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Influence of Carbon Content on Element Diffusion in Silicon Carbide-Based TRISO Composite Fuel
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作者 Xiaojiao Wang Libing Zhu +1 位作者 Yan You Zhaoquan Zhang 《Journal of Electronic Research and Application》 2024年第5期80-88,共9页
The coating layers of Tri-structural Isotropic Particles(TRISO)serve to protect the kernel and act as barriers to fission products.Sintering aids in the silicon carbide matrix variably react with TRISO coating layers,... The coating layers of Tri-structural Isotropic Particles(TRISO)serve to protect the kernel and act as barriers to fission products.Sintering aids in the silicon carbide matrix variably react with TRISO coating layers,leading to the destruction of the coating layers.Investigating how carbon content affects element diffusion in silicon carbide-based TRISO composite fuel is of great significance for predicting reactor safety.In this study,silicon carbide-based TRISO composite fuels with different carbon contents were prepared by adding varying amounts of phenolic resin to the silicon carbide matrix.X-ray Diffraction(XRD)and Scanning Electron Microscopy(SEM)were employed to characterize the phase composition,morphology,and microstructure of the composite fuels.The elemental content in each coating layer of TRISO was quantified using Energy-Dispersive X-ray Spectroscopy(EDS).The results demonstrated that the addition of phenolic resin promoted the uniform distribution of sintering aids in the silicon carbide matrix.The atomic percentage(at.%)of aluminum(Al)in the pyrolytic carbon layer of the TRISO particles reached its lowest value of 0.55%when the phenolic resin addition was 1%.This is because the addition of phenolic resin caused the Al and silicon(Si)in the matrix to preferentially react with the carbon in the phenolic resin to form a metastable liquid phase,rather than preferentially consuming the pyrolytic carbon in the outer coating layer of the TRISO particles.The findings suggest that carbon addition through phenolic resin incorporation can effectively mitigate the deleterious reactions between the TRISO coating layers and sintering aids,thereby enhancing the durability and safety of silicon carbide-based TRISO composite fuels. 展开更多
关键词 silicon carbide TRISO composite fuel Diffusion behavior carbon content
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Multi-scale design of silicon/carbon composite anode materials for lithium-ion batteries:A review
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作者 Liu Yang Shuaining Li +6 位作者 Yuming Zhang Hongbo Feng Jiangpeng Li Xinyu Zhang Huai Guan Long Kong Zhaohui Chen 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第10期30-45,I0002,共17页
Silicon/carbon composites,which integrate the high lithium storage performance of silicon with the exceptional mechanical strength and conductivity of carbon,will replace the traditional graphite electrodes for high-e... Silicon/carbon composites,which integrate the high lithium storage performance of silicon with the exceptional mechanical strength and conductivity of carbon,will replace the traditional graphite electrodes for high-energy lithium-ion batteries.Various strategies have been designed to synthesize silicon/carbon composites for tackling the issues of anode pulverization and poor stability in the anodes,thereby improving the lithium storage ability.The effect of the regulation method at each scale on the final negative electrode performance remains unclear.However,it has not been fully clarified how the regulation methods at each scale influence the final anode performance.This review will categorize the materials structure into three scales:molecular scale,nanoscale,and microscale.First,the review will examine modification methods at the molecular scale,focusing on the interfacial bonding force between silicon and carbon.Next,it will summarize various nanostructures and special shapes in the nanoscale to explore the construction of silicon/carbon composites.Lastly,the review will provide an analysis of microscale control approaches,focusing on the formation of composite particle with micron size and the utilization of micro-Si.This review provides a comprehensive overview of the multi-scale design of silicon/carbon composite anode materials and their optimization strategies to enhance the performance of lithium-ion batteries. 展开更多
关键词 Lithium-ion batteries silicon/carbon composites Molecular scale Nanoscale MICROSCALE
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Preparation and Analysis of Carbon Fiber-Silicon Carbide Thermally Conductive Asphalt Concrete
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作者 Zhiyong Yang Enjie Hu +3 位作者 Lei Xi Zhi Chen Feng Xiong Chuanhai Zhan 《Fluid Dynamics & Materials Processing》 EI 2024年第4期705-723,共19页
