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In Situ Growth of Highly Porous Zeolitic-Imidazolate Frameworks-8 on Copolymer Derived Carbon for High-Performance Supercapacitor 高性能超级电容器用高孔沸石-咪唑酸骨架-8在共聚物衍生碳上原位生长
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-27 DOI: 10.1002/batt.202500477
Pinky Saharan, Mandeep Singh, Chandan Kumar, Shashank Sundriyal, Sanjay R. Dhakate

Zeolitic-imidazolate frameworks (ZIFs) are gaining widespread attention in energy storage research owing to their high porosity, structure tailorability, and multiple reaction sites. However, their very low inherent electrical conductivity limits their pristine usage in supercapacitors. Therefore, a promising way is to integrate ZIFs with suitable conductive materials, which can help to provide additional conductive pathways, thereby promoting fast charge transfer. In this work, a strategy is proposed to improve the conductivity of ZIF-8 by incorporating it with PANI-PPy conducting copolymer-derived carbon (CoP@C). The prepared ZIF-8/CoP@C composite possesses nitrogen units (pyridinic-N, graphitic-N, and pyrrolic-N) that enhance its electronic conductivity and provide additional pseudo-capacitance. In a three-electrode setup with 1 M H2SO4 electrolyte, the ZIF-8/CoP@C composite electrode demonstrated the highest specific capacitance of 247.9 F g−1, which is much higher than the pristine ZIF-8 electrode (72.1 F g−1) at 1 A g−1. Furthermore, the ZIF-8/CoP@C electrodes were employed to construct an aqueous symmetrical supercapacitor that delivers a high energy density of 25.7 Wh kg−1 and a power density of 402.1 W kg−1, along with prolonged cyclic stability of 92.9% after 10 000 charge–discharge cycles. This study introduces a benchmark for employing conducting copolymers to elevate the electrochemical performance of different ZIFs/MOFs in supercapacitors.

沸石-咪唑盐框架(ZIFs)因其高孔隙率、结构可定制性和多反应位点等优点在储能研究中受到广泛关注。然而,它们非常低的固有导电性限制了它们在超级电容器中的原始使用。因此,一种很有前途的方法是将zif与合适的导电材料集成,这有助于提供额外的导电途径,从而促进快速电荷转移。在这项工作中,提出了一种通过将ZIF-8与聚苯胺-聚吡啶导电共聚物衍生碳结合来提高其导电性的策略(CoP@C)。所制备的ZIF-8/CoP@C复合材料具有氮单元(吡啶- n、石墨- n和吡啶- n),可提高其电子导电性并提供额外的伪电容。在含1 M H2SO4电解液的三电极条件下,ZIF-8/CoP@C复合电极的比电容最高,为247.9 F g−1,远高于原始ZIF-8电极在1 a g−1时的72.1 F g−1。此外,利用ZIF-8/CoP@C电极构建了一个水对称超级电容器,该电容器具有25.7 Wh kg - 1的高能量密度和402.1 W kg - 1的功率密度,并在10,000次充放电循环后具有92.9%的长周期稳定性。本研究为利用导电共聚物提高不同zif / mof在超级电容器中的电化学性能提供了一个基准。
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引用次数: 0
Comprehensive Analysis of Float Current Behavior and Calendar Aging Mechanisms in Lithium-Ion Batteries 锂离子电池浮子电流行为及日历老化机理综合分析
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-22 DOI: 10.1002/batt.202500349
Mohamed Azzam, Dirk-Uwe Sauer, Christian Endisch, Meinert Lewerenz

Aiming to quantify degradation currents from solid electrolyte interphase formation () and gain of active lithium due to cathode lithiation (), resulting from electrolyte decomposition, the float current behavior of lithium-ion batteries is investigated with different cathode materials. The float current, , represents the recharge current required to maintain the cell at a fixed potential during calendar aging. This current arises as lithium is irreversibly consumed at the anode or inserted into the cathode, shifting the electrode potentials. To account for the asymmetric response of the electrodes, a voltage-dependent scaling factor, , is introduced, derived from the slopes of the electrode-specific voltage curves. Using this factor in combination with measured float currents and capacity loss rates from check-up tests, and is quantified at 30 °C across various float voltages. Although the and capacity data are limited to 30 °C, the model is extended to a range of 5–50 °C using only float current measurements. The results show that using capacity loss rates alone underestimate and that , contributes significantly to the observed float current at elevated voltages, indicating that cathode lithiation plays an increasingly important role in high-voltage calendar aging.

