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Crystal structure,phase transitions,and thermodynamic properties of magnesium metavanadate(MgV_(2)O_(6)) 被引量:1
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作者 Guishang Pei Cheng Pan +2 位作者 Dapeng Zhong Junyi Xiang Xuewei Lv 《Journal of Magnesium and Alloys》 SCIE EI CAS CSCD 2024年第4期1449-1460,共12页
As a promising anode material for magnesium ion rechargeable batteries,magnesium metavanadate(MgV_(2)O_(6))has attracted considerable research interest in recent years.A MgV_(2)O_(6)sample was synthesized via a facile... As a promising anode material for magnesium ion rechargeable batteries,magnesium metavanadate(MgV_(2)O_(6))has attracted considerable research interest in recent years.A MgV_(2)O_(6)sample was synthesized via a facile solid-state reaction by multistep-firing stoichiometric mixtures of MgO and V2O5 powder under an air atmosphere.The solid-state phase transition fromα-MgV_(2)O_(6)toβ-MgV_(2)O_(6)occurred at 841 K and the enthalpy change was 4.37±0.04 kJ/mol.The endothermic effect at 1014 K and the enthalpy change was 26.54±0.26 kJ/mol,which is related to the incongruent melting ofβ-MgV_(2)O_(6).In situ XRD was performed to investigate phase transition of the as-prepared MgV_(2)O_(6)at high temperatures.The cell parameters obtained by Rietveld refinement indicated that it crystallizes in a monoclinic system with the C2/m space group,and the lattice parameters of a=9.280 A°,b=3.501 A°,c=6.731 A°,β=111.76°.The solid-state phase transition fromα-MgV_(2)O_(6)toβ-MgV_(2)O_(6)was further studied by thermal kinetics,indicating that this process is controlled first by a fibril-like mechanism and then by a spherulitic-type mechanism with an increasing heating rate.Additionally,the enthalpy change of MgV_(2)O_(6)at high temperatures was measured utilizing the drop calorimetry,heat capacity was calculated and given as:Cp=208.3+0.03583T-4809000T^(−2)(298-923 K)(J mol^(−1)K^(−1)),the high-temperature heat capacity can be used to calculate Gibbs free energy of MgV_(2)O_(6)at high temperatures. 展开更多
关键词 MgV_(2)O_(6) crystal structure Phase transitions Thermodynamic functions
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Sensing the heavy water concentration in an H_(2)O-D_(2)O mixture by solid-solid phononic crystals
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作者 Mohammadreza Rahimi Ali Bahrami 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第4期493-498,共6页
A new method based on phononic crystals is presented to detect the concentration of heavy water(D_(2)O)in an H_(2)O-D_(2)O mixture.Results have been obtained and analyzed in the concentration range of 0%-10%and 90%-10... A new method based on phononic crystals is presented to detect the concentration of heavy water(D_(2)O)in an H_(2)O-D_(2)O mixture.Results have been obtained and analyzed in the concentration range of 0%-10%and 90%-100%D_(2)O.A proposed structure of tungsten scatterers in an aluminum host is studied.In order to detect the target material,a cavity region is considered as a sound wave resonator in which the target material with different concentrations of D_(2)O is embedded.By changing the concentration of D_(2)O in the H_(2)O-D_(2)O mixture,the resonance frequency undergoes a frequency shift.Each 1%change in D_(2)O concentration in the H_(2)O-D_(2)O mixture causes a frequency change of about 120 Hz.The finite element method is used as the numerical method to calculate and analyze the natural frequencies and transmission spectra of the proposed sensor.The performance evaluation index shows a high Q factor up to 1475758 and a high sensitivity up to 13075,which are acceptable values for sensing purposes.The other figures of merit related to the detection performance also indicate high-quality performance of the designed sensor. 展开更多
