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Energy & Environmental Materials 2023年第3期6卷 8-19页

作者： Qiyu Wang Xiangqun Xu Bo Hong Maohui Bai Jie Li Zhian Zhang Yanqing Lai School of Metallurgy and Environment Central South UniversityChangsha 410083China Engineering Research Centre of Advanced Battery Materials The Ministry of EducationChangsha 410083China

Quasi-solid-state lithium metal battery is a promising candidate for next generation high energy density and high safety power *** intensive efforts on electrolytes,uncontrolled interfacial reactions on lithium with electrolyte and patchy interfacial contacts still hinder its practical ***,we bring in rationally designed F contained groups into polymer skeleton via in-situ gelation for the first time to establish quasi-solid-state *** method achieves a capacity retention of 90%after 1000 cycles at 0.5C with LiFePO_(4)*** interface constructed by polymer skeleton and reaction with–CF_(3)lead to the predicted solid electrolyte interface species with high ***,we optimize molecular reactivity and interface stability with regulating F contained end groups in the *** on different structures reveal that high performance solid stable lithium metal batteries rely on chemical modification as well as stable polymer skeleton,which is more critical to construct robust and steady SEI with uniform lithium *** approach with functional groups regulation proposes a more stable cycling process with a capacity retention of 94.2%at 0.5C and 87.6%at 1C after 1000 cycles with LiFePO_(4) cathodes,providing new insights for the practical development of quasi-solid-state lithium metal battery.

关键词： F contained end groups in-situ gel electrolyte interface stability molecular reactivity quasi-solid-state lithium metal battery

In situ surface engineering enables high interface stability and rapid reaction kinetics for Ni-rich cathodes

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eScience 2023年第1期3卷 38-44页

作者： Wenshuai Guo Wu Wei Huawei Zhu Yanjie Hu Hao Jiang Chunzhong Li Shanghai Engineering Research Center of Hierarchical Nanomaterials School of Materials Science and EngineeringEast China University of Science and TechnologyShanghai 200237China Key Laboratory for Ultrafine Materials of Ministry of Education School of Chemical EngineeringEast China University of Science and TechnologyShanghai 200237China

Layered oxide cathodes with high Ni content promise high energy density and competitive cost for Li-ion batteries(LIBs).However,Ni-rich cathodes suffer from irreversible interface reconstruction and undesirable cracking with severe performance degradation upon long-term operation,especially at elevated ***,we demonstrate in situ surface engineering of Ni-rich cathodes to construct a dual ion/electron-conductive NiTiO 3 coating layer and Ti gradient doping(NC90–Ti@NTO)in *** dual-modification synergy helps to build a thin,robust cathode–electrolyte interface with rapid Li-ion transport and enhanced reaction kinetics,and effec-tively prevents unfavorable crystalline phase transformation during long-term cycling under harsh *** optimized NC90–Ti@NTO delivers a high reversible capacity of 221.0 mAh g^(-1) at 0.1C and 158.9 mAh g^(-1) at ***,it exhibits a capacity retention of 88.4%at 25?C after 500 cycles and 90.7%at 55?C after 300 cycles in a pouch-type full *** finding provides viable clues for stabilizing the lattice and interfacial chemistry of Ni-rich cathodes to achieve durable LIBs with high energy density.

关键词： Ni-rich cathode Surface engineering High energy density interface stability Li-ion batteries

interface stability of the SiC Particles/Fe Matrix Composite System

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Journal of Wuhan University of Technology(Materials Science) 2006年第3期21卷 49-53页

作者：汤文明 School of Materials Science and Engineering Hefei University of TechnologyHefei 230009China