为了量化固体电解质间相形成的降解电流()和电解质分解导致的阴极锂化()的活性锂增益(),研究了不同正极材料下锂离子电池的浮子电流行为。浮动电流表示在日历老化期间将电池保持在固定电位所需的充电电流。当锂在阳极被不可逆地消耗或插入阴极时,这种电流就会产生,从而改变电极电位。为了解释电极的不对称响应,引入了电压相关的比例因子,该比例因子来源于电极特定电压曲线的斜率。将该系数与检查测试中测量的浮子电流和容量损失率相结合,并在30°C下对各种浮子电压进行量化。虽然和容量数据仅限于30°C,但该模型仅使用浮子电流测量扩展到5-50°C的范围。结果表明,单独使用容量损耗率对高压下观察到的浮子电流有显著影响,表明阴极锂化在高压日历老化中起着越来越重要的作用。
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引用次数: 0
Unveiling the Importance of Solid−Liquid Interphase for the Development of All Solid-State Sodium Metal Batteries 揭示固液界面对全固态钠金属电池发展的重要性
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-21 DOI: 10.1002/batt.202500408
Rahul Singh,  Tushar, Vineeth Sasikumar Kala, Md Osama Zubair, Chhail Bihari Soni,  Sungjemmenla, Mahesh Chandra, Kamlesh Kumar, Kundan Kumar Mishra, Vipin Kumar

Solid-state sodium batteries (SSSBs) offer high energy density with improved safety, making them an appealing candidate for long-range mobility applications. Considering the advances in SSSBs, ionic conduction is no longer a critical barrier. However, the instability of the electrode/electrolyte interface remains a hurdle, limiting cycling stability and cathode utilization. The compatibility between the electrode/electrolyte is often established by a small amount of liquid/polymer electrolyte. The solid–liquid interphase (SOLI) instead of the solid–solid interface plays a crucial role in deciding the performance of SSSBs. SOLI is a key component of the existing SSSBs, facilitating ion transport while mitigating interfacial resistance. The intricate, but essential, characteristics of SOLI, namely the composition, distribution, and ionic properties of the interfaces, are highlighted. This review highlights the key design strategies for optimizing the SOLI, including electrolyte engineering, interphase material selection, and the use of multiphase interphases to balance cell performance. Moreover, advanced characterization techniques are discussed, along with recent breakthroughs in SOLI research. This review aims to provide insights into overcoming the challenges of SOLI to enhance the electrochemical performance and long-term stability of SSSBs. A thorough understanding of SOLI engineering will pave the way for practical, safe, and long-lasting high-performance SSSBs.

固态钠电池(SSSBs)提供高能量密度和更高的安全性,使其成为远程移动应用的有吸引力的候选者。考虑到SSSBs的进展,离子传导不再是一个关键的障碍。然而,电极/电解质界面的不稳定性仍然是一个障碍,限制了循环稳定性和阴极利用率。电极/电解质之间的相容性通常通过少量的液体/聚合物电解质来建立。固液界面(SOLI)取代固-固界面对SSSBs的性能起着至关重要的作用。SOLI是现有SSSBs的关键组成部分,促进离子传输,同时减轻界面阻力。复杂的,但必不可少的,特点的SOLI,即组成,分布,和离子性质的界面,强调。这篇综述强调了优化SOLI的关键设计策略,包括电解质工程,间相材料选择,以及使用多相间相来平衡电池性能。此外,还讨论了先进的表征技术,以及SOLI研究的最新突破。本文旨在为克服SOLI的挑战,提高SSSBs的电化学性能和长期稳定性提供见解。对SOLI工程的深入了解将为实用、安全、持久的高性能sssb铺平道路。
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引用次数: 0
Carbon-Based Electrodes: Harnessing Organic Compound Oxidation for Sustainable Redox Flow Batteries 碳基电极:利用有机化合物氧化可持续氧化还原液流电池
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-21 DOI: 10.1002/batt.202500359
Zheng Tang, Yifan Zhang, Wulin Yang, Zipeng Zhao, Jincai Zhao