关键词 phononic crystals sensor H_(2)O-D_(2)O mixture CAVITY
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Crystallization management of CsPbI_(2)Br perovskites by PbAc_(2)-incorporated twice spin-coating process for efficient and stable CsPbI_(2)Br perovskite solar cells
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作者 Yu Liu Kun Lang +6 位作者 Huifang Han Huijing Liu Yao Fu Pengchen Zou Yinhui Lyu Jia Xu Jianxi Yao 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第10期419-428,I0008,共11页
CsPbI_(2)Br perovskite solar cell has been extensively studied due to its exceptional thermal stability and relatively stable perovskite phase structure.However,the presence of bromine leads to a rapid crystallization... CsPbI_(2)Br perovskite solar cell has been extensively studied due to its exceptional thermal stability and relatively stable perovskite phase structure.However,the presence of bromine leads to a rapid crystallization rate of CsPbI_(2)Br films,resulting in small grain size and high defect density.Additionally,CsPbI_(2)Br demonstrates poor light absorption due to its wide bandgap.Therefore,it is crucial to control the crystallization rate and increase the film thickness to reduce defect density,enhance light absorption,and improve photovoltaic performance.In this study,we utilized a PbAc_(2)-incorporated twice spincoating(PTS) process to address these issues.Initially,PbAc_(2) was added to the CsPbI_(2)Br precursor solution to form a CsPbI_(2)Br film,which was then coated with the CsPbI_(2)Br precursor solution to produce the PTS film,Ac^(-)can delay the perovskite crystallization,leading to the formation of thicker and denser CsPbI_(2)Br films.Moreover,lone-pair electrons of the oxygen atom provided by Ac^(-)formed coordination bonds with under-coordinated Pb~(2+) ions to fill halogen ion vacancies,thereby reducing the defect density.Ultimately,the PTS CsPbI_(2)Br device achieved a peak power conversion efficiency(PCE) of 16.19% and maintained 96.7% of its initial PCE over 1500 h at room temperature under 25% relative humidity without any encapsulation. 展开更多
关键词 CsPbI_(2)Br Twice spin-coating process PbAc_(2) crystallization management Perovskite solar cells
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Regulating crystal phase of TiO_(2) to enhance catalytic activity of Ni/TiO_(2) for solar-driven dry reforming of methane
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作者 HE Zhanjun GONG Kun +3 位作者 DAI Yuanyuan NIU Qiang LIN Tiejun ZHONG Liangshu 《燃料化学学报(中英文)》 EI CAS CSCD 北大核心 2024年第9期1203-1213,共11页
Ni/TiO_(2) catalyst is widely employed for photo-driven DRM reaction while the influence of crystal structure of TiO_(2) remains unclear.In this work,the rutile/anatase ratio in supports was successfully controlled by... Ni/TiO_(2) catalyst is widely employed for photo-driven DRM reaction while the influence of crystal structure of TiO_(2) remains unclear.In this work,the rutile/anatase ratio in supports was successfully controlled by varying the calcination temperature of anatase-TiO_(2).Structural characterizations revealed that a distinct TiO_(x) coating on the Ni nanoparticles(NPs)was evident for Ni/TiO_(2)-700 catalyst due to strong metal-support interaction.It is observed that the TiOx overlayer gradually disappeared as the ratio of rutile/anatase increased,thereby enhancing the exposure of Ni active sites.The exposed Ni sites enhanced visible