An experimental investigation into the thermal conductivity of CF-SiC two-phase composite asphalt concrete is presented.The main objective of this study was to verify the possibility of using SiC powder instead of min... An experimental investigation into the thermal conductivity of CF-SiC two-phase composite asphalt concrete is presented.The main objective of this study was to verify the possibility of using SiC powder instead of mineral powder as the thermal conductive filler to prepare a new type of asphalt concrete and improve the efficiency of electrothermal snow and ice melting systems accordingly.The thermal conductivity of asphalt concrete prepared with different thermally conductive fillers was tested by a transient plane source method,and the related performances were measured.Then the temperature rise rate and surface temperature were studied through field heating tests.Finally,the actual ice melting efficiency of the thermally conductive asphalt concrete was evaluated using an effective electrothermal system.As shown by the experimental results,the composite made of SiC powder and carbon fiber has a high thermal conductivity.When SiC replaces mineral powder,the thermal conductivity of the asphalt mixture increases first and then decreases with the increase of carbon fiber content.In the present study,in particular,the thermal conductivity attained a peak when the carbon fiber content was 0.2%of the aggregate mass. 展开更多
关键词 carbon fiber silicon carbide thermally conductive asphalt concrete road performance electrothermal snow melting
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Research Progress of Carbon-Silicone Composite Materials
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作者 Beibei Liu Rongjie Kan 《Expert Review of Chinese Chemical》 2024年第2期1-7,共7页
Silicone is a kind of polymer material with high cross-linked structure,which is com-posed by Si-O-Si main chain.Due to the special molecular chain structure,silicone mate-rials are characterized by oxidation resistan... Silicone is a kind of polymer material with high cross-linked structure,which is com-posed by Si-O-Si main chain.Due to the special molecular chain structure,silicone mate-rials are characterized by oxidation resistance,aging resistance,high and low temperature resistance and chemical corrosion resistance.Moreover,silicone materials have process-able properties,simple forming process,good mechanical property,non-toxic and pollution-free.Therefore,silicone has been widely concerned by researchers at home and abroad.In this paper,the main research progress and application directions of carbon-silicone composite at home and abroad in recent years are reviewed. 展开更多
关键词 carbon materials GRAPHEME siliconE composite materials
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Research on Silicon Carbide Dispersion-Reinforced Hypereutectic Aluminum-Silicon Electronic Packaging Materials
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作者 Ruixi Guo Yunhao Hua Tianze Jia 《Journal of Electronic Research and Application》 2024年第2期86-94,共9页
The objective of this study is to improve the mechanical properties and machining performance of high thermal conductivity and low expansion silicon carbide dispersion-strengthened hypereutectic aluminum-silicon elect... The objective of this study is to improve the mechanical properties and machining performance of high thermal conductivity and low expansion silicon carbide dispersion-strengthened hypereutectic aluminum-silicon electronic packaging materials to meet the needs of aviation,aerospace,and electronic packaging fields.We used the powder metallurgy method and high-temperature hot pressing technology to prepare SiC/Al-Si composite materials with different SiC contents(5vol%,10vol%,15vol%,and 20vol%).The results showed that as the SiC content increased,the tensile strength of the composite material first increased and then decreased.The tensile strength was the highest when the SiC content was 15%;the sintering temperature significantly affected the composite material’s structural density and mechanical properties.Findings indicated 700℃was the optimal sintering and the optimal SiC content of SiC/Al-Si composite materials was between 10%and 15%.Besides,the sintering temperature should be strictly controlled to improve the material’s structural density and mechanical properties. 展开更多
关键词 silicon carbide Electronic packaging materials Powder metallurgy Mechanical properties composite materials
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Preparation and properties of porous silicon carbide ceramics through coat-mix and composite additives process 被引量:2
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作者 赵宏生 刘中国 +3 位作者 杨阳 刘小雪 张凯红 李自强 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2011年第6期1329-1334,共6页