The interface reaction between the SiC particles （ SiCp ） and Fe was stndicd during sintering the SiCp reinforced Fe matrix composites at 1423 K for 1 h. In the composite having 3wt% （weight ratio） SiCp （the 3SiCp/ Fe composite）, the interface reaction products of Fe3 Si, the carbon precipitates, and Fe3 C or pearlite were generated. Fe3 Si coustructs the bright matrix of the reaction zone in the original situation of the SiCp. The carbon precipitates are randondy embedded in the reaction zone. Fe3 C or pearlite exists at the grain boundaries of the Fe matrix. As increasing the SiCp concentration in the SiCp/ Fe composite, the inteusity of the interface reaction between SiCp and Fe iacreases. After the 10SiCp/ Fe composite （ having 10wt .% SiCp ） sintered at 1423 K for 1 h, all of SiCp are decomposed, and replaced by the reaction zone composed of Fe3 Si and the carbon precipitates. No Fe3 C or pearlite was genertaed during the reaction. The effects of the techniques of oxidizing of SiCp , coating SiCp by interaction with the Cr powder, and alloying the Fe matrix by adding the Cr element on the interface stability of the SiCp/ Fe composite system were also investigated, respectitely. The oxide membrane and the coating layer on SiCp can inhibit the interface reaction between SiCp and Fe by isolating SiCp from the Fe matrix during sintering. The interface reaction does not occur in the 3 SiCp/ Fe- 10 Cr composite but in the 3 SiCp/ Fe-5 Cr composite. In the SiCp/ Fe-Cr alloy composites, the interface reaction between SiCp and the Fe- Cr alloys is weaker than that between SiCp and Fe . The Cr element behaves as a diluent, it causes a redaction in the interface reaction, which is proportional to the amount of the element added.

关键词： interface reaction interface stability oxidation of SiC coating alloying

A thick yet dense silicon anode with enhanced interface stability in lithium storage evidenced by in situ TEM observations

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Science Bulletin 2020年第18期65卷 1563-1569,M0004页

作者： Junwei Han Dai-Ming Tang Debin Kong Fanqi Chen Jing Xiao Ziyun Zhao Siyuan Pan Shichao Wu Quan-Hong Yang Nanoyang Group State Key Laboratory of Chemical EngineeringSchool of Chemical Engineering and TechnologyCollaborative Innovation Center of Chemical Science and Engineering(Tianjin)Tianjin UniversityTianjin 300350China International Center for Materials Nanoarchitectonics(WPI-MANA) National Institute for Materials Science(NIMS)Namiki 1-1Tsukubalbaraki 305-0044Japan CAS Key Laboratory of Nanosystem and Hierarchical Fabrication CAS Center for Excellence in NanoscienceNational Center for Nanoscience and TechnologyBeijing 100190China Joint School of National University of Singapore and Tianjin University International Campus of Tianjin UniversityBinhai New CityFuzhou 350207China

Increasing the density and thickness of electrodes is required to maximize the volumetric energy density of lithium-ion batteries for practical ***,dense and thick electrodes,especially highmass-content(>50 wt%) silicon anodes,have poor mechanical stability due to the presence of a large number of unstable interfaces between the silicon and conducting components during *** we report a network of mechanically robust carbon cages produced by the capillary shrinkage of graphene hydrogels that can contain the silicon nanoparticles in the cages and stabilize the silicon/carbon *** situ transmission electron microscope characterizations including compression and tearing of the structure and lithiation-induced silicon expansion experiments,have provided insight into the excellent confinement and buffering ability of this interface-strengthened graphene-caged silicon nanoparticle anode ***,a dense and thick silicon anode with reduced thickness fluctuations has been shown to deliver both high volumetric(>1000 mAh cm^-3) and areal(>6 mAh cm^-2)capacities together with excellent cycling capability.

关键词： Lithium-ion battery Silicon anode interface stability In situ TEM Dense and thick electrodes

Prediction of Solid-Liquid interface stability by Coupling M-S Model with CALPHAD Method

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Journal of Materials Science & Technology 2004年第4期20卷 466-468页

作者： RuijieZHANG ZhiHE ZhongweiCHEN WanqiJIE StateKeyLaboratoryofSolidificationProcessing NorthwesternPolytechnicalUniversityXi'an710072China StateKeyLaboratoryofSolidificationProcessing NorthwesternPolytechnicalUniversityXi'an710072China

A method to predict the solid-liquid interface stability during unidirectional solidification is developed by coupling M-S model with CALPHAD method. The method was applied to AI-0.38 Zn and AI-0.34 Si-0.14 Mg (wt pct) alloys, and the predicted results were compared with some former experimental data of the two alloys. The good agreement between the calculation results and the experimental data demonstrates the superiority of the present method to the classical one based on constant parameter assumptions.