light absorption and boosted the dissociation capability of CH4,which led to the much elevated catalytic activity for Ni/TiO_(2)-950 in which rutile dominated.Therefore,the catalytic activity of solar-driven DRM reaction was significantly influenced by the rutile/anatase ratio.Ni/TiO_(2)-950,characterized by a predominant rutile phase,exhibited the highest DRM reactivity,with remarkable H_(2) and CO production rates reaching as high as 87.4 and 220.2 mmol/(g·h),respectively.These rates were approximately 257 and 130 times higher,respectively,compared to those obtained on Ni/TiO_(2)-700 with anatase.This study suggests that the optimization of crystal structure of TiO_(2) support can effectively enhance the performance of photothermal DRM reaction. 展开更多
关键词 dry reforming of methane photothermal catalysis crystal phase TiO_(2) metal-support interaction
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Localization effect in single crystal of RuAs_(2)
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作者 易哲铠 刘琪 +12 位作者 光双魁 徐升 岳小宇 梁慧 李娜 周颖 吴丹丹 孙燕 李秋菊 程鹏 夏天龙 孙学峰 王义炎 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第4期195-200,共6页
We report the magnetotransport and thermal properties of RuAs_(2) single crystal.RuAs_(2) exhibits semiconductor behavior and localization effect.The crossover from normal state to diffusive transport in the weak loca... We report the magnetotransport and thermal properties of RuAs_(2) single crystal.RuAs_(2) exhibits semiconductor behavior and localization effect.The crossover from normal state to diffusive transport in the weak localization(WL)state and then to variable range hopping(VRH)transport in the strong localization state has been observed.The transitions can be reflected in the measurement of resistivity and Seebeck coefficient.Negative magnetoresistance(NMR)emerges with the appearance of localization effect and is gradually suppressed in high magnetic field.The temperature dependent phase coherence length extracted from the fittings of NMR also indicates the transition from WL to VRH.The measurement of Hall effect reveals an anomaly of temperature dependent carrier concentration caused by localization effect.Our findings show that RuAs_(2) is a suitable platform to study the localized state. 展开更多
关键词 weak localization variable range hopping RuAs_(2) single crystal
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Analyses of Reaction Mechanisms among Different Sulfonation Reagents and m-Diphenylamine and Crystal Structures of the Formed Compounds
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作者 Dongdong Chen Chundong Mi +2 位作者 Menglan Yuan Aiquan Jia Qian-Feng Zhang 《Journal of Materials Science and Chemical Engineering》 2024年第4期84-97,共14页
In the traditional process, m-phenylenediamine reacts with fuming sulfuric acid at high temperature to get intermediates, and then after dehydration occurs intramolecular rearrangement to get 2,4-diaminobenzenesulfoni... In the traditional process, m-phenylenediamine reacts with fuming sulfuric acid at high temperature to get intermediates, and then after dehydration occurs intramolecular rearrangement to get 2,4-diaminobenzenesulfonic acid. Traditional methods need to consume a lot of fuming sulfuric acid or concentrated sulfuric acid, resulting in high industrial large-scale production cost, more waste, and posing a serious environmental pollution risk. In this thesis, three different sulfonation reagents were used for the sulfonation reaction of m-phenylenediamine, and the reaction mechanisms and crystal structures of the three pathways were investigated. The three routes are: 