over 1000 cycles and superior rate performance over 10C. Further, the constructed Ah-scale pouch cell delivers notable energy density of 360.6 Wh kg−1. This work demonstrates the great promise of LHB regulation strategy for designing high-efficient electrocatalysts for Li–S batteries and beyond.
多硫化物锂(LiPSs)的催化转化是抑制穿梭效应和提高锂硫电池氧化还原动力学的一种很有前途的途径。然而,连续的多个LiPSs氧化还原反应使得电催化剂的活性难以预测。在此,我们提出了一个低哈伯德带(LHB)描述子来调节串联电催化lips转化,以实现快速和坚固的Li-S电池。结合理论计算,催化活性由LHB中心位置(ƐLHB)和LHB宽度(ꞷLHB)之间的平衡共同决定。作为概念证明,Fe3O4@FeP显示了同时拥有接近ƐLHB的费米能级和宽ꞷ的LHB的平衡。实现了一个加速的串联电催化LiPSs转化,其中接近ƐLHB费米能级(以Fe3O4为活性中心)有利于长链LiPSs的吸附并催化s8到li2s4的过程,而宽ꞷLHB(以FeP为活性中心)随后有助于催化li2s4到li2s的反应。因此,精心制作的Li-S电池在1000次循环以上提供出色的循环稳定性,在10C以上提供卓越的倍率性能。此外,构建的ah级袋状电池提供了360.6 Wh kg−1的显著能量密度。这项工作证明了LHB调节策略在设计Li-S电池及其他领域的高效电催化剂方面的巨大前景。
{"title":"Regulating lower hubbard band for tandem electrocatalytic lithium polysulfides conversion","authors":"Pan Zeng ,&nbsp;Wanhai Zhou ,&nbsp;Bin Su ,&nbsp;Yinqi Hu ,&nbsp;ChengWei Du ,&nbsp;Xiaoqin Li ,&nbsp;Cheng Yuan ,&nbsp;Genlin Liu ,&nbsp;Xiaofeng Zhao ,&nbsp;Wei Luo ,&nbsp;Rajeev Ahuja ,&nbsp;Qingyuan Wang ,&nbsp;Dongliang Chao ,&nbsp;Liang Zhang","doi":"10.1016/j.esci.2025.100497","DOIUrl":"10.1016/j.esci.2025.100497","url":null,"abstract":"<div><div>Catalytic conversion of lithium polysulfides (LiPSs) is a promising avenue to suppress the shuttle effect and enhance the redox kinetics of lithium–sulfur (Li–S) batteries. However, the consecutive multiple LiPSs redox reactions make the activity prediction of electrocatalysts elusive. Herein, we propose a lower Hubbard band (LHB) descriptor to regulate tandem electrocatalytic LiPSs conversion for fast and robust Li–S batteries. Combined with theoretical calculations, the catalytic activity is jointly determined by the balance between LHB center position (Ɛ<sub>LHB</sub>) and LHB width (ꞷ<sub>LHB</sub>). As a proof of concept, Fe<sub>3</sub>O<sub>4</sub>@FeP shows a balance of possessing a close Ɛ<sub>LHB</sub> to the Fermi level and a wide ꞷ<sub>LHB</sub> simultaneously. An accelerated tandem electrocatalytic LiPSs conversion is achieved, where a close Ɛ<sub>LHB</sub> to Fermi level (with Fe<sub>3</sub>O<sub>4</sub> as the active center) benefits the adsorption of long-chain LiPSs and catalyzes S<sub>8</sub>-to-Li<sub>2</sub>S<sub>4</sub> process, while a wide ꞷ<sub>LHB</sub> (with FeP as the active center) subsequently contributes to catalyze the Li<sub>2</sub>S<sub>4</sub>-to-Li<sub>2</sub>S reaction. Consequently, the elaborate Li–S batteries deliver outstanding cycle stability over 1000 cycles and superior rate performance over 10C. Further, the constructed Ah-scale pouch cell delivers notable energy density of 360.6 Wh kg<sup>−1</sup>. This work demonstrates the great promise of LHB regulation strategy for designing high-efficient electrocatalysts for Li–S batteries and beyond.</div></div>","PeriodicalId":100489,"journal":{"name":"eScience","volume":"6 1","pages":"Article 100497"},"PeriodicalIF":36.6,"publicationDate":"2026-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145842606","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Heartbeat electro-language: Exploring piezoelectric technologies for cardiovascular health monitoring 心跳电语言:探索压电技术用于心血管健康监测
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-01-01 Epub Date: 2025-06-05 DOI: 10.1016/j.esci.2025.100436
Yun Ke , Tong Li , Jun Li , Mingliang Pei , Xinming Wang , Weichang Xie , Shuting Zhuang , Xiaofeng Ye , Zhou Li , Zuankai Wang , Fan Yang