The core-shell structure silicon-resin precursor powders were synthesized through coat-mix process and addition of Al2O3-SiO2-Y2O3 composite additives.A series of porous silicon carbide ceramics were produced after mo... The core-shell structure silicon-resin precursor powders were synthesized through coat-mix process and addition of Al2O3-SiO2-Y2O3 composite additives.A series of porous silicon carbide ceramics were produced after molding,carbonization and sintering.The phase,morphology,porosity,thermal conductivity,thermal expansion coefficient,and thermal shock resistance were analyzed.The results show that porous silicon carbide ceramics can be produced at low temperature.The grain size of porous silicon carbide ceramic is small,and the thermal conductivity is enhanced significantly.Composite additives also improve the thermal shock resistance of porous ceramics.The bending strength loss rate after 30 times of thermal shock test of the porous ceramics which were added Al2O3-SiO2-Y2O3 and sintered at 1 650 ℃ is only 6.5%.Moreover,the pore inside of the sample is smooth,and the pore size distribution is uniform.Composite additives make little effect on the thermal expansion coefficient of the porous silicon carbide ceramics. 展开更多
关键词 silicon carbide porous ceramic coat-mix composite additives
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On the Strength of Silicon Carbide Particulate Reinforced Aluminium Alloy Matrix Composites 被引量:4
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作者 Mingjiu ZHAO, Yue LIU, Liqing CHEN and Jing BIInstitute of Metal Research, Chinese Academy of Sciences, Shenyang 110016, China 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2004年第4期451-453,共3页
In the present study, the modified continuum model, quench strengthening and dislocation pile-up model was respectively used to estimate the yield strength of SiCp/AI composites. The experimental results showed that t... In the present study, the modified continuum model, quench strengthening and dislocation pile-up model was respectively used to estimate the yield strength of SiCp/AI composites. The experimental results showed that the modified shear lag model or quench strengthening model would underestimate the yield strength of SiCp/AI composites. However, the modified Hall-Petch correlation on the basis of the dislocation pile-up model, expressed as σcy = 244 + 371λ-1/2, fitted very well with the experimental data, which indicated that the strength increase of SiCp/AI composites might be due to the direct blocking of dislocation motion by the particulate-matrix interface. Namely, the dislocation pile-up is the most possible strengthening mechanism for SiCp/AI composites. 展开更多
关键词 silicon carbide particulate composites Shear lag model Quench strengthening model Dislocation pile-up model Hall-Petch correlation
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Diffusion Bonding of Silicon Carbide Particulate Reinforced 2024 Al Composites 被引量:6
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作者 Mingjiu ZHAO+, Liqing CHEN and Jing BI (Metal Matrix Composites Department, Institute of Metal Research, Chinese Academy of Sciences, Shenyang 110015, China) Gang ZHANG (Shenyang Institute of Technology, Shenyang 110015, China) 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2000年第5期471-474,共4页
A study has been made on diffusion bonding of SiCp/2024Ai composites by means of pure Al interlayer. In the condition of TB=843 K, PB=16 MPa, tB= 60 min, the diffusion bonded joint, with a shear strength of 235 MPa, w... A study has been made on diffusion bonding of SiCp/2024Ai composites by means of pure Al interlayer. In the condition of TB=843 K, PB=16 MPa, tB= 60 min, the diffusion bonded joint, with a shear strength of 235 MPa, was obtained when a 15 μm thick interlayer was used. The results of the shear testing and SEM indicate that fracture of the joint presented characteristics of ductile rupture. 展开更多
关键词 Diffusion Bonding of silicon carbide Particulate Reinforced 2024 Al composites SICP AL
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Finite element simulation of the micromachining of nanosized-silicon-carbide-particle reinforced composite materials based on the cohesive zone model
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作者 Hongmin Pen Jianhua Guo +2 位作者 Zizhen Cao Xianchong Wang Zhiguo Wang 《Nanotechnology and Precision Engineering》 EI CAS CSCD 2018年第4期242-247,共6页