1) one-step synthesis of monosulfonated compound 1 from raw material and sulfur trioxide (SO<sub>3</sub>);2) rapid reaction of raw material and chlorosulfonic acid to synthesize bisulfonated compound 2;3) direct eutectic crystallization of raw material and ordinary sulfuric acid to obtain compound 3. The crystal structure of the compounds synthesized by three paths was analyzed by X-ray single crystal diffraction, and compound 1 was characterized by NMR, Fourier infrared spectra, UV-visible spectrum and Mass spectrometry. The one-step synthesis of SO<sub>3</sub> as a sulfonation reagent has the advantages of mild reaction conditions, simple operation and low cost. 展开更多
关键词 2 4-Diaminobenzenesulfonic Acid Sulfur Trioxide (SO3) Spectrometry crystal Structure
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Understand anisotropy dependence of damage evolution and material removal during nanoscratch of MgF_(2) single crystals 被引量:4
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作者 Chen Li Yinchuan Piao +3 位作者 Feihu Zhang Yong Zhang Yuxiu Hu Yongfei Wang 《International Journal of Extreme Manufacturing》 SCIE EI CAS CSCD 2023年第1期236-252,共17页
To understand the anisotropy dependence of the damage evolution and material removal during the machining process of MgF_(2) single crystals,nanoscratch tests of MgF_(2) single crystals with different crystal planes a... To understand the anisotropy dependence of the damage evolution and material removal during the machining process of MgF_(2) single crystals,nanoscratch tests of MgF_(2) single crystals with different crystal planes and directions were systematically performed,and surface morphologies of the scratched grooves under different conditions were analyzed.The experimental results indicated that anisotropy considerably affected the damage evolution in the machining process of MgF_(2) single crystals.A stress field model induced by the scratch was developed by considering the anisotropy,which indicated that during the loading process,median cracks induced by the tensile stress initiated and propagated at the front of the indenter.Lateral cracks induced by tensile stress initiated and propagated on the subsurface during the unloading process.In addition,surface radial cracks induced by the tensile stress were easily generated during the unloading process.The stress change led to the deflection of the propagation direction of lateral cracks.Therefore,the lateral cracks propagated to the workpiece surface,resulting in brittle removal in the form of chunk chips.The plastic deformation parameter indicated that the more the slip systems were activated,the more easily the plastic deformation occurred.The cleavage fracture parameter indicated that the cracks propagated along the activated cleavage planes,and the brittle chunk removal was owing to the subsurface cleavage cracks propagating to the crystal surface.Under the same processing parameters,the scratch of the(001)crystal plane along the[100]crystal-orientation was found to be the most conducive to achieving plastic machining of MgF_(2) single crystals.The theoretical results agreed well with the experimental results,which will not only enhance the understanding of the anisotropy dependence of the damage evolution and removal process during the machining of MgF_(2) crystals,but also provide a theoretical foundation for achieving the high-efficiency and low-damage processing of anisotropic single crystals. 展开更多
关键词 anisotropy dependence damage evolution stress field crack propagation NANOSCRATCH MgF_(2)single crystal