Cardiovascular diseases remain the leading cause of global morbidity and mortality, underscoring the urgent need for advanced technologies capable of continuous, noninvasive, and intelligent monitoring. Piezoelectric sensors, owing to their inherent electromechanical transduction, high sensitivity, and self-powered operation, offer a compelling pathway for next-generation cardiovascular health monitoring. In this review, we summarize recent advances in piezoelectric materials, from zero-to three-dimensional architectures, and their integration into wearable and implantable platforms. Key applications include the assessment of arterial health via pulse wave velocity and vascular stiffness, cuffless blood pressure estimation, and the monitoring of cardiopulmonary functions such as heart rate, respiratory rhythm, and cardiac acoustics. We also highlight emerging strategies such as passive wireless communication enabled by surface acoustic wave principles, and the development of multimodal systems that concurrently capture mechanical, optical, and chemical signals. The convergence of piezoelectric technologies with artificial intelligence and Internet of Things frameworks enables real-time signal processing, remote access, and personalized medical interventions. Finally, we discuss current challenges in material biocompatibility, encapsulation, signal fidelity, and clinical translation, and outline future directions for advancing high-performance piezoelectric systems for intelligent cardiovascular diagnostics and connected healthcare.
心血管疾病仍然是全球发病率和死亡率的主要原因,因此迫切需要能够进行持续、无创和智能监测的先进技术。压电传感器由于其固有的机电转导、高灵敏度和自供电操作,为下一代心血管健康监测提供了一个令人信服的途径。在这篇综述中,我们总结了压电材料的最新进展,从零到三维结构,以及它们与可穿戴和植入平台的集成。主要应用包括通过脉搏波速度和血管硬度评估动脉健康,无袖扣血压估计,以及监测心肺功能,如心率,呼吸节律和心脏声学。我们还强调了新兴的策略,如由表面声波原理实现的无源无线通信,以及同时捕获机械、光学和化学信号的多模态系统的发展。压电技术与人工智能和物联网框架的融合使实时信号处理、远程访问和个性化医疗干预成为可能。最后,我们讨论了目前在材料生物相容性、封装、信号保真度和临床翻译方面的挑战,并概述了用于智能心血管诊断和互联医疗的高性能压电系统的未来发展方向。
{"title":"Heartbeat electro-language: Exploring piezoelectric technologies for cardiovascular health monitoring","authors":"Yun Ke ,&nbsp;Tong Li ,&nbsp;Jun Li ,&nbsp;Mingliang Pei ,&nbsp;Xinming Wang ,&nbsp;Weichang Xie ,&nbsp;Shuting Zhuang ,&nbsp;Xiaofeng Ye ,&nbsp;Zhou Li ,&nbsp;Zuankai Wang ,&nbsp;Fan Yang","doi":"10.1016/j.esci.2025.100436","DOIUrl":"10.1016/j.esci.2025.100436","url":null,"abstract":"<div><div>Cardiovascular diseases remain the leading cause of global morbidity and mortality, underscoring the urgent need for advanced technologies capable of continuous, noninvasive, and intelligent monitoring. Piezoelectric sensors, owing to their inherent electromechanical transduction, high sensitivity, and self-powered operation, offer a compelling pathway for next-generation cardiovascular health monitoring. In this review, we summarize recent advances in piezoelectric materials, from zero-to three-dimensional architectures, and their integration into wearable and implantable platforms. Key applications include the assessment of arterial health via pulse wave velocity and vascular stiffness, cuffless blood pressure estimation, and the monitoring of cardiopulmonary functions such as heart rate, respiratory rhythm, and cardiac acoustics. We also highlight emerging strategies such as passive wireless communication enabled by surface acoustic wave principles, and the development of multimodal systems that concurrently capture mechanical, optical, and chemical signals. The convergence of piezoelectric technologies with artificial intelligence and Internet of Things frameworks enables real-time signal processing, remote access, and personalized medical interventions. Finally, we discuss current challenges in material biocompatibility, encapsulation, signal fidelity, and clinical translation, and outline future directions for advancing high-performance piezoelectric systems for intelligent cardiovascular diagnostics and connected healthcare.</div></div>","PeriodicalId":100489,"journal":{"name":"eScience","volume":"6 1","pages":"Article 100436"},"PeriodicalIF":36.6,"publicationDate":"2026-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145842682","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Achieving high-voltage polymer-based all-solid-state batteries based on thermodynamic and kinetic degradation insights 实现基于热力学和动力学降解的高压聚合物全固态电池
