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Journal of Rare Earths 2024年第5期42卷 1001-1008,I0007页

作者： Zhen Zhang Huanhuan Chen Shiju Cao Jinhua Peng Peng Guo Chang Long Shan Wang Chang Chen Yong Wu Ji'an Huang Xiaodong Du Haigen Wei School of materials Science and Engineering Hefei University of TechnologyHefei230009China NationalLocal Joint Research Center of Non-ferrous Metal materials and Processing Technology Hefei230009China Laboratory of Nonferrous Metal Material and Processing Engineering of Anhui Province Hefei230009China School of materials Science and Engineering Jiangsu University of Science and TechnologyZhenjiang212003China institute of Industry and Equipment Technology Hefei University of TechnologyHefei230009China Faculty of materials {1. and Chemistry Jiangxi University of Science and TechnologyGanzhou341000China

Hot-extrusion and cold-rolling were conducted on Mg-Ce binary alloys to explore the effect of cerium(Ce)on microstructure,texture and mechanical properties of Mg *** addition of Ce results in significant grain refinement both in as-cast and hot-extruded *** basal texture is also weakened after extrusion and an inclined basal texture is formed with Ce *** strength and elongation of the Mg-Ce alloys are improved simultaneously due to such grain refinement and texture weakening *** cold-rolling,plenty of twins are found in the pure Mg and AZ31.plates while grains in the Mg-0.3Ce plate deform more uniformly without lamellar twin ***,Mg-0.3Ce alloys own strong and continuous strain hardening because Ce atoms and Mg-Ce precipitated phases serve as obstacles for dislocation slip.

关键词： Mg-Ce alloys Hot extrusion Cold-rolling Rare earths

Evolution of interfacial heat transfer,contact behavior and microstructure during sub-rapid solidification of molten steel with different hydrogen contents

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Journal of Iron and Steel Research International 2024年第1期31卷 215-223页

作者： Cheng Lu Wan-lin Wang Chen-yang Zhu Jie Zeng Xin-yuan Liu Hua-long Li School of metallurgy and Environment Central South UniversityChangsha410083HunanChina National Center for International Research of Clean metallurgy Central South UniversityChangsha410083HunanChina institute of Research of Iron and Steel ShasteelZhangjiagang215625JiangsuChina

Typical Q235 low-carbon steel samples with different hydrogen contents(0.0004,0.0008,and 0.001. wt.%)were prepared by adjusting the environment humidity and *** effects of hydrogen on interfacial heat transfer,contact behavior,and microstructure evolution were investigated using a novel droplet solidification *** results revealed that when the hydrogen content increases from 0.0004 to 0.001. wt.%,the maximum heat flux between the molten steel and cooling substrate decreases from 8.01.to 6.1. MW/m^(2),and the total heat removed in the initial 2 s reduces from 1..30 to 8.27 MJ/m^(2).Moreover,the final contact angle between the molten steel and substrate increases from 1.3.741.to 1.3.697°,and the number of pores on the droplet bottom surface increases significantly from 21.to 21. with the increase in *** surface roughness of the droplet bottom surface increases from 20.902 to 49.1.1.*** addition,the average grain size of the droplet increases from 1..778 to 33.548 pm with the increase in the hydrogen *** interfacial contact condition becomes worse due to the escape of hydrogen from the steel matrix during the cooling process,which leads to the reduction in the interfacial heat transfer and the increase in the grain size.

关键词： Strip casting Hydrogen content Interfacial heat transfer behavior Contact behavior Microstructure evolution

Universal insertion of molecules in ionic compounds under pressure

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National Science Review 2024年第1期11卷 120-128页

作者： Feng Peng Yanming Ma Chris J.Pickard Hanyu Liu Maosheng Miao College of Physics and Electronic Information Luoyang Normal University Department of Chemistry and Biochemistry California State University Northridge State Key Laboratory of Superhard materials & Key Laboratory of Material Simulation Methods and Software of Ministry of Education College of Physics Jilin University International Center of Future Science Jilin University Department of materials Science & {1. University of Cambridge Advanced institute for {1. Research Tohoku University Department of Earth Science University of California Santa Barbara

Using first-principles calculations and crystal structure search methods, we found that many covalently bonded molecules such as H2, N2, CO2, NH3, H2O and CH4may react with NaC l, a prototype ionic solid,and form stable compounds under pressure while retaining their molecular structure. These molecules,despite whether they are homonuclear or heteronuclear, polar or non-polar, small or large, do not show strong chemical interactions with surrounding Na and Cl ions. In contrast, the most stable molecule among all examples, N2, is found to transform into cyclo-N5-anions while reacting with NaC l under high pressures. It provides a new route to synthesize pentazolates, which are promising green energy materials with high energy density. Our work demonstrates a unique and universal hybridization propensity of covalently bonded molecules and solid compounds under pressure. This surprising miscibility suggests possible mixing regions between the molecular and rock layers in the interiors of large planets.