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Crystallization thermodynamics of 2,4(5)-dinitroimidazole in binary solvents 被引量:2
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作者 Pengbao Lian Lizhen Chen +3 位作者 Dan He Guangyuan Zhang Zishuai Xu Jianlong Wang 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2023年第5期173-182,共10页
2,4(5)-Dinitroimidazole(2,4(5)-DNI)is an important organic intermediate,and itself can also be used for energetic material.In this work,the solubility of 2,4(5)-DNI in(methanol+water,acetonitrile+water,acetone+water)b... 2,4(5)-Dinitroimidazole(2,4(5)-DNI)is an important organic intermediate,and itself can also be used for energetic material.In this work,the solubility of 2,4(5)-DNI in(methanol+water,acetonitrile+water,acetone+water)binary solvents were measured by using a dynamic test method from 278.15 K to 323.15 K under 101.1 k Pa.The Jouyban–Acree model,van't Hoff–Jouyban–Acree model,Apelblat–Jouyb an–Acree model,Ma model,and Sun model were used to correlate the experimental data.The values of relative average deviation(RAD)and root-mean-square deviation(RMSD)were very small,indicating that the error between the experimental value and the correlated value was very small.The thermodynamic parameters such as dissolution enthalpy,dissolution entropy and Gibbs energy were calculated based on solubility data.High-purity of 2,4(5)-DNI was efficiently obtained by using cooling and dilution crystallization method. 展开更多
关键词 2 4(5)-Dinitroimidazole Solid-liquid equilibrium Solubility model Three thermodynamic parameters Cooling and dilution crystallization
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Centimeter-sized Cs_(3)Cu_(2)I_(5)single crystals grown by oleic acid assisted inverse temperature crystallization strategy and their films for high-quality X-ray imaging 被引量:1
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作者 Tao Chen Xin Li +9 位作者 Yong Wang Feng Lin Ruliang Liu Wenhua Zhang Jie Yang Rongfei Wang Xiaoming Wen Bin Meng Xuhui Xu Chong Wang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2023年第4期382-389,共8页
Low-dimensional halide perovskites have become the most promising candidates for X-ray imaging,yet the issues of the poor chemical stability of hybrid halide perovskite,the high poisonousness of lead halides and the r... Low-dimensional halide perovskites have become the most promising candidates for X-ray imaging,yet the issues of the poor chemical stability of hybrid halide perovskite,the high poisonousness of lead halides and the relatively low detectivity of the lead-free halide perovskites which seriously restrain its commercialization.Here,we developed a solution inverse temperature crystal growth(ITCG)method to bring-up high quality Cs_(3)Cu_(2)I_(5)crystals with large size of centimeter order,in which the oleic acid(OA)is introduced as an antioxidative ligand to inhibit the oxidation of cuprous ions effieiently,as well as to decelerate the crystallization rate remarkalby.Based on these fine crystals,the vapor deposition technique is empolyed to prepare high quality Cs_(3)Cu_(2)I_(5)films for efficient X-ray imaging.Smooth surface morphology,high light yields and short decay time endow the Cs_(3)Cu_(2)I_(5)films with strong radioluminescence,high resolution(12 lp/mm),low detection limits(53 nGyair/s)and desirable stability.Subsequently,the Cs_(3)Cu_(2)I_(5)films have been applied to the practical radiography which exhibit superior X-ray imaging performance.Our work provides a paradigm to fabricate nonpoisonous and chemically stable inorganic halide perovskite for X-ray imaging. 展开更多
关键词 Inverse temperature crystal growth Cs_(3)Cu_(2)I_(5)single crystal Vapor deposition Cs_(3)Cu_(2)I_(5)films X-ray imaging