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-01-01 Epub Date: 2025-05-26 DOI: 10.1016/j.esci.2025.100433
Xiaoyan Yu , Yun Su , Hang Su , Ruizhi Liu , Jingyi Qiu , Xiayu Zhu , Rui Wen , Hao Zhang , Xiaohui Rong , Yong-Sheng Hu , Gaoping Cao
Understanding the mechanisms behind the degradation in cyclic stability of polymer-based all-solid-state batteries (ASSBs) at high voltages is important for facilitating their commercial application. Beyond the examination of specific material properties, from the perspectives of thermodynamic and kinetic factors, we find that the operating temperature critically influences the stability of the electrodes, electrolytes and electrode/electrolyte interfaces within the ASSBs. In this study, we constructed polymer-based ASSBs and comprehensively investigated the cyclic stability and changes in failure mechanisms with different operating temperatures at high voltages. Notably, a lower operating temperature enhanced the cyclic stability by suppressing structural collapse of the cathode and decomposition of the electrolytes while inhibiting lithium dendrites growth. The assembled lithium coin cells exhibited a superior capacity retention of 81.8% after 400 cycles at a voltage of 3.0–4.45 V and operating temperature of 40 °C. In addition, both lithium pouch cells and sodium coin cells were prepared and demonstrated excellent performances. This work provides a rational guide for the development of advanced polymer-based ASSBs.
了解聚合物基全固态电池(assb)在高压下循环稳定性下降背后的机制对于促进其商业应用非常重要。除了对特定材料性能的考察之外,从热力学和动力学因素的角度来看,我们发现工作温度对assb内电极、电解质和电极/电解质界面的稳定性有重要影响。在这项研究中,我们构建了基于聚合物的assb,并全面研究了在不同工作温度下的高压循环稳定性和失效机制的变化。值得注意的是,较低的工作温度通过抑制阴极的结构崩溃和电解质的分解而增强了循环稳定性,同时抑制了锂枝晶的生长。在3.0 ~ 4.45 V电压和40℃工作温度下,经过400次循环后,电池容量保持率高达81.8%。此外,还制备了锂袋电池和钠硬币电池,并表现出优异的性能。该工作为先进聚合物基assb的开发提供了合理的指导。
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引用次数: 0
Mutual stabilization of hybrid and inorganic perovskites for photovoltaics 光伏用杂化钙钛矿和无机钙钛矿的相互稳定
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-01-01 Epub Date: 2025-07-18 DOI: 10.1016/j.esci.2025.100449
Yuheng Li , Ziwei Zheng , Xin Zheng , Xiaoyuan Liu , Yingguo Yang , Yongcheng Zhu , Zaiwei Wang , Xingyu Ren , Mimi Fu , Rui Guo , Jing Guo , Zewen Xiao , Yaoguang Rong , Xiong Li
Stabilizing black-phase formamidinium lead triiodide (FAPbI3) is critical for high-performance perovskite solar cells (PSCs). We present a stabilization strategy utilizing co-evaporated cesium lead iodide (CsPbI3) capping layers. Enabled by favorable crystal lattice matching, cubic-phase CsPbI3 spontaneously forms on FAPbI3 surfaces, establishing mutual phase stabilization with the underlying black-phase FAPbI3. When combined with ammonium salt interface modification, the CsPbI3 interlayer effectively suppresses the ion (FA+ and F-PEA+) diffusion between the stacked perovskite layers. The FAPbI3/CsPbI3 bilayer structured devices exhibited a certified record reverse-scanning power-conversion efficiency of 27.17% and maintained a stabilized power output efficiency of 26.62%. Remarkably, the cells retain 93.5% of the initial efficiency after 1500 h damp-heat test, and retaining over 94.2% of its maximum PCE after about 1185 h with a linear extrapolation to a T90 of 2352 h operation under continuous illumination at maximum power point tracking at 85 °C.
