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An inorganic liquid crystalline dispersion with 2D ferroelectric moieties

National science Review 2024年第5期11卷 254-263页

作者： Ziyang Huang Zehao Zhang Rongjie Zhang Baofu Ding Liu Yang Keyou Wu Youan Xu Gaokuo Zhong Chuanlai Ren Jiarong Liu Yugan Hao Menghao Wu Teng Ma Bilu Liu Shenzhen Graphene Centre Shenzhen Key Laboratory of Advanced Layered Materials for Value-added ApplicationsTsinghua-Berkeley Shenzhen Institute and Institute of Materials ResearchTsinghua Shenzhen International Graduate School Tsinghua University Institute of Technology for Carbon Neutrality Faculty of Materials Science and Engineering Shenzhen Institute of Advanced Technology Chinese Academy of Sciences School of Physics and Institute for Quantum Science and Engineering School of Chemistry and Institute of Theoretical ChemistryHuazhong University of Science and Technology Xi'an Research Institute of High Technology Shenzhen Institute of Advanced Technology Chinese Academy of Sciences Department of Applied Physics Hong Kong Polytechnic University

Electro-optical effect-based liquid crystal devices have been extensively used in optical modulation techniques, in which the Kerr coefficient reflects the sensitivity of the liquid crystals and determines the strength of the device's operational electric field. The Peterlin–Stuart theory and the O'Konski model jointly indicate that a giant Kerr coefficient could be obtained in a material with both a large geometrical anisotropy and an intrinsic polarization, but such a material is not yet reported. Here we reveal a ferroelectric effect in a monolayer two-dimensional mineral vermiculite. A large geometrical anisotropy factor and a large inherent electric dipole together raise the record value of Kerr coefficient by an order of magnitude, till 3.0 × 10-4mV-2. This finding enables an ultra-low operational electric field of10～2–10～4V m-1and the fabrication of electro-optical devices with an inch-level electrode separation, which has not previously been practical. Because of its high ultraviolet stability（decay <1% under ultraviolet exposure for 1000 hours）, large-scale production, and energy efficiency, prototypical displayable billboards have been fabricated for outdoor interactive scenes. This work provides new insights for both liquid crystal optics and two-dimensional ferroelectrics.

关键词： 2D materials layered minerals vermiculite ferroelectric inorganic liquid crystal Kerr coefficient

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Mitigated reaction kinetics between lithium metal anodes and electrolytes by alloying lithium metal with low-content magnesium

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Journal of Energy Chemistry 2024年第8期95卷 644-650,I0014页

作者： Yang-Yang Wang Ya-Nan Wang Nan Yao Shu-Yu Sun Xiao-Qing Ding Chen-Xi Bi Qian-Kui Zhang Zhao Zheng Cheng-Bin Jin Bo-Quan Li Xue-Qiang Zhang Jia-Qi Huang School of Materials Science and Engineering Beijing Institute of TechnologyBeijing 100081China Advanced Research Institute of Multidisciplinary Science Beijing Institute of TechnologyBeijing 100081China Beijing Key Laboratory of Green Chemical Reaction Engineering and Technology Department of Chemical EngineeringTsinghua UniversityBeijing 100084China College of Materials and Chemistry China Jiliang UniversityHangzhou 310018ZhejiangChina

Lithium(Li)metal is regarded as a promising anode candidate for high-energy-density rechargeable ***,Li metal is highly reactive against electrolytes,leading to rapid decay of active Li metal ***,alloying Li metal with low-content magnesium(Mg)is proposed to mitigate the reaction kinetics between Li metal anodes and *** atoms enter the lattice of Li atoms,forming solid solution due to the low amount(5 wt%)of *** atoms mainly concentrate near the surface of Mg-alloyed Li metal *** reactivity of Mg-alloyed Li metal is mitigated kinetically,which results from the electron transfer from Li to Mg atoms due to the electronegativity *** on quantitative experimental analysis,the consumption rate of active Li and electrolytes is decreased by using Mgalloyed Li metal anodes,which increases the cycle life of Li metal batteries under demanding ***,a pouch cell(1.25 Ah)with Mg-alloyed Li metal anodes delivers an energy density of 340 Wh kg^(-1)and a cycle life of 100 *** work inspires the strategy of modifying Li metal anodes to kinetically mitigate the side reactions with electrolytes.