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Crystal facet engineering coexposed CuIn(200)and In(101)in CuIn alloy nanocatalysts enabling selective and stable CO_(2)electroreduction
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作者 Lulu Li Yang Zhang +6 位作者 Xi Luo Israr Masood ul Hasan Kai Wu Bing Nan Yanxing Zhang Nengneng Xu Jinli Qiao 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2023年第11期569-578,I0012,共11页
The electrocatalytic carbon dioxide reduction reaction(eCO_(2)RR)into high-value-added chemicals and fuels is a promising strategy to mitigate global warming.However,it remains a significant stumbling block to the rat... The electrocatalytic carbon dioxide reduction reaction(eCO_(2)RR)into high-value-added chemicals and fuels is a promising strategy to mitigate global warming.However,it remains a significant stumbling block to the rationally tuning lattice plane of the catalyst with high activity to produce the target product in the eCO_(2)RR process.To attempt to solve this problem,the Culn bimetallic alloy nanocatalyst with specifically exposed lattice planes is modulated and electrodeposited on the nitrogen-doped porous carbon cloth by a simple two-step electrodeposition method,which induces high Faraday efficiency of 80%towards HCOO-(FEHCOO-)with a partial current density of 13.84 mA cm-2at-1.05 V(vs.RHE).Systematic characterizations and theoretical modeling reveal that the specific coexposed Culn(200)and In(101)lattice facets selectively adsorbed the key intermediate of OCHO*,reducing the overpotential of HCOOH and boosting the FEHCOO-in a wide potential window(-0.65--1.25 V).Moreover,a homogeneous distribution of Culn nanoparticles with an average diameter of merely~3.19 nm affords exposure to abundant active sites,meanwhile prohibiting detachment and agglomeration of nanoparticles during eCO_(2)RR for enhanced stability attributing to the self-assembly electrode strategy.This study highlights the synergistic effect between catalytic activity and facet effect,which opens a new route in surface engineering to tune their electrocatalytic performance. 展开更多
关键词 Electrocatalytic CO_(2) reduction reaction Culn alloy crystal facetengineering NANOCATALYST
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Effect of ZnO,La_(2)O_(3),and YF_(3)on Crystallization and Rehological Behavior of Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2)Glass
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作者 王君 GAO Shengnan +6 位作者 ZHENG Qingshuang ZHANG Xiaowei ZHANG Dongliang XIONG Dehua JIN Siqingaowa 王觅堂 焦国豪 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS CSCD 2023年第4期753-758,共6页
The effect of substitution La_(2)O_(3)and YF_(3)as network modifiers respectively for Y_(2)O_(3),and ZnO as intermediate oxide for Al_(2)O_(3)on crystallization and viscous behavior of Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2)gl... The effect of substitution La_(2)O_(3)and YF_(3)as network modifiers respectively for Y_(2)O_(3),and ZnO as intermediate oxide for Al_(2)O_(3)on crystallization and viscous behavior of Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2)glass was studied.La_(2)O_(3)and YF_(3)substitution for Y_(2)O_(3)decreases the melting temperature of studied glass from 1402 to 1346 and 1379℃,and the activation energy of viscous flow decreases from 340 to 250 and 265 kJ/mol.Meanwhile,ZnO substitution for Al_(2)O_(3)decreases the melting temperature to 1379℃while increases the activation energy of viscous flow to 542 kJ/mol,due to their different role in glass structure.Substitution