稳定黑相三碘化甲脒铅(FAPbI3)是高性能钙钛矿太阳能电池(PSCs)的关键。我们提出了一种利用共蒸发铯碘化铅(CsPbI3)封盖层的稳定策略。由于有利的晶格匹配,立方相CsPbI3在FAPbI3表面自发形成,与底层的黑相FAPbI3建立了相互相稳定。当与铵盐界面改性结合时,CsPbI3夹层能有效抑制钙钛矿层间离子(FA+和F-PEA+)的扩散。FAPbI3/CsPbI3双层结构器件的反向扫描功率转换效率为27.17%,稳定功率输出效率为26.62%。值得注意的是,电池在1500 h湿热测试后保持了93.5%的初始效率,在大约1185 h后保持了超过94.2%的最大PCE,线性外推到在85°C的最大功率点跟踪下连续照明下运行2352 h的T90。
{"title":"Mutual stabilization of hybrid and inorganic perovskites for photovoltaics","authors":"Yuheng Li ,&nbsp;Ziwei Zheng ,&nbsp;Xin Zheng ,&nbsp;Xiaoyuan Liu ,&nbsp;Yingguo Yang ,&nbsp;Yongcheng Zhu ,&nbsp;Zaiwei Wang ,&nbsp;Xingyu Ren ,&nbsp;Mimi Fu ,&nbsp;Rui Guo ,&nbsp;Jing Guo ,&nbsp;Zewen Xiao ,&nbsp;Yaoguang Rong ,&nbsp;Xiong Li","doi":"10.1016/j.esci.2025.100449","DOIUrl":"10.1016/j.esci.2025.100449","url":null,"abstract":"<div><div>Stabilizing black-phase formamidinium lead triiodide (FAPbI<sub>3</sub>) is critical for high-performance perovskite solar cells (PSCs). We present a stabilization strategy utilizing co-evaporated cesium lead iodide (CsPbI<sub>3</sub>) capping layers. Enabled by favorable crystal lattice matching, cubic-phase CsPbI<sub>3</sub> spontaneously forms on FAPbI<sub>3</sub> surfaces, establishing mutual phase stabilization with the underlying black-phase FAPbI<sub>3</sub>. When combined with ammonium salt interface modification, the CsPbI<sub>3</sub> interlayer effectively suppresses the ion (FA<sup>+</sup> and F-PEA<sup>+</sup>) diffusion between the stacked perovskite layers. The FAPbI<sub>3</sub>/CsPbI<sub>3</sub> bilayer structured devices exhibited a certified record reverse-scanning power-conversion efficiency of 27.17% and maintained a stabilized power output efficiency of 26.62%. Remarkably, the cells retain 93.5% of the initial efficiency after 1500 h damp-heat test, and retaining over 94.2% of its maximum PCE after about 1185 h with a linear extrapolation to a <em>T</em><sub>90</sub> of 2352 h operation under continuous illumination at maximum power point tracking at 85 °C.</div></div>","PeriodicalId":100489,"journal":{"name":"eScience","volume":"6 1","pages":"Article 100449"},"PeriodicalIF":36.6,"publicationDate":"2026-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145799745","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Photo-electroactive p-n heterojunction catalyst with dual Co sites for high-performance light-enhanced zinc–air batteries 高性能光增强锌空气电池用双Co位光电活性p-n异质结催化剂
IF 36.6 Q1 ELECTROCHEMISTRY Pub Date : 2026-01-01 Epub Date: 2025-07-03 DOI: 10.1016/j.esci.2025.100450