Carbon-based materials, due to their natural abundance, high conductivity, tunable surface chemistry, and good stability, have emerged as a material choice in the electrochemical advanced oxidation processes (EAOPs) for catalytic degradation of organic compounds. Recent progress is summarized from the perspective of materials design and engineering. Specifically, the fundamental mechanisms underlying EAOPs are introduced, with a focus on the activation of hydrogen peroxide, peroxymonosulfate, and peroxydisulfate to generate reactive species essential for organic contaminants degradation in wastewater. Additionally, various materials engineering strategies and their associated structure-property relationships are examined, including the optimization of morphology, surface functional group modification, and elemental doping. The reviewed materials are categorized based on their suitability for specific applications, such as electro-Fenton, heterogeneous electro-Fenton, and nonelectro-Fenton processes. Furthermore, strategies for enhancing the overall performance of EAOP systems are discussed, including the design of bipolar electrodes and the integration of external fields, such as microwaves, to accelerate EAOP reactions through the modulation of electrode potentials. Finally, the perspective outlines the opportunities, challenges, and future directions of carbon-based materials in the catalytic field of EAOPs. In addition, the perspective examines the potential and hurdles of carbon-based electrodes in sustainable redox flow batteries, outlining pathways toward efficient, sustainable water treatment.

碳基材料因其天然丰度高、导电性好、表面化学性质可调、稳定性好等优点,已成为电化学高级氧化过程(EAOPs)催化降解有机化合物的材料选择。从材料设计和工程的角度综述了近年来的研究进展。具体来说,介绍了EAOPs的基本机制,重点介绍了过氧化氢、过氧单硫酸根和过氧二硫酸根的活化,以产生降解废水中有机污染物所必需的活性物质。此外,还研究了各种材料工程策略及其相关的结构-性能关系,包括形态优化,表面官能团修饰和元素掺杂。所审查的材料根据其特定应用的适用性进行分类,例如电fenton,异质电fenton和非电fenton工艺。此外,还讨论了提高EAOP系统整体性能的策略,包括双极电极的设计和外场(如微波)的集成,通过电极电位的调制来加速EAOP反应。最后,展望了碳基材料在EAOPs催化领域的机遇、挑战和未来发展方向。此外,展望研究了碳基电极在可持续氧化还原液流电池中的潜力和障碍,概述了高效、可持续水处理的途径。
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引用次数: 0
Tailoring Carbon Microcrystals for Ultrafast Lithium Storage 用于超快锂存储的定制碳微晶体
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-21 DOI: 10.1002/batt.202500370
Feifei Mao, Xiangyang Kong, Shasha Gao, Penggao Liu, Yong-Zheng Fang, Zhen Zhou

The demand for high energy density, fastcharging capability,and extended working life is crucial for next-generation lithium-ion batteries (LIBs) employed in consumer-grade electronic devices and electric vehicles.However, the presently utilized graphite anode exhibits sluggish ion kinetics and limited specific capacity owing to its fixed crystal structure and restricted interlayer distance. Herein, a large-size cation shear strategy for regulating carbon crystals is demonstrated. During the carbonization process, the shuttling of cations within the carbon skeleton inhibits the horizontal growth and longitudinal stacking of the carbon crystals, thereby successfully synthesizing ultramicrocrystalline carbon with short-range order and abundant microporous structures. As a result of the optimized carbon lattices, Li-ion insertion mechanism and dynamics are greatly improved, exhibiting a super high Li-storage capacity of 1156 mAh g−1 at 0.1 A g−1 (three times that of graphite theoretical capacity) and excellent rate capability with 375 mAh g−1 maintained at 6 A g−1 (100% graphite theoretical capacity). The assembled LiNi6Co2Mn2-based full batteries achieve excellent fast charging capability and long cycle stability, with a 92% energy retention rate after 500 cycles. This carbon crystal regulation strategy demonstrates great potential for developing advanced carbon-based LIBs with high power and high energy.