ZnO for Al_(2)O_(3)refines and homogenizes the crystals size and lowers crystallinity because the nucleation and crystal growth are depressed by higher activation energy of crystallization and change of crystallization mechanism from bulk crystallization to surface crystallization.Replacement of Y_(2)O_(3)by La_(2)O_(3)and YF_(3)respectively also decreases the crystallinity of Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2)glass ceramic due to competitive and hindering effect on the rearranged atoms,structural units and groups required by precipitated two crystals.Besides,y-Y2Si2O7,precipitation of Y4.67(SiO4)3O,ZnAl_(2)O_(4),and Y3Si3O10F were observed respectively due to incorporation of La_(2)O_(3),ZnO,and YF_(3). 展开更多
关键词 Y_(2)O_(3) aluminosilicate glass crystalLIZATION viscous activation energy
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Extremely fast vortex dynamics in Bi_(2)Sr_(2)Ca_(2)Cu_(3)O_(10+δ) crystalline nanostrip
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作者 于奥博 林成天 +1 位作者 张孝富 尤立星 《Chinese Physics B》 SCIE EI CAS CSCD 2023年第6期563-568,共6页
The maximum velocity of a mobile vortex in movement is generally limited by the phenomenon of flux-flow instability(FFI),which necessitates weak vortex pinning and fast heat removal from non-equilibrium electrons.We h... The maximum velocity of a mobile vortex in movement is generally limited by the phenomenon of flux-flow instability(FFI),which necessitates weak vortex pinning and fast heat removal from non-equilibrium electrons.We here demonstrate exfoliations and nano-fabrications of Bi_(2)Sr_(2)Ca_(2)Cu_(3)O_(10+δ) crystalline nanostrips,which possess a rather weak pinning volume of vortices,relatively low resistivity,and large normal electron diffusion coefficient.The deduced vortex velocity in Bi_(2)Sr_(2)Ca_(2)Cu_(3)O_(10+δ) crystalline nanostrips can be up to 300 km/s near the superconducting transition temperature,well above the speed of sound.The observed vortex velocity is an order of magnitude faster than that of conventional superconducting systems,representing a perfect platform for exploration of ultra-fast vortex matter and a good candidate for fabrications of superconducting nanowire single photon detectors or superconducting THz modulator. 展开更多
关键词 Bi_(2)Sr_(2)Ca_(2)Cu_(3)O_(10+δ)(Bi2223) vortices dynamics ultra thin single crystal nanowire
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NdF_(3)-LiF-Nd_(2)O_(3)-NdF_(2)熔盐体系结晶行为的研究
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作者 姜银举 段超 +3 位作者 邓永春 辛文彬 唐家悦 樊文军 《稀有金属与硬质合金》 CAS CSCD 北大核心 2024年第2期1-5,共5页
氟化物体系稀土氧化物熔盐电解过程中,熔盐的结晶析出行为显著影响电解过程,为此本文针对NdF_(3)-LiF-Nd_(2)O_(3)、NdF_(3)-LiF-NdF_(2)以及NdF_(3)-LiF-Nd_(2)O_(3)-NdF_(2)三种熔盐体系(NdF_(3)和LiF质量比固定为85∶15),采用降温黏... 氟化物体系稀土氧化物熔盐电解过程中,熔盐的结晶析出行为显著影响电解过程,为此本文针对NdF_(3)-LiF-Nd_(2)O_(3)、NdF_(3)-LiF-NdF_(2)以及NdF_(3)-LiF-Nd_(2)O_(3)-NdF_(2)三种熔盐体系(NdF_(3)和LiF质量比固定为85∶15),采用降温黏度曲线测定熔盐的结晶温度,通过X射线衍射分析结晶物相。结果表明:NdF_(3)-LiF-Nd_(2)O_(3)和NdF_(3)-LiF-NdF_(2)熔盐体系中,随着熔盐中Nd_(2)O_(3)或NdF_(2)含量的增加,熔盐的结晶温度升高,熔盐的结晶物相分别为NdOF和NdF_(2);NdF_(3)-LiF-Nd_(2)O_(3)-NdF_(2)熔盐体系中,当Nd_(2)O_(3)含量为2%~3%、NdF_(2)含量为1%~3%时,熔盐结晶温度在981~988℃范围内,且NdOF与NdF_(2)共结晶。适当提高电解槽底部温度、改善底部熔盐的流动性,是抑制稀土熔盐电解过程熔盐结晶析出的有效方法。 展开更多
关键词 熔盐电解 NdF_(3)-LiF-Nd_(2)O_(3)-NdF_(2) 黏度 结晶温度 结晶物相
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Na_(2)O对锂铝硅微晶玻璃析晶及性能的影响
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作者 郑伟宏 王启东 +3 位作者 高子鹏 张浩 袁坚 田培静 《硅酸盐通报》 CAS 北大核心 2024年第4期1301-1307,共7页