关键词： molecule-solid hybrid materials high-pressure crystal structure prediction density functional theory planet interior

Pool bio-oxidation and fitting analysis of low-grade arsenic-containing refractory gold ore

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Green Chemical Engineering 2024年第4期5卷 511-518页

作者： Jiafeng Li Linlin Tong Haijun Zhang Qiao Chen Hongying Yang Lingling Shen Yiqin Zhai Rongfan Yao School of Mines China University of Mining and Technology School of metallurgy Northeastern University School of Chemical Engineering Technology China University of Mining and Technology School of materials Science and Engineering Lanzhou University of Technology School of Intelligent Manufacturing Jiangsu Vocational Institute of Architectural Technology

To overcome the limitations of geography, climate, and ore characteristics on the ore beneficiation process, biooxidation studies on low-grade arsenic-bearing refractory gold ore by pool leaching were carried out, as well as process fitting analysis. The gold particles are encapsulated by pyrite and arsenopyrite. After 60 days of biooxidation, the oxidation rates of arsenic, sulfur, and gold were 39%～69%, 24%～41., and 49%～83%, respectively. The inoculated Acidithiobacillus ferrooxidans, Ferroplasma acidiphilum, and Leptospirillum ferrodiazotrophum could all mediate the initial pyrite/arsenopyrite oxidation and the Fe2+oxidation reaction, but only the former could mediate the subsequent sulfur compound oxidation. When compared to daily bacterial circulation and bacterial replacement every ten days, aeration improved the gold leaching rate by 1.%～22%. The Boltzmann model could fit both the arsenic and sulfur bio-oxidation, with model fit variances greater than 0.98. Based on the experimental and fitting results, the bio-oxidation cycle was determined to be 60 days, and the bio-oxidation mechanisms are summarized. This study has significant practical implications for the rational utilization of gold resources and provides theoretical and practical guidance for similar gold ores.

关键词： Refractory gold ore Bio-oxidation Pool leaching Boltzmann model

Effect of hafnium and molybdenum addition on inclusion characteristics in Co-based dual-phase high-entropy alloys

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International Journal of Minerals,metallurgy and {1. 2024年第7期31卷 1639-1650页

作者： Yong Wang Wei Wang Joo Hyun Park Wangzhong Mu Key Laboratory for Ferrous metallurgy and Resources Utilization of Ministry of Education&Hubei Provincial Key Laboratory for New Processes of Ironmaking and Steelmaking Wuhan University of Science and TechnologyWuhan 430081China Department of materials Science and Engineering KTH Royal Institute of TechnologySE-10044StockholmSweden Department of Chemical Engineering Northeast Electric Power UniversityJilin 132012China Department of materials Science and Chemical Engineering Hanyang UniversityAnsan 15588Korea Engineering materials Division of Materials ScienceDepartment of Engineering Science and MathematicsLuleå University of Technology97187 LuleåSweden

Specific grades of high-entropy alloys(HEAs)can provide opportunities for optimizing properties toward high-temperature *** this work,the Co-based HEA with a chemical composition of Co_(47.5)Cr_(30)Fe_(7.5)Mn_(7.5)Ni_(7.5)(at%)was *** refractory metallic elements hafnium(Hf)and molybdenum(Mo)were added in small amounts(1.5at%)because of their well-known positive effects on high-temperature *** characteristics were comprehensively explored by using a two-dimensional cross-sectional method and extracted by using a three-dimensional electrolytic extraction *** results revealed that the addition of Hf can reduce Al_(2)O_(3)inclusions and lead to the formation of more stable Hf-rich inclusions as the main *** addition cannot influence the inclusion type but could influence the inclusion characteristics by affecting the physical parameters of the HEA *** calculated coagulation coefficient and collision rate of Al_(2)O_(3)inclusions were higher than those of HfO_(2)inclusions,but the inclusion amount played a larger role in the agglomeration behavior of HfO_(2)and Al_(2)O_(3)*** impurity level and active elements in HEAs were the crucial factors affecting inclusion formation.