对于用于消费级电子设备和电动汽车的下一代锂离子电池(lib)来说,高能量密度、快速充电能力和延长工作寿命的需求至关重要。然而,目前使用的石墨阳极由于其固定的晶体结构和层间距离的限制,离子动力学缓慢,比容量有限。本文展示了一种用于调节碳晶体的大尺寸阳离子剪切策略。在炭化过程中,碳骨架内阳离子的穿梭抑制了碳晶体的水平生长和纵向堆积,从而成功合成了具有短程有序和丰富微孔结构的超微晶碳。优化后的碳晶格大大改善了锂离子的插入机制和动力学,在0.1 ag−1时具有1156 mAh g−1的超高锂存储容量(是石墨理论容量的3倍),在6 ag−1时具有375 mAh g−1的优异倍率容量(100%石墨理论容量)。组装的lini6co2mn2基全电池具有优异的快速充电能力和长周期稳定性,500次循环后能量保留率达到92%。这种碳晶体调控策略为开发高功率、高能量的先进碳基锂离子电池显示了巨大的潜力。
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引用次数: 0
Solvent-Free Mechano-Thermal Synthesis of a Li-Zn Phosphonate Cathode Framework 磷酸锂锌阴极骨架的无溶剂机械热合成
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-21 DOI: 10.1002/batt.202500426
Augustin Ramackers, Darsi Rambabu, Tom Goossens, Vasudeva Rao Bakuru, Petru Apostol, Robert Markowski, Géraldine Chanteux, Andrii Kachmar, Viliam Frano, Guillaume Esser, Nicolas Malherbe, Yan Zhang, Fabio Lucaccioni, Yaroslav Filinchuk, Alexandru Vlad

A key challenge in synthesizing alkali-ion metal–organic frameworks (MOFs) lies in the multistep procedures typically required, often involving solvothermal crystallization, desolvation, post-synthetic alkali-metalation, and controlled drying. To address this, a solvent-free mechano-thermal method is reported that combines solid-state grinding of precursors with thermal annealing under vacuum. This direct, scalable route offers a more sustainable alternative while enabling stoichiometric precision. We demonstrate this approach for the synthesis of Li4-Zn-p-DOBDP_mt (LZP3; p-DOBDP6− = 2,5-dioxido-1,4-benzenediphosphate), in which lithium is incorporated during MOF formation. The resulting material exhibits better crystallinity compared to its conventionally synthesized counterpart and retains its key functional properties, including a reversible capacity of 130 mAhg1 at 3.2 V versus Li+/Li and a quasi-solid-state ionic conductivity of 10−6 S cm1 at 303 K. These results underscore the viability of solid-state synthesis for constructing alkali-ion-containing organic electrode materials with reduced processing complexity.

合成碱离子金属有机骨架(MOFs)的一个关键挑战在于通常需要的多步骤程序,通常涉及溶剂热结晶、脱溶、合成后的碱金属化和控制干燥。为了解决这个问题,报告了一种无溶剂的机械热方法,将前驱体的固态磨削与真空下的热退火相结合。这种直接的、可扩展的路线提供了一种更可持续的替代方案,同时实现了化学计量精度。我们证明了这种方法用于合成Li4-Zn-p-DOBDP_mt (LZP3; p-DOBDP6−= 2,5-二氧化-1,4-苯二磷酸),其中锂在MOF形成过程中被掺入。与传统合成的材料相比,该材料具有更好的结晶度,并保留了其关键的功能特性,包括在3.2 V时的可逆容量为130 mAhg−1,而Li+/Li在303 K时的准固态离子电导率为10−6 S cm−1。这些结果强调了固态合成构建碱离子有机电极材料的可行性,降低了加工复杂性。
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引用次数: 0
Synthesis of Ti3C2Tx(exf)@h-BN@Co3O4 Hierarchical Structure: An Active Cathode for High-Performing Solid-State Supercapacitor and Density Functional Theory Calculations Ti3C2Tx(exf)@h-BN@Co3O4层次结构的合成:高性能固态超级电容器的活性阴极及密度泛函理论计算
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-19 DOI: 10.1002/batt.202500466
Sarifa Regina Fernandes, Rajeshvari Samatbhai Karmur, Krishna Aravind Padmalayam, Ashakiran Maibam, Derek Hao, Ravichandar Babarao, Narendra Nath Ghosh