关键词： Lithium metal anodes Alloying Anode/electrolyte interface Reaction kinetics Pouch cell

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A post-modification strategy to precisely construct dual-atom sites for oxygen reduction electrocatalysis

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Journal of Energy Chemistry 2024年第3期90卷 511-517,I0012页

作者： Juan Wang Xinyan Liu Chang-Xin Zhao Yun-Wei Song Jia-Ning Liu Xi-Yao Li Chen-Xi Bi Xin Wan Jianglan Shui Hong-Jie Peng Bo-Quan Li Jia-Qi Huang School of Materials Science and Engineering Beijing Institute of TechnologyBeijing 100081China Advanced Research Institute of Multidisciplinary Science Beijing Institute of TechnologyBeijing 100081China Beijing Key Laboratory of Green Chemical Reaction Engineering and Technology Department of Chemical EngineeringTsinghua UniversityBeijing 100084China Institute of Fundamental and Frontier Sciences University of Electronic Science and Technology of ChinaChengdu 611731SichuanChina School of Materials Science and Engineering Beihang UniversityBeijing 100191China

Dual-atom catalysts(DACs) afford promising potential for oxygen reduction electrocatalysis due to their high atomic efficiency and high intrinsic ***,precise construction of dual-atom sites remains a *** this work,a post-modification strategy is proposed to precisely fabricate DACs for oxygen reduction ***,a secondary metal precursor is introduced to the primary single-atom sites to introduce direct metal-metal interaction,which ensures the formation of desired atom pair structure during the subsequent pyrolysis process and allows for successful construction of *** as-prepared FeCo-NC DAC exhibits superior oxygen reduction electrocatalytic activity with a half-wave potential of 0,91 V *** hydrogen ***-air batteries equipped with the FeCo-NC DAC demonstrate higher peak power density than those with the Pt/C *** importantly,this post-modification strategy is demonstrated universal to achieve a variety of dual-atom *** work presents an effective synthesis methodology for precise construction of catalytic materials and propels their applications in energy-related devices.

关键词： Dual-atom catalysts Electrocatalysis Oxygen reduction reaction Post-modification Zinc–air batteries

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First Principles Calculations for Corrosion in Mg-Li-Al Alloys with Focus on Corrosion Resistance: A Comprehensive Review

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Computers, materials & Continua 2024年第11期81卷 1905-1952页

作者： Muhammad Abdullah Khan Muhammad Usman Yuhong Zhao School of Materials Science and Engineering Collaborative Innovation Center of Ministry of Education and Shanxi Province for High-Performance Al/Mg Alloy MaterialsNorth University of ChinaTaiyuan030051China Electronics Department North University of ChinaTaiyuan030000China Beijing Advanced Innovation Center for Materials Genome Engineering University of Science and Technology BeijingBeijing100083China Institute of Materials Intelligent Technology Liaoning Academy of MaterialsShenyang110004China

This comprehensive review examines the structural,mechanical,electronic,and thermodynamic properties of Mg-Li-Al alloys,focusing on their corrosion resistance and mechanical performance *** first-principles calculations based on Density Functional Theory(DFT)and the quasi-harmonic approximation(QHA),the combined properties of the Mg-Li-Al phase are explored,revealing superior incompressibility,shear resistance,and stiffness compared to individual *** review highlights the brittleness of the alloy,supported by B/G ratios,Cauchy pressures,and Poisson’s *** structure analysis shows metallic behavior with varied covalent bonding characteristics,while Mulliken population analysis emphasizes significant electron transfer within the *** paper also studied thermodynamic properties,including Debye temperature,heat capacity,enthalpy,free energy,and entropy,which are precisely examined,highlighting the Mg-Li-Al phase sensitive to thermal conductivity and thermal performance *** density of states(PHDOS)confirms dynamic stability,while anisotropic sound velocities reveal elastic *** comprehensive review not only consolidates the current understanding of the Mg-Li-Al alloy’s properties but also proposes innovative strategies for enhancing corrosion *** these strategies is the introduction of a corrosion barrier akin to the Mg-Li-Al network,which holds promise for advancing both the applications and performance of these *** review serves as a crucial foundation for future research aimed at optimizing alloy design and processing methods.