A finite element method based on the cohesive zone model was used to study the micromachining process of nanosized silicon-carbide-particle(SiCp) reinforced aluminum matrix composites. As a hierarchical multiscale sim... A finite element method based on the cohesive zone model was used to study the micromachining process of nanosized silicon-carbide-particle(SiCp) reinforced aluminum matrix composites. As a hierarchical multiscale simulation method, the parameters for the cohesive zone model were obtained from the stress-displacement curves of the molecular dynamics simulation. The model considers the random properties of the siliconcarbide-particle distribution and the interface of bonding between the silicon carbide particles and the matrix.The machining mechanics was analyzed according to the chip morphology, stress distribution, cutting temperature, and cutting force. The simulation results revealed that the random distribution of nanosized SiCp causes non-uniform interaction between the tool and the reinforcement particles. This deformation mechanics leads to inhomogeneous stress distribution and irregular cutting force variation. 展开更多
关键词 Multiscale COHESIVE zone model NANOSIZED silicon carbide particles composite MATERIALS MICROMACHINING
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Machining studies of die cast aluminum alloy-silicon carbide composites
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作者 Thambu Sornakumar Marimuthu Kathiresan 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2010年第5期648-653,共6页
Metal matrix composites (MMCs) with high specific stiffness, high strength, improved wear resistance, and thermal properties are being increasingly used in advanced structural, aerospace, automotive, electronics, an... Metal matrix composites (MMCs) with high specific stiffness, high strength, improved wear resistance, and thermal properties are being increasingly used in advanced structural, aerospace, automotive, electronics, and wear applications. Aluminum alloy-silicon carbide composites were developed using a new combination of the vortex method and the pressure die-casting technique in the present work. Machining studies were conducted on the aluminum alloy-silicon carbide (SiC) composite work pieces using high speed steel (HSS) end-mill tools in a milling machine at different speeds and feeds. The quantitative studies on the machined work piece show that the surface finish is better for higher speeds and lower feeds. The surface roughness of the plain aluminum alloy is better than that of the aluminum alloy-silicon carbide composites. The studies on tool wear show that flank wear increases with speed and feed. The end-mill tool wear is higher on machining the aluminum alloy-silicon carbide composites than on machining the plain aluminum alloy. 展开更多
关键词 metal matrix composites aluminum alloys silicon carbide die casting MILLING surface roughness
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Evidence of the Role of Carbon Vacancies in Nickel-Based Ohmic Contacts to n-Type Silicon Carbide 被引量:1
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作者 郭辉 张义门 张玉明 《Journal of Semiconductors》 EI CAS CSCD 北大核心 2007年第1期5-9,共5页
N-wells are created by P+ ion implantation into Si-faced p-type 4H-SiC epilayer. Ti and Ni are deposited in sequence on the surface of the active regions. Ni2Si is identified as the dominant phase by X-ray diffracti... N-wells are created by P+ ion implantation into Si-faced p-type 4H-SiC epilayer. Ti and Ni are deposited in sequence on the surface of the active regions. Ni2Si is identified as the dominant phase by X-ray diffraction (XRD) analysis after metallization annealing. An amorphous C film at the Ni2 Si/SiC interface is confirmed by an X-ray energy-dispersive spectrometer (XEDS). The Ni2Si and amorphous C film are etched away selectively,followed by deposition of new metal films without annealing. Measurement of the current-voltage characteristics shows that the contacts are still ohmic after the Ni2 Si and amorphous C film are replaced by new metal films. The sheet resistance Rsh of the implanted layers decreases from 975 to 438f2/D, because carbon vacancies (Vc) appeared during annealing,which act as donors for electrons in SiC. 展开更多
关键词 NI ohmic contact silicon carbide carbon vacancies P^+ ion implantation
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Microstructure and properties of electronic packaging shell with high silicon carbide aluminum-base composites by semi-solid thixoforming
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作者 郭明海 刘俊友 +2 位作者 贾成厂 贾琪瑾 果世驹 《Journal of Central South University》 SCIE EI CAS 2014年第11期4053-4058,共6页