Herein, the synthesis of Ti3C2Tx(exf)@h-BN@Co3O4 and its electrochemical performances as an active cathode material in a flexible all-solid-state asymmetric supercapacitor (ASC) is presented. A hierarchical heterostructure has been created by integrating nanometer-thin exfoliated Ti3C2Tx(exf) MXene sheets with a 2-D layered hexagonal boron nitride (h-BN) and immobilizing Co3O4 nanorods on the surface. h-BN and Co3O4 offer rich redox features and highly conductive Ti3C2Tx facilitates the charge transfer process. To prepare the anode of ASC, a spent tea-derived porous carbon (PC) was used. An ASC device (Ti3C2Tx(exf)@h-BN@Co3O4//PC) was assembled with PVA-KOH gel-electrolyte. This device exhibited a specific capacitance of 105.8 F g−1 at a current density of 0.5 A g−1, an energy density of 33.0 W h kg−1 at a power density of 375 W kg−1, and retention of ≈90% of its initial capacitance and ≈85% of its Coulombic efficiency after 5000 charge-discharge cycles. To gain an in-depth understanding of the electronic band structure of Ti3C2@h-BN@Co3O4, computational investigations were carried out. The calculated value of quantum capacitance of Ti3C2@h-BN@Co3O4 was 59.16 μFcm−2 at 2.67 V (positive bias). This work highlights the exceptional performance and durability of Ti3C2Tx(exf)@h-BN@Co3O4 ternary heterostructure and positions it as a highly promising candidate for next-generation supercapacitors.

本文介绍了Ti3C2Tx(exf)@h-BN@Co3O4的合成及其作为柔性全固态非对称超级电容器(ASC)活性正极材料的电化学性能。通过将纳米薄片状Ti3C2Tx(exf) MXene片与二维层状六方氮化硼(h-BN)结合并在表面固定Co3O4纳米棒,形成了分层异质结构。h-BN和Co3O4具有丰富的氧化还原特性,高导电性Ti3C2Tx有利于电荷转移过程。采用废茶衍生多孔碳(PC)制备ASC阳极。用PVA-KOH凝胶-电解质组装ASC器件(Ti3C2Tx(exf)@h-BN@Co3O4//PC)。该器件在0.5 a g−1电流密度下的比电容为105.8 F g−1,在375 W kg−1功率密度下的比电容为33.0 W h kg−1,在5000次充放电循环后,其初始电容保持率约为90%,库仑效率保持率约为85%。为了深入了解Ti3C2@h-BN@Co3O4的电子能带结构,进行了计算研究。在2.67 V(正偏置)下,Ti3C2@h-BN@Co3O4的量子电容计算值为59.16 μFcm−2。这项工作突出了Ti3C2Tx(exf)@h-BN@Co3O4三元异质结构的卓越性能和耐用性,并将其定位为下一代超级电容器的极有前途的候选者。
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引用次数: 0
Prussian Blue Analogs as Cathode Materials for Sodium-Ion Batteries 普鲁士蓝类似物作为钠离子电池正极材料
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-19 DOI: 10.1002/batt.202500482
Narasimharao Kitchamsetti, Ana L. F. de Barros, Sungwook Mhin

Prussian blue analogs (PBAs) have shown great promise as cathode materials for sodium-ion batteries (SIBs) due to their easy synthesis, affordability, structural adaptability, and high theoretical capacity. However, despite their considerable potential, there are still several performance challenges that hinder their practical use. This review thoroughly explores the structures of PBAs and their electrochemical reaction mechanisms, systematically summarizing current synthesis methods and modification techniques while providing forward-looking insights. Additionally, the industrial viability of PBAs is assessed from a commercialization standpoint. By examining advanced synthesis methods, material optimization strategies, and challenges in industrial development, this work aims to provide both theoretical guidance and technical prospects for enhancing the application of PBAs in practical SIBs.