关键词： First-principles calculations Mg-Li-Al alloys corrosion resistance thermodynamic properties mechanical properties

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Mechanically mixing copper and silver into self-supporting electrocatalyst for hydrogen evolution

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International Journal of Minerals,Metallurgy and materials 2023年第10期30卷 1906-1913页

作者： Xinzhuo Hu Zhe Liu Yi Feng Yongfeng Zhang Zhe Li Zhennan Chen Jing Mao Jing Yang Hui Liu Pengfei Yin Lei Cui Xiwen Du Institute of New Energy Materials School of Materials Science and EngineeringTianjin UniversityTianjin 300072China Institute of Advanced Welding Technology School of Materials Science and EngineeringTianjin UniversityTianjin 300072China Zijin Copper Co.LTD.Shanghang Country Longyan 364200China Department of Materials Science Fudan UniversityShanghai 200433China

Commercial hydrogen production involves the development of efficient hydrogen evolution reaction ***,we adopted a friction stir processing(FSP)technique to mix immiscible metals homogenously and obtain a self-supporting copper-silver(CuAg)*** gust of Ag atoms with larger atomic sizes caused a tensile strain in the Cu ***,the chemical-potential difference induced electron transfer from Cu to Ag,and the two factors jointly led to the upshift of Cu d-band and improved the catalytic ***,the CuAg electrode exhibited a high turnover frequency(12 times that of pure Cu),a low overpotential at high current density(superior to platinum foil),and high durability(1.57%decay over 180 h).Our work demonstrates that FSP is a powerful method for preparing self-supporting catalysts of immiscible alloys with high catalytic performance.

关键词： hydrogen evolution reaction catalyst friction stir processing strain electron transfer

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One-step fabrication of ultrathin porous Janus membrane within seconds for waterproof and breathable electronic skin

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science Bulletin 2025年第5期70卷 712-721页

作者： Yufeng Ni Bing Li Chengzhen Chu Shaofan Wang Yujie Jia Shichun Cao Rasoul Esmaeely Neisiany Chuanglong He Shuo Chen Zhengwei You State Key Laboratory of Advanced Fiber Materials Institute of Functional MaterialsCollege of Materials Science and EngineeringResearch Base of Textile Materials for Flexible Electronics and Biomedical Applications(China Textile Engineering Society)Shanghai Engineering Research Center of Nano-Biomaterials and Regenerative MedicineShanghai Key Laboratory of Lightweight CompositeDonghua UniversityShanghai 201620China College of Biological Science and Medical Engineering Donghua UniversityShanghai 201620China Department of Materials and Polymer Engineering Faculty of EngineeringHakim Sabzevari UniversitySabzevar***Iran Biotechnology Centre Silesian University of TechnologyGliwice44-100Poland

It remains a challenge for a simple and scalable method to fabricate ultrathin porous Janus membranes for stretchable on-skin ***,we propose a one-step droplet spreading phase separation strategy to prepare an ultrathin and easily collected Janus thermoplastic polyurethane(TPU)membrane within *** metal-ion solvation structure mitigated migration kinetics to delay TPU solution demixing,promoting the further penetration of the coagulating ***,the developed membranes,with an average preparation rate of 25.2 cm^(2)s^(−1),had a thickness of 5μm,and the water vapor transmission rate was determined to be 663 g m^(−2) d^(−1).The small pore layer having an average pore size of 1.7μm effectively blocked external liquid *** porous Janus TPU membrane coated by liquid metal served as a building block to develop a new generation of monolithic stretchable electronics with simultaneous high permeability and waterproofness.