关键词： interface stability CALPHAD method Unidirectional solidification

A First-principles Study on the Adhesion Strength,Interfacial stability,and Electronic Properties of Mg/Mg_(2)Y interface

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Acta Metallurgica Sinica(English Letters) 2024年第3期37卷 537-550页

作者： Yunxuan Zhou Wenjun Tian Quan Dong Hailian Wang Jun Tan Xianhua Chen Kaihong Zheng Fusheng Pan College of Materials Science and Engineering National Engineering Research Center for Magnesium AlloysChongqing UniversityChongqing 400044China State Key Laboratory of Mechanical Transmission Chongqing UniversityChongqing 400044China Institute of New Materials Guangdong Academy of SciencesGuangzhou 510650China

The interfacial microstructures and configurations directly affect the comprehensive properties of the composites,but their interfacial adhesion mechanism is complicated to expound by experimental *** this work,based on the stacking sequence of the Mg/Mg_(2)Y interface models,nine different Mg/Mg_(2)Y interface configurations with top site,bridge site,and hollow site(HCP)under Mg1,Mg_(2),and Y terminations were successfully constructed and systematically explored by first-principles *** results showed that the Mg_(2)Y(0001)surface with Y termination is the most stable when the yttrium chemical potential()is less than-1.09 eV;otherwise,Mg_(2)Y(0001)surface with Mg1 termination is the most *** seven-layer Mg(0001)and eleven-layer Mg_(2)Y(0001)slabs are employed to reflect the bulk-like interior ***,the Mg(0001)/Mg_(2)Y(0001)with the Y-HCP stacking has the largest interface thermodynamic stability with the value of 2.383 J/m^(2) in all interface configurations owing to its largest work of *** addition,the interfacial energy of Y-HCP stacking is significantly smaller than those of Mg1-HCP when is approximately less than-0.55 eV,showing that it is more *** thermodynamic stability of Mg/Mg_(2)Y with Y-HCP is due to Mg-Y chemical bonds formed between Mg and Y ***,the Mg/Mg_(2)Y interfaces are strong interfaces based on the Griffith fracture theory.

关键词： Mg/Mg_(2)Y interface interface stability Work of adhesion Electronic structure First-principles calculations

interface and mechanical degradation mechanisms of the silicon anode in sulfide-based solid-state batteries at high temperatures

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Chinese Physics B 2024年第8期33卷 117-126页

作者：王秋辰黄昱力许晶禹习谦李泓陈立泉 Key Laboratory for Renewable Energy Beijing Key Laboratory for New Energy Materials and DevicesBeijing National Laboratory for Condensed Matter PhysicsInstitute of PhysicsChinese Academy of SciencesBeijing 100190China University of Chinese Academy of Sciences Beijing 100049China Huairou Division Institute of PhysicsChinese Academy of SciencesBeijing 101408China

Silicon(Si)is a competitive anode material owing to its high theoretical capacity and low electrochemical ***,the prospect of Si anodes in solid-state batteries(SSBs)has been proposed due to less solid electrolyte interphase(SEI)formation and particle ***,major challenges arise for Si anodes in SSBs at elevated *** this work,the failure mechanisms of Si-Li_(6)PS_(5)Cl(LPSC)composite anodes above 80℃are thoroughly investigated from the perspectives of interface stability and(electro)chemo-mechanical *** chemistry and growth kinetics of Lix Si|LPSC interphase are demonstrated by combining electrochemical,chemical and computational *** and/or Si–P compound formed at Lix Si|LPSC interface prove to be detrimental to interface stability at high *** the other hand,excessive volume expansion and local stress caused by Si lithiation at high temperatures damage the mechanical structure of Si-LPSC composite *** work elucidates the behavior and failure mechanisms of Si-based anodes in SSBs at high temperatures and provides insights into upgrading Si-based anodes for application in SSBs.

关键词： sulfide electrolytes silicon anodes interface stability degradation kinetics all-solid-state batteries

Solid-state lithium-ion batteries for grid energy storage:opportunities and challenges

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Science China Chemistry 2024年第1期67卷 43-66页

作者： Xin Chang Yu-Ming Zhao Boheng Yuan Min Fan Qinghai Meng Yu-Guo Guo Li-Jun Wan CAS Key Laboratory of Molecular Nanostructure and Nanotechnology CAS Research/Education Center for Excellence in Molecular SciencesBeijing National Laboratory for Molecular Sciences(BNLMS)Institute of ChemistryChinese Academy of Sciences(CAS)Beijing 100190China University of Chinese Academy of Sciences Beijing 100049China