The electronic packaging shell with high silicon carbide aluminum-base composites was prepared by semi-solid thixoforming technique. The flow characteristic of the Si C particulate was analyzed. The microstructures of... The electronic packaging shell with high silicon carbide aluminum-base composites was prepared by semi-solid thixoforming technique. The flow characteristic of the Si C particulate was analyzed. The microstructures of different parts of the shell were observed by scanning electron microscopy and optical microscopy, and the thermophysical and mechanical properties of the shell were tested. The results show that there exists the segregation phenomenon between the Si C particulate and the liquid phase during thixoforming, the liquid phase flows from the shell, and the Si C particles accumulate at the bottom of the shell. The volume fraction of Si C decreases gradually from the bottom to the walls. Accordingly, the thermal conductivities of bottom center and walls are 178 and 164 W·m-1·K-1, the coefficients of thermal expansion(CTE) are 8.2×10-6 and 12.6×10-6 K-1, respectively. The flexural strength decreases slightly from 437 to 347 MPa. The microstructures and properties of the shell show gradient distribution. 展开更多
关键词 high silicon carbide aluminum-base composites electronic packaging semi-solid thixoforming thermal conductivity coefficient of thermal expansion
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Research progress on silicon/carbon composite anode materials for lithium-ion battery 被引量:37
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作者 Xiaohui Shen Zhanyuan Tian +5 位作者 Ruijuan Fan Le Shao Dapeng Zhang Guolin Cao Liang Kou Yangzhi Bai 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2018年第4期1067-1090,共24页
Silicon (Si) has been considered as one of the most promising anode material for tHe next generation lithium-ion batteries (LIBs) with high energy densities, due to its high theoretical capacity, abundant availabi... Silicon (Si) has been considered as one of the most promising anode material for tHe next generation lithium-ion batteries (LIBs) with high energy densities, due to its high theoretical capacity, abundant availability and environmental friendliness. However. silicon materials with low intrinsic electric and ionic conductivity suffer from huge volume variation during lithiation/delithiation processes leading to the pulverization of Si and subsequently resulting in severe capacity fading of the electrodes. Coupling of Si with carbon (C) realizes a favorable combination of the two materials properties, such as high lithiation capacity of Si and excellent mechanical and conductive properties of C. making silicon/carbon composite (Si/C) ideal candidates for LIBs anodes. In this review, recent progresses of Si/C materials utilized in LIBs are summarized in terms of structural design principles, material synthesis methods, morphological characteristics and electrochemical performances by highlighting the material structures. The mechanisms behind the performance enhancement are also discussed. Moreover, other factors that affect the performance of Si/C anodes, such as prelithiation, electrolyte additives, and binders, are also discussed. We aim to present a full scope of the Si/C-based anodes, and help understand and design future structures of Si/C anodes in LIBs, 展开更多
关键词 Lithium-ion batteries Anodes silicon/carbon composite
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Structural feature and electronic property of an (8, 0) carbon-silicon carbide nanotube heterojunction 被引量:4
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作者 刘红霞 张鹤鸣 +1 位作者 胡辉勇 宋久旭 《Chinese Physics B》 SCIE EI CAS CSCD 2009年第2期734-737,共4页
A supercell of a nanotube heterojunction formed by an (8, 0) carbon nanotube (CNT) and an (8, 0) silicon carbide nanotube (SiCNT) is established, in which 96 C atoms and 32 Si atoms are included. The geometry ... A supercell of a nanotube heterojunction formed by an (8, 0) carbon nanotube (CNT) and an (8, 0) silicon carbide nanotube (SiCNT) is established, in which 96 C atoms and 32 Si atoms are included. The geometry optimization and the electronic property of the heterojunction are implemented through the first-principles calculation based on the density functional theory (DFT). The results indicate that the structural rearrangement takes place mainly on the interface and the energy gap of the heterojunction is 0.31 eV, which is narrower than those of the isolated CNT and the isolated SiCNT. By using the average bond energy method, the valence band offset and the conduction band offset are obtained as 0.71 and -0.03 eV, respectively. 展开更多
关键词 carbon nanotube/silicon carbide nanotube heterojunction electronic properties average-bond-energy method band offsets
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Semisolid forging electronic packaging shell with silicon carbon-reinforced copper composites 被引量:2
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作者 Kai-Kun Wang 《Rare Metals》 SCIE EI CAS CSCD 2013年第2期191-195,共5页