关键词： porous polyurethane kinetics

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Metalphthalocyanine frameworks grown on TiO_(2)nanotubes for synergistically and efficiently electrocatalyzing urea production from CO_(2)and nitrate

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science China Chemistry 2023年第5期66卷 1417-1424页

作者： Ning Li Hui Gao Zhixin Liu Qianjun Zhi Bowen Li Lei Gong Baotong Chen Tao Yang Kang Wang Peng Jin Jianzhuang Jiang Beijing Advanced Innovation Center for Materials Genome Engineering Beijing Key Laboratory for Science and Application of Functional Molecular and Crystalline MaterialsDepartment of Chemistry and Chemical EngineeringSchool of Chemistry and Biological EngineeringUniversity of Science and Technology BeijingBeijing 100083China School of Materials Science and Engineering Hebei University of TechnologyTianjin 300130China Innovation Research Institute for Carbon Neutrality University of Science and Technology BeijingBeijing 100083China

Electrocatalytic synthesis of urea from CO_(2)and NO_(3)^(-)under ambient conditions provides an appealing alternative to the traditional energy-intensive urea synthetic *** active and selective electrocatalysts for efficient urea production are therefore urgently desired owing to the unsatisfactory performance of the thus far reported ***,a phthalocyaninebased(Pc-based)covalent organic framework(COF),namely Co Pc-COF,fabricated from the nucleophilic substitution reaction of hexadecafluorophthalocyaninato cobalt with octahydroxylphthalocyanine cobalt,in situ grew on the surface of multilayered Ti O_(2)nanotubes(NTs),generating the Co Pc-COF@Ti O_(2)NTs *** X-ray diffraction analysis in combination with electron microscopy measurements discloses the uniform coating of crystalline Co Pc-COF on the multilayered Ti O_(2)NTs in Co Pc-COF@Ti O_(2)***,electrochemical tests reveal the superior electrocatalytic activity of Co Pc-COF@Ti O_(2)NTs towards urea production from CO_(2)and NO3-with a record-high yield of 1,205μg h^(-1)cm^(-2)and an outstanding Faraday efficiency of 49%at-0.6 V versus reversible hydrogen electrode due to the significant synergistic catalysis *** situ attenuated total reflection infrared spectroscopic investigation and theoretical calculations unveil the efficient C–N coupling reaction between*CO intermediate derived from CO_(2)on Co Pc moieties and*NH2intermediate formed from NO_(3)^(-)on Ti O_(2)NTs during the urea formation process over Co Pc-COF@Ti O_(2)*** work should be helpful towards designing and fabricating high-performance electrocatalysts for sustainable synthesis of urea through efficient synergistic effect of multiactive centers.

关键词： covalent organic frameworks phthalocyanine TiO_(2) electrocatalytic urea synthesis C–N bond coupling

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Effect of pre-twinning and heat treatment on formability of AZX311 Mg alloy

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Journal of Magnesium and Alloys 2024年第3期12卷 1154-1169页

作者： Mahesh Panchal Lalit Kaushik Min-Seong Kim Ravi Kottan Renganayagalu Shi-Hoon Choi Jaiveer Singh Department of Mechanical Engineering Indian Institute of Technology JodhpurKarwarJodhpur 342030RajasthanIndia Department of Metallurgical and Materials Engineering Indian Institute of Technology JodhpurKarwarJodhpur 342030RajasthanIndia Energy Materials Research Center Korea Institute of Science and Technology(KIST)5 Hwarang-roSeongbuk-guSeoul 02792Republic of Korea Department of Advanced Components and Materials Engineering Sunchon National University255 Jungang-roSuncheonJeonnam 57922Republic of Korea