关键词： high-entropy alloy non-metallic inclusion agglomeration thermodynamics alloying

Two-Dimensional Metallophthalocyanine Nanomaterials for Electrocatalytic Energy Conversion

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Energy & Environmental materials 2024年第4期7卷 364-385页

作者： Xinqi Wang Shaohui Sun Jiahao Yao Hao Wan Renzhi Ma Wei Ma School of Chemical Engineering and Zhongyuan Critical Metals Laboratory Zhengzhou University Research Center for materials Nanoarchitectonics (MANA) National Institute for Materials Science (NIMS)

Crowing energy demand drives the rapid development of clean and reliable energy *** the past years,the exploration of novel materials with considerable efficiency and durability has drawn attention in the area of elec... 详细信息

关键词： conjugated nanostructure electrocatalysis 2D metallophthalocyanines

Metallic Sb-stabilized porous silicon with stable SEI and high electron/ion conductivity boosting lithium-ion storage performance

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Rare Metals 2024年第9期43卷 4234-4242页

作者： Jia-Guo Deng Hao-Qin Feng Yu-Long Xu Si-Guang Guo Jian-Ping Li Kai-Fu Huo Ji-Jiang Fu Biao Gao Pual-K.Chu The State Key Laboratory of Refractories and metallurgy and {1. of Advanced materials and Nanotechnology Wuhan University of Science and TechnologyWuhan 430081China Wuhan National Laboratory for Optoelectronics(WNLO) School of Optical and Electronic InformationHuazhong University of Science and TechnologyWuhan 430074China Department of Physics Department of Materials Science&Engineeringand Department of Biomedical EngineeringCity University of Hong KongHong Kong 999077China

Silicon(Si)has mild discharge potential and high theoretical capacity,making it a highly desirable material for lithium-ion batteries(LIBs).Nevertheless,the excessive volume expansion,poor ion/electron conductiv ity and unstable solid electrolyte interface(SEI)hinde practical application to ***,the metallic antimony(Sb)stabilized porous Si(SiDSb)composite was prepared by magnesiothermic reduction of Sb_(2)O_(3)and Mg_(2)Si and chemical etching to remove the by-product of *** highly conductive Sb nanodots embedded in the Si liga ments promote not only the formation of conductive and stable LiF-rich SEI,but also the electron/ion transpor ability of *** to the outstanding bulk/interface stability,excellent conductivity,as well as ideal porous structure,the SiDSb electrode demonstrates a capacity of820 mAh·g^(-1.after undergoing 320 turns at 1.00 mA·g^(-1..Additionally,it exhibits a stable capacity of 675 m Ah·g^(-1.when tested at a higher current density of 5000 m A·g^(-1..The results reveal a viable solution to solve three problems at the same time,namely the poor conductivity,inferior SEI and excessive volume expansion of Si,boding well for the design of Si-based materials for high-energy LIBs.

关键词： Silicon Anodes Lithium-ion batteries Antimony Solid electrolyte interphase

Topological Confinement in Reversibly Interlocked Polymer Networks

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Chinese Journal of Polymer Science 2024年第2期42卷 133-140,I0004页

作者： Wan-Ting Dai Zhen-Hua Xie Yu-Bin Ke Yang You Min-Zhi Rong Ming-Qiu Zhang Key Laboratory for Polymeric Composite and Functional materials of Ministry of Education GD HPPC LabIGCMESchool of ChemistrySun Yat-sen UniversityGuangzhou510275China Spallation Neutron Source Science Center China Spallation Neutron SourceDongguan523803China institute of High Energy Physics Chinese Academy of SciencesBeijing100049China College of materials and {1. Guizhou UniversityGuiyang550025China

Recently, we reported a series of reversibly interlocked polymer networks(RILNs), whose mechanical robustness and functionalities improvement was believed to be derived from topological interlocking of two sub-networks, although the direct evidence for the deduction is still lacking. Herein, a specially-designed RILNs system, in which the inter-component hydrogen bonds can be shielded as needed, was prepared and used to study the micro-structures of RILNs, aiming to verify the existence of mechanical interlocking in RILNs. By changing the pH of the swelling solvent, the effect exerted by the inter-component non-covalent bonds was eliminated, so detailed information of the networks structure was exposed. The small angle X-ray scattering(SAXS) and small-angle neutron scattering(SANS) results indicated that swelling-induced structural evolution of the two sub-networks mutually affected each other, even when the inter-component hydrogen bonds were absent, proving the presence of topological interlocking. The findings may help to draw a more accurate physical image and reveal the detailed structureproperty relationship of RILNs.