To fabricate electronic packaging shell of coppermatrix composite with characteristics of high ther mal conductivity and low thermal expansion coefficient, semisolid forming technology, and powder metallurgy was combi... To fabricate electronic packaging shell of coppermatrix composite with characteristics of high ther mal conductivity and low thermal expansion coefficient, semisolid forming technology, and powder metallurgy was combined. Conventional mechanical mixing of Cu and SiC could have insufficient wettability, and a new method of semisolid processing was introduced for billets preparation. The SiC/Cu composites were first prepared by PM, and then, semisolid reheating was performed for the successive semisolid forging. Composite billets with SiC 35 % vol ume fraction were compacted and sintered pressurelessly, microstructure analysis showed that the composites pre pared by PM had high density, and the combination between SiC particles and Cualloy was good. Semisolid reheating was the crucial factor in determining the micro structure and thixotropic property of the billet. An opti mised reheating strategy was proposed: temperature 1,025 ℃and holding time 5 min. 展开更多
关键词 Semi-solid forming silicon carbon reinforcedcopper composites Electronic packaging shell MICROSTRUCTURE
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Electrochemical behavior of insulin on pretreated carbon black electrode enhanced with silicon carbide nanostructure
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作者 郭朝中 陈昌国 +1 位作者 ZHENG Jie LUO Zhong-li 《Journal of Chongqing University》 CAS 2013年第3期103-107,共5页
We previously reported the direct electrochemical detection of insulin at bare carbon electrodes. Here a novel modified acetylene carbon black paste electrode(SiC/CB-CPE), based on the outstanding characteristics of s... We previously reported the direct electrochemical detection of insulin at bare carbon electrodes. Here a novel modified acetylene carbon black paste electrode(SiC/CB-CPE), based on the outstanding characteristics of silicon carbide nanostructure,was developed for the electrooxidation of insulin in alkaline solution and it was characterized by cyclic voltammetry(CV) and electrochemical impedance spectroscopy(EIS) in 5 mmol/L Fe(CN)63-/4- solution. It is found that silicon carbide nanostructure doped into the CB-CPE greatly facilitates the redox electrochemistry of Fe(CN)63-/4- probe and the electrochemical oxidation of insulin. The electrooxidation of insulin is a one-electron and one-proton reaction and an irreversible adsorption-controlled electrode process. The anodic oxidation current increases linearly with the concentration of insulin from 1×10-7mol/L to1.2×10-6mol/L in 0.1 mol/L Na2CO3-NaHCO3 buffer solution(pH 10.0) and the detection limit was 50 nmol/L. In addition, the SiC/CB-CPE shows good sensitivity, reproducibility, renewability and capacity of resisting disturbance. 展开更多
关键词 silicon carbide nanostructure ELECTROOXIDATION INSULIN carbon black carbon paste electrode
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Effect of Strain on the Electrical Resistance of Carbon Nanotube/Silicone Rubber Composites
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作者 曾尤 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2011年第5期812-816,共5页
Carbon nanotube (CNT) filled silicone rubber (SR) composites were synthesized by in situ polymerization.The effect of strain on the electrical resistance of the CNT/SR composites and the structure evolution of CNT... Carbon nanotube (CNT) filled silicone rubber (SR) composites were synthesized by in situ polymerization.The effect of strain on the electrical resistance of the CNT/SR composites and the structure evolution of CNT networks during tensile deformation were investigated.The results showed that the CNT/SR composites had high sensitivity of resistance-strain response.In a wide strain range (0-125%),the change of resistivity could reach 107,which was closely associated with the evolution process of the conductive CNT-network structure.The volume expansion of the composites in the tensile process led to a gradual decrease in the volume fraction of CNTs with the strain increase.When CNT loading was lower than the percolation threshold,CNT network was in disconnected state with a rapid increase in electrical resistance of the composites.Furthermore,the CNT loading had remarkable effect on the sensitivity of resistance-strain response in the composites. 展开更多
关键词 carbon nanotubes silicone rubber composite resistance-strain response
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Density functional theory calculation of the properties of carbon vacancy defects in silicon carbide
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作者 XiuhongWang Junlei Zhao +4 位作者 Zongwei Xu Flyura Djurabekova Mathias Rommel Ying Song Fengzhou Fanga 《Nanotechnology and Precision Engineering》 CAS CSCD 2020年第4期211-217,共7页