In this study,the effects of pre-strain-induced tensile twins(TTWs)and controlled heat treatment on the formability behavior of AZX311 Mg alloy sheets were investigated.A 4%compressive strain was applied to pre-strain the sheets using the in-plane compression(IPC)technique along the rolling direction(RD)to introduce *** pre-strained(PS)samples were subsequently heat-treated at 250℃,350℃,and 400℃ independently for 1 hr,and are termed as PSA1,PSA2,and PSA3,*** cupping tests were conducted to assess the formability of the sheet samples under different initial *** results showed that the PS sample heat-treated at 250℃ for 1hr exhibited a decrease in the Erichsen index(IE)compared to the as-rolled sample,whereas PSA2 and PSA3 samples showed an increase in IE *** analysis revealed that most of the TTWs generated through pre-twinning were stable at 250℃;however,the twin volume fraction reduced to 41%at 350℃ compared to the PS samples due to enhanced thermal activity at that ***,PSA2 samples showed severe grain coarsening in some areas of the sample,and the fraction of such grains increased in the PSA3 *** stretch formability(IE value)of PSA2 samples showed a 32.3%increase compared to the as-rolled ***,the analysis of the deformed specimen at failure under the Erichsen test indicated that considerable detwinning occurs in the PS and PSA1 samples,whereas dislocation slip activity dominates in the PSA2 and PSA3 samples during stretch *** from detwinning and dislocation slip,deformation twins were also observed in all samples after the Erichsen ***,this work highlights the importance of texture control and its underlying mechanisms via pre-twinning followed by heat treatment and their impact on the room temperature(RT)stretch formability of AZX311 Mg alloy sheets.

关键词： Mg alloys Pre-twinning Texture Formability EBSD.

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Enhanced Hydrogen Embrittlement Resistance via Cr Segregation in Nanocrystalline Fe-Cr Alloys

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Acta Metallurgica Sinica(English Letters) 2023年第12期36卷 1925-1935页

作者： Linshuo Dong Feiyang Wang Hong-Hui Wu Mengjie Gao Penghui Bai Shuize Wang Guilin Wu Junheng Gao Xiaoye Zhou Xinping Mao Beijing Advanced Innovation Center for Materials Genome Engineering Innovation Research Institute for Carbon NeutralityUniversity of Science and Technology BeijingBeijing 100083China Institute of Steel Sustainable Technology Liaoning Academy of MaterialsShenyang 110004China Department of Materials Science and Engineering Shenzhen MSU-BIT UniversityShenzhen 518172China

Hydrogen is a clean fuel with numerous sources,yet the hydrogen industry is plagued by hydrogen embrittlement(HE)issues during the storage,transportation,and usage of hydrogen *** can compromise material performance during service,leading to significant safety hazards and economic *** the current work,the influence of element Cr on the HE resistance of nanocrystalline Fe-Cr alloys under different hydrogen concentrations and strain rates was *** hybrid Monte Carlo(MC)and molecular dynamics(MD)simulations,it was found that Cr atoms were segregated at grain boundaries(GB)and inhibited the GB ***,Cr segregation improved the strength and plasticity of the nanocrystalline Fe-Cr alloys,especially the HE ***,the Cr segregation reduced the diffusion coefficient of hydrogen and inhibited hydrogen-induced *** work provided new insight into the development of iron-based alloys with high HE resistance in the future.

关键词： Hydrogen embrittlement Molecular dynamics simulations Cr segregation Grain boundary Nanocrystalline materials

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Data and Machine Learning in Polymer science

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Chinese Journal of Polymer science 2023年第9期41卷 1371-1376,I0006页

作者： Yun-Qi Li Ying Jiang Li-Quan Wang Jian-Feng Li Department of Polymer Materials and Engineering College of Materials and MetallurgyGuizhou UniversityGuiyang550025China School of Chemistry Beihang UniversityBeijing100191China Shanghai Key Laboratory of Advanced Polymeric Materials School of Materials Science and EngineeringEast China University of Science and TechnologyShanghai200237China The State Key Laboratory of Molecular Engineering of Polymers Department of Macromolecular ScienceFudan UniversityShanghai200433China

Data-driven innovation has shown great power in solving problems in multifactor correlation,convergence and optimization,synergistic and antagonistic effects,pattern and boundary identification,critical behavior and phase transition,which are ubiquitous in polymer *** for the in-depth understanding of physical problems or in the discovery of new polymer materials,integrating data and machine learning into conventional experimental,theoritical,modeling and simulation approaches becomes *** we present a perspective based on our research interests,highlight some key issues and provide a prospection in this emerging *** focus on a number of typical advances in the description and identification of polymer conformation and structures,and the interpretation and prediction of structureproperty correlations,that have applied data and machine learning in polymer science.

关键词： Machine learning Big data Structure-property relationship Optimization Prediction

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