普鲁士蓝类似物(PBAs)由于其易于合成、价格合理、结构适应性强和理论容量大等优点,作为钠离子电池(sib)的正极材料具有广阔的应用前景。然而,尽管它们具有相当大的潜力,但仍然存在一些性能挑战,阻碍了它们的实际应用。本文深入探讨了多环芳烃的结构及其电化学反应机理,系统总结了目前的合成方法和改性技术,并提供了前瞻性的见解。此外,从商业化的角度评估了PBAs的工业可行性。通过研究先进的合成方法、材料优化策略和工业发展面临的挑战,旨在为加强PBAs在实际sib中的应用提供理论指导和技术前景。
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引用次数: 0
A Long Cycle-Life and Recyclable Anthraquinone Oligomer Connected via Amide Bonds for Use in Rechargeable Organic Batteries 用酰胺键连接的长循环寿命可回收蒽醌低聚物用于可充电有机电池
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-19 DOI: 10.1002/batt.202500289
Saki Fukuma, Hikaru Sano, Moe Yamauchi, Keisuke Yasuda, Hisanori Ando, Masaru Yao

With the increasing demand for energy, the requirements for energy storage systems have also increased. For example, rechargeable lithium batteries, which are the primary power sources for mobile devices, must have a high energy density and be environmentally friendly. Herein, organic compounds linked by amide bonds that underwent chemical hydrolysis or biodegradation as sustainable battery materials are investigated. In particular, an amide-bonded anthraquinone oligomer is synthesized, and its potential as a cathode-active material is examined. The anthraquinone monomer, with a theoretical capacity of 258 mAh g−1, exhibits rapid capacity decay during the cycle test; however, the synthesized oligomer, with a theoretical capacity of 144 mAh g−1, exhibits excellent cycle-life performance. For example, it retains ≈82% of its initial capacity after 200 cycles. This electrochemical improvement is attributed to the decreased solubility in the electrolyte solution due to oligomerization. This study contributes to the development of long cycle-life organic batteries with environmental benefits.

随着能源需求的不断增长,对储能系统的要求也越来越高。例如,可充电锂电池,作为移动设备的主要电源,必须具有高能量密度和环保。在此,通过酰胺键连接的有机化合物经过化学水解或生物降解作为可持续电池材料进行了研究。特别地,合成了一种酰胺键蒽醌低聚物,并考察了其作为阴极活性材料的潜力。理论容量为258 mAh g−1的蒽醌单体在循环试验中表现出快速的容量衰减;然而,合成的低聚物的理论容量为144 mAh g−1,具有优异的循环寿命性能。例如,经过200次循环后,它保留了约82%的初始容量。这种电化学上的改善是由于在电解质溶液中的溶解度由于低聚而降低。本研究有助于开发具有环境效益的长循环寿命有机电池。
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引用次数: 0
Latent Diffusion Models for Virtual Battery Material Screening and Characterization 虚拟电池材料筛选与表征的潜在扩散模型
IF 4.7 4区 材料科学 Q2 ELECTROCHEMISTRY Pub Date : 2025-08-16 DOI: 10.1002/batt.202500075
Deepalaxmi Rajagopal, Arnd Koeppe, Adrian Cierpka, Britta Nestler

Efficient characterization of battery materials is fundamental to understanding the underlying electrochemical mechanisms and ensuring the safe operation of batteries. In this work, an innovative data-driven multimodal generative method is proposed to accelerate the characterization and screening of battery materials. This approach leverages a variant of the latent diffusion model, which combines a variational autoencoder (VAE) and a denoising U-Net. The VAE maps microscale information from characterization techniques, such as atomic force microscopy (AFM), into a common latent space, and the denoising U-net, conditioned on battery properties, guides the screening of battery materials. Together, the data-driven properties of material space, enriched with battery functional properties and formulated in a common latent space, achieve the accurate translation of information from AFM to meaningful material descriptors and accelerate the screening of battery materials to meet the functional needs of the battery system under consideration.

电池材料的有效表征是理解潜在的电化学机制和确保电池安全运行的基础。在这项工作中,提出了一种创新的数据驱动的多模态生成方法来加速电池材料的表征和筛选。该方法利用了潜在扩散模型的一种变体,该模型结合了变分自编码器(VAE)和去噪U-Net。VAE将来自表征技术(如原子力显微镜(AFM))的微尺度信息映射到一个共同的潜在空间中,并根据电池性能进行去噪U-net,指导电池材料的筛选。总之,数据驱动的材料空间属性,丰富了电池的功能属性,并在一个共同的潜在空间中制定,实现了从AFM信息到有意义的材料描述符的准确翻译,加速了电池材料的筛选,以满足所考虑的电池系统的功能需求。
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引用次数: 0
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