关键词： Reversibly interlocked polymer networks Small angle X-ray scattering Small-angle neutron scattering Topological confinement

Enhanced ferroelectric and improved leakage of BFO-based thin films through increasing entropy strategy

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International Journal of Minerals,metallurgy and {1. 2024年第10期31卷 2263-2273页

作者： Dongfei Lu Guoqiang Xi Hangren Li Jie Tu Xiuqiao Liu Xudong Liu Jianjun Tian Linxing Zhang institute for Advanced {1. Technology University of Science and Technology BeijingBeijing 100083China

BiFeO_(3)(BFO)has received considerable attention as a lead-free ferroelectric film due to its large theoretical remnant ***,BFO suffers from a large leakage current,resulting in poor ferroelectric ***,the sol-gel method was used to deposit a series of BFO-based thin films on fluorine-doped tin oxide substrates,and the effects of the substitution of the elements Co,Cu,Mn(B-site)and Sm,Eu,La(A-site)on the crystal structure,ferroelectricity,and leakage current of the BFO-based thin films were *** confirmed that lattice distortion by X-ray diffraction can be attributed to the substitution of individual elements in the BFO-based *** and Eu substitutions contribute to the lattice distortion in a pseudo-cubic structure,while La is biased toward *** force microscopy confirmed that reversible switching of ferroelectric domains by nearly 1.0°can be realized through the prepared *** ferroelectric hysteresis loops showed that the order for the polarization contribution is as follows:Cu>Co>Mn(B-site),Sm>La>Eu(A-site).The current density voltage curves indicated that the order for leakage contribution is as follows:Mn1.0 to 8.4 mA/cm^(2)at a field strength of 1.0 kV/***,based on the increasing entropy strategy of chemical engineering,this st

关键词： increasing entropy synergistic ferroelectric film remnant polarization leakage current

Influence of processing history on microstructure， mechanical properties， and electrical conductivity of Cu-0.7Mg alloy

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Transactions of Nonferrous Metals Society of China 2024年

作者： Alireza KALHOR Kinga RODAK Marek TKOCZ Bartosz CHMIELA Ivo SCHINDLER ?ukasz POLOCZEK Krzysztof RADWA?SKI Hamed MIRZADEH Marian KAMPIK Faculty of materials Engineering， Silesian University of Technology V?B – Technical University of Ostrava， Faculty of materials Science and Technology materials Research Group， ?ukasiewicz Upper Silesian {1. of Technology School of metallurgy and {1. Engineering， College of Engineering， University of Tehran Faculty of Electrical Engineering， Silesian University of Technology

The effects of forward extrusion as well as extrusion combined with reversible torsion (KoBo extrusion)， followed by additional deformation via the MaxStrain module of the Gleeble thermomechanical simulator， on the microstructure， mechanical properties， and electrical conductivity of a Cu-0.7Mg (wt.%) alloy， were investigated in this work. The simulation results highlighted the critical influence of processing history in determining the equivalent strain distribution. The sample subjected to forward extrusion at 400 ℃and subsequent MaxStrain processing (FM sample)， possessed 76% lower grain size compared to the sample processed solely with MaxStrain (AM sample). Likewise， the KoBo-extruded and MaxStrain-processed sample (KM sample) exhibited 66% smaller grain size compared to the AM sample. Tensile test results revealed that the AM， FM， and KM samples， respectively， possessed 251.， 288%， and 360% higher yield strength， and 95%， 1.1.， and 1.9% higher tensile strength compared to the initial annealed alloy， as a result of grain refinement as well as deformation strengthening. Finally， the electrical conductivity measurements revealed that AM， FM， and KM samples， respectively， possessed electrical conductivity values of 37.9， 35.6， and 32.0 (MS/m)， which， considering their mechanical properties， makes them eligible to be categorized as high-strength and high-conductivity copper alloys.

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