Tuo Lu , Nengneng Xu , Benji Zhou , Liyuan Guo , Xiaodan Wen , Shuaifeng Lou , Guicheng Liu , Woochul Yang , Nianjun Yang , Momo Safari , Haitao Huang , Jinli Qiao
Highly electrocatalytic and durable Co-Nx-C frameworks containing carbon nanofibers (CNFs)/carbon nitrides (CNs) are vital materials for rechargeable zinc–air batteries (RZABs). However, the existing Co-Nx-C frameworks experience severe agglomeration during synthesis and limited active site accessibility/mechanical robustness. In this work, a photo-enhanced bifunctional catalyst with a type II p-n heterojunction (g–C3N4–Co@CNT/Co–N4/C@CNF) is achieved through a combined “electrospinning + calcination + ball milling” approach. The composite integrates graphitic carbon nitride (g-C3N4) nanosheets with dual active Co sites (nanoparticles and Co–N4 single atoms) anchored on conductive carbon nanofibers. This architecture enables efficient charge separation, enhanced light absorption, and accelerated oxygen redox kinetics. DFT calculations reveal that g-C3N4 modulates the electronic structure and lowers the reaction free-energy barriers, leading the d-band center closer to the Fermi level. Under light irradiation, the g–C3N4–Co@CNT/Co–N4/C@CNF exhibits outstanding ORR/OER catalytic performance, with a small overpotential gap of 0.684 V (E1/2 = 0.930 V, Ej:10 = 1.614 V). In practical application: 1) light-enhanced liquid ZABs with g–C3N4–Co@CNT/Co–N4/C@CNF photoactive catalysts manifest a peak power density of 310 mW cm−2 and a long cycle life exceeding 1100 h. 2) Light-enhanced flexible ZABs also can reach a peak power density of 96 mW cm−2 and tolerate a wide range of bending angles (0°–180°–0°) during harsh operation. This work offers a new platform for designing efficient photo-electrocatalysts and advancing next-generation solar–electrochemical energy conversion systems.
含有碳纳米纤维(CNFs)/碳氮化物(CNs)的高电催化和耐用的Co-Nx-C框架是可充电锌空气电池(RZABs)的重要材料。然而,现有的Co-Nx-C框架在合成过程中存在严重的团聚现象,并且活性位点可及性/机械稳健性有限。在这项工作中,通过结合“静电纺丝+煅烧+球磨”的方法,获得了具有II型p-n异质结(g-C3N4 - Co@CNT/ Co-N4 /C@CNF)的光增强双功能催化剂。该复合材料将石墨氮化碳(g-C3N4)纳米片与双活性Co位点(纳米颗粒和Co - n4单原子)固定在导电碳纳米纤维上。这种结构可以实现有效的电荷分离,增强光吸收和加速氧氧化还原动力学。DFT计算表明,g-C3N4调节了电子结构,降低了反应的自由能垒,使d带中心更接近费米能级。在光照射下,g-C3N4 - Co@CNT/ Co-N4 /C@CNF表现出优异的ORR/OER催化性能,过电位间隙很小,为0.684 V (E1/2 = 0.930 V, Ej:10 = 1.614 V)。在实际应用中:1)g-C3N4 - Co@CNT/ Co-N4 /C@CNF光活性催化剂的光增强液体ZABs的峰值功率密度为310 mW cm - 2,循环寿命超过1100 h。2)光增强柔性ZABs的峰值功率密度也可达到96 mW cm - 2,并且在恶劣的工作条件下可以承受大范围的弯曲角(0°- 180°- 0°)。这项工作为设计高效的光电催化剂和推进下一代太阳能-电化学能量转换系统提供了新的平台。
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