As a promisingmaterial for quantumtechnology,silicon carbide(SiC)has attracted great interest inmaterials science.Carbon vacancy is a dominant defect in 4H-SiC.Thus,understanding the properties of this defect is criti... As a promisingmaterial for quantumtechnology,silicon carbide(SiC)has attracted great interest inmaterials science.Carbon vacancy is a dominant defect in 4H-SiC.Thus,understanding the properties of this defect is critical to its application,and the atomic and electronic structures of the defects needs to be identified.In this study,density functional theorywas used to characterize the carbon vacancy defects in hexagonal(h)and cubic(k)lattice sites.The zero-phonon line energies,hyperfine tensors,and formation energies of carbon vacancies with different charge states(2−,−,0,+and 2+)in different supercells(72,128,400 and 576 atoms)were calculated using standard Perdew-Burke-Ernzerhof and Heyd-Scuseria-Ernzerhof methods.Results show that the zero-phonon line energies of carbon vacancy defects are much lower than those of divacancy defects,indicating that the former is more likely to reach the excited state than the latter.The hyperfine tensors of VC+(h)and VC+(k)were calculated.Comparison of the calculated hyperfine tensor with the experimental results indicates the existence of carbon vacancies in SiC lattice.The calculation of formation energy shows that the most stable carbon vacancy defects in the material are VC 2+(k),VC+(k),VC(k),VC−(k)and VC 2−(k)as the electronic chemical potential increases. 展开更多
关键词 Density functional theory silicon carbide carbon vacancy
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Fabrication of Silicon/Carbon Composite Material with Silicon Waste and Carbon Nanofiber Applied in Lithium-Ion Battery
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作者 Ying-Yang Li Che-Ya Wu +1 位作者 Tzu-Ying Lin Jenq-Gong Duh 《Journal of Environmental Protection》 2022年第1期150-160,共11页
Silicon (Si) is regarded as a promising material for lithium-ion battery anode because of high theoretical capacity. Nevertheless, Si faces particle pulverization and rapid capacity fading due to serious volume change... Silicon (Si) is regarded as a promising material for lithium-ion battery anode because of high theoretical capacity. Nevertheless, Si faces particle pulverization and rapid capacity fading due to serious volume change during the lithiation and the delithiation process. In this work, a silicon/carbon composite constituted to Si powder and carbon nanofiber (CNF) is produced to solve the above issues as a new design structure of anode material. The Si powder was recycled from the silicon slicing waste in photovoltaic industry and the CNF was from dry rice straws. By mixing the purified Si powder with CNF, the composite was synthesized by the freeze-drying method and calcination. In the cyclic test, Si adding with 1 wt% CNF showed 3091 mAh/g capacity in the first cycle and 1079 mAh/g capacity after 100 cycles at the current density of 0.5 A/g, which were both better than pristine Si. SEM images also show the composite structure can eliminate cracks on the surface of the electrode during cycling. CNF attaching on Si particles can increase specific surface area, so binder can easily combine the active materials and the conductive materials together. This strategy enhances the structure stability and prevents the electrode from delamination. 展开更多
关键词 composite Material carbon Nanofiber Waste silicon Anode Material Lithium-Ion Battery
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Influence of pyrolysis temperature on structure and dielectric properties of polycarbosilane derived silicon carbide ceramic 被引量:2
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作者 丁冬海 周万城 +2 位作者 周璇 罗发 朱冬梅 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2012年第11期2726-2729,共4页
β-SiC ceramic powders were obtained by pyrolyzing polycarbosilane in vacuum at 800-1200 °C. The β-SiC ceramic powders were characterized by TGA/DSC, XRD and Raman spectroscopy. The dielectric properties of β-S... β-SiC ceramic powders were obtained by pyrolyzing polycarbosilane in vacuum at 800-1200 °C. The β-SiC ceramic powders were characterized by TGA/DSC, XRD and Raman spectroscopy. The dielectric properties of β-SiC ceramic powders were investigated by measuring their complex permittivity by rectangle wave guide method in the frequency range of 8.2-18 GHz. The results show that both real part ε′ and imaginary part ε″ of complex permittivity increase with increasing pyrolysis temperature. The mechanism was proposed that order carbon formed at high temperature resulted in electron relaxation polarization and conductance loss, which contributes to the increase in complex permittivity. 展开更多
关键词 silicon carbide ceramic polycarbosilane derived SiC dielectric properties pyrolysis temperature free carbon complexpermittivity
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