The energy crisis and environmental pollution drive more attention to the development and utilization of renewable *** the capricious nature of renewable energy resource,it has difficulty supplying electricity directly to consumers stably and efficiently,which calls for energy storage systems to collect energy and release electricity at peak *** to their flexible power and energy,quick response,and high energy conversion efficiency,lithium-ion batteries stand out among multiple energy storage technologies and are rapidly deployed in the *** superior performance and ensuring the safety of energy storage systems,intrinsically safe solid-state electrolytes are expected as an ideal alternative to liquid *** this review,we systematically evaluate the priorities and issues of traditional lithium-ion batteries in grid energy *** lithium-ion batteries containing liquid electrolytes,solid-state lithium-ion batteries have the potential to play a more significant role in grid energy *** challenges of developing solid-state lithium-ion batteries,such as low ionic conductivity of the electrolyte,unstable electrode/electrolyte interface,and complicated fabrication process,are discussed in ***,the safety of solid-state lithium-ion batteries is *** the obtained insights,inspiring prospects for solid-state lithium-ion batteries in grid energy storage are depicted.

关键词： lithium-ion batteries grid energy storage solid-state electrolytes interface stability

Armoring lithium metal anode with soft±rigid gradient interphase toward high-capacity and long-life all-solid-state battery

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Green Energy & Environment 2024年第8期9卷 1279-1289页

作者： Rui Zhang Biao Chen Yuhan Ma Yue Li Junwei Sha Liying Ma Chunsheng Shi Naiqin Zhao School of Materials Science and Engineering and Tianjin Key Laboratory of Composite and Functional Materials Tianjin University Joint School of National University of Singapore and Tianjin University International Campus of Tianjin University Department of Chemical and Biomolecular Engineering National University of Singapore Collaborative Innovation Centre of Chemical Science and Engineering

Solid polymer electrolytes （SPEs） are highly promising for realizing high-capacity,low-cost,and safe Li metal ***,the Li dendritic growth and side reactions between Li and SPEs also plague these ***,a fluorinated lithium salt coating （FC） with organicinorganic gradient and soft-rigid feature is introduced on Li surface as an artificial protective layer by the in-situ reaction between Li metal and fluorinated carboxylic *** FC layer can improve the interface stability and wettability between Li and SPEs,assist the transport of Li ions,and guide Li nucleation,contributing to a dendrite-free Li deposition and long-lifespan Li metal *** symmetric cell with FC-Li anodes exhibits a high areal capacity of 1 mAh cm-2at 0.5 mA cm-2,and an ultra-long lifespan of 2000 h at a current density of 0.1 m A ***,the full cell paired with the LiFePO4cathode exhibits improved cycling stability,remaining 83.7%capacity after 500 cycles at 1 *** matching with the S cathode,the FC layer can prevent the shuttle effect,contributing to stable and high-capacity Li-S *** work provided a promising way for the construction of stable all-solid-state lithium metal batteries with prolonged lifespan.

关键词： All-solid-state battery Solid polymer electrolyte Li metal anode Li nucleation interface stability

Recent progress of interface modification of layered oxide cathode material for sodium-ion batteries

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Electron 2024年第2期2卷 98-122页

作者： Luyi Sun Jun Zeng Xuanhong Wan Chenxi Peng Jiarui Wang Chongjia Lin Min Zhu Jun Liu Guangdong Provincial Key Laboratory of Advanced Energy Storage Materials School of Materials Science and EngineeringSouth China University of TechnologyGuangzhouChina Department of Mechanical and Aerospace Engineering The Hong Kong University of Science and TechnologyHong KongChina

With the advantages of similar theoretical basis to lithium batteries,relatively low budget and the abundance of sodium resources,sodium ion batteries(SIBs)are recognized as the most competitive alternative to lithium-ion *** various types of cathodes for SIBs,advan-tages of high theoretical capacity,nontoxic and facile synthesis are introduced for layered transition metal oxide cathodes and therefore they have attracted huge ***,layered oxide cathodes suffer from various degradation *** these issues,interface instability including surface residues,phase transitions,loss of active transition metal and oxygen loss takes up the major part of the degra-dation of layered *** degradation mechanisms usually lead to irreversible structure collapse and cracking generation,which signifi-cantly influence the interface stability and electrochemical performance of layered *** review briefly introduces the background of researches on layered cathodes for SIBs and their basic structure *** the origins and effects on layered cathodes of degradation mech-anisms are systematically ***,we will summarize various interface modification methods including surface engineering,doping modification and electrolyte composition which are aimed to improve interface stability of layered cathodes,perspectives of future research on layered cathodes are mentioned to provide some theoretical proposals.

关键词： interface modification interface stability layered oxides sodium ion batteries surface coating