采用熔融法制备了不同Na_(2)O含量的透明锂铝硅微晶玻璃,通过DSC、XRD、FESEM等测试方法研究了不同Na_(2)O含量对玻璃析晶及性能的影响。结果表明:Na_(2)O的引入能显著降低玻璃的转变温度和析晶温度,抑制LiAlSi_(4)O_(10)晶相的析出。但... 采用熔融法制备了不同Na_(2)O含量的透明锂铝硅微晶玻璃,通过DSC、XRD、FESEM等测试方法研究了不同Na_(2)O含量对玻璃析晶及性能的影响。结果表明:Na_(2)O的引入能显著降低玻璃的转变温度和析晶温度,抑制LiAlSi_(4)O_(10)晶相的析出。但Na_(2)O的引入促使微晶玻璃中析出Li_(2)Si_(2)O_(5)新相,并且随着Na_(2)O引入量的增加,Li_(2)Si_(2)O_(5)转变为主晶相。由于晶体尺寸均为纳米级,主晶相的转变对透过率影响较小,微晶玻璃的可见光透过率均高于85%。主晶相的转变有效增强了微晶玻璃的机械性能,其弯曲强度由300 MPa提升至331 MPa。Na_(2)O的引入有效增强了Na-K交换,Na_(2)O含量为4%(质量分数)的Li 2O-Al_(2)O_(3)-SiO_(2)微晶玻璃在410℃的KNO_(3)熔盐中交换6 h后,维氏硬度由7.108 GPa提升至7.403 GPa,弯曲强度由331 MPa提升至470 MPa。 展开更多
关键词 Na_(2)O LiAlSi_(4)O_(10) Li_(2)Si_(2)O_(5) Li_(2)O-Al_(2)O_(3)-SiO_(2)微晶玻璃 主晶相转变 Na-K交换
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Li_(2)O/Na_(2)O对YAS微晶玻璃结构、析晶与力学性能的影响
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作者 郑伟宏 刘国凤 +3 位作者 张浩 王启东 张梦豪 袁坚 《硅酸盐通报》 CAS 北大核心 2024年第4期1292-1300,共9页
透明微晶玻璃由于优异的力学性能被广泛应用于电子领域。本文采用熔融法制备了不同质量分数Li_(2)O和Na_(2)O的Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2)(YAS)微晶玻璃,通过Raman、DSC、XRD、FESEM、UV-VIS-NIR等测试方法研究了其结构特征、析晶... 透明微晶玻璃由于优异的力学性能被广泛应用于电子领域。本文采用熔融法制备了不同质量分数Li_(2)O和Na_(2)O的Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2)(YAS)微晶玻璃,通过Raman、DSC、XRD、FESEM、UV-VIS-NIR等测试方法研究了其结构特征、析晶与力学性能。结果表明:当碱金属氧化物R_(2)O(R=Li,Na)总量保持不变,随着Li_(2)O取代Na_(2)O含量的增加,YAS微晶玻璃的转变温度、软化温度和结晶峰温度逐渐降低,Q^(4)基团对应的含量逐渐减少,说明Li_(2)O作为网络外体使YAS微晶玻璃结构逐步解聚,玻璃的析晶能力逐渐增强。在同一热处理制度下,随着Li_(2)O取代量的增加,YAS微晶玻璃维氏硬度显著提升,而透过率明显下降。在680℃/10 h+750℃/1 h热处理制度下,可以制备出晶体大小一致且分布均匀的以钇稳定氧化锆为主晶相的透明YAS微晶玻璃,此时2%(质量分数,下同)Na_(2)O+4%Li_(2)O YAS微晶玻璃具有良好的综合性能,如维氏硬度为646 HV,断裂韧性为1.07 MPa·m^(1/2),透过率为85.7%,在诸多领域具有巨大的应用潜力。 展开更多
关键词 Y_(2)O_(3)-Al_(2)O_(3)-SiO_(2) 透明微晶玻璃 碱金属氧化物 结构 析晶 维氏硬度
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Er掺杂PbF_(2)晶体的局域团簇结构与光谱性能研究
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作者 李琳 张沛雄 +4 位作者 谭俊成 朱思祁 尹浩 李真 陈振强 《人工晶体学报》 CAS 北大核心 2024年第7期1112-1120,共9页
本文采用Bridgman法成功生长了一系列Er∶PbF_(2)晶体。利用基于密度泛函理论的第一性原理计算详细研究了Er^(3+)在PbF_(2)晶体中的团簇效应。首次获得了Er∶PbF_(2)晶体的上转换发光特性(发光强度、颜色变化)与团簇结构之间的关系。研... 本文采用Bridgman法成功生长了一系列Er∶PbF_(2)晶体。利用基于密度泛函理论的第一性原理计算详细研究了Er^(3+)在PbF_(2)晶体中的团簇效应。首次获得了Er∶PbF_(2)晶体的上转换发光特性(发光强度、颜色变化)与团簇结构之间的关系。研究发现,随着Er^(3+)浓度增加,团簇从单聚体向高阶构型演化,Er^(3+)离子之间的距离先减小后增大,这使得上转换发光中的红色发射强度先增大后减小,红绿发光比也在Er^(3+)浓度高于6.5%(摩尔分数)后逐渐减小,即发光颜色可以从红色调整为黄绿色。该研究证明了稀土离子团簇的结构演化可以调控Er∶PbF_(2)的光谱特性,为多色发光材料的设计提供一种新方法。 展开更多
关键词 Er∶PbF_(2)晶体 上转换发光 密度泛函理论 铒离子团簇 光谱性能
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Nb_(2)O_(5)对3Y-TZP陶瓷性能影响的研究
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作者 林信平 李和祯 陈戈 《中国锰业》 2024年第2期47-49,61,共4页
研究了Nb_(2)O_(5)的加入对3Y-TZP陶瓷性能的影响,主要包括对硬度、韧性、冲击性的影响,并且结合显微形貌以及XRD物相图谱分析出的晶轴比进行分析。结果表明,随着Nb_(2)O_(5)添加量的增加,陶瓷的韧性呈现提升趋势,硬度呈现降低趋势,强... 研究了Nb_(2)O_(5)的加入对3Y-TZP陶瓷性能的影响,主要包括对硬度、韧性、冲击性的影响,并且结合显微形貌以及XRD物相图谱分析出的晶轴比进行分析。结果表明,随着Nb_(2)O_(5)添加量的增加,陶瓷的韧性呈现提升趋势,硬度呈现降低趋势,强度呈现先上升后下降趋势。这一现象的产生,一方面归因于Nb_(2)O_(5)的加入让陶瓷生成异相小晶粒,进而提供异相颗粒增韧阻碍裂纹扩展;另一方面,由于Nb^(5+)的引入提高了晶轴比,从而让相变更容易发生。综上所述,Nb_(2)O_(5)的最佳添加质量分数为0.5%。 展开更多
关键词 3Y-TZP Nb_(2)O_(5) 异相颗粒增韧 晶轴比
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第一性原理研究压力对Fe_(2)B的结构、机械性质的影响
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作者 李海侠 刘钧 +1 位作者 黄上分 陶钧 《原子与分子物理学报》 CAS 北大核心 2024年第2期105-111,共7页
基于密度泛函理论的第一性原理方法,系统研究了0~30 GPa压力下四方相Fe_(2)B的结构,稳定性和力学性质等.随着压力的增加,计算得到的晶格参数逐渐减小,所有结构均满足热力学稳定性,体积模量和剪切模量逐渐增大,韧性得到有效改善.硬度呈... 基于密度泛函理论的第一性原理方法,系统研究了0~30 GPa压力下四方相Fe_(2)B的结构,稳定性和力学性质等.随着压力的增加,计算得到的晶格参数逐渐减小,所有结构均满足热力学稳定性,体积模量和剪切模量逐渐增大,韧性得到有效改善.硬度呈现先增大后减小的趋势,并在18 GPa压力时达到最大值,各向异性先增大后减小.德拜温度变化趋势与杨氏模量的变化趋势相同.同时还研究了相变结构——正交相的相关性质,结果表明其结构满足热力学稳定性但不满足力学稳定性,是否稳定存在还需要进行后续实验研究. 展开更多
关键词 第一性原理 Fe_(2)B 压力 晶体结构 机械性能
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La_(1-x)Ce_(x)MnO_(3)-Ba/Al_(2)O_(3)催化剂对NO选择性生成NH_(3)的影响
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作者 宋崇林 郑庆贺 +3 位作者 吕誉 崔立峰 李云强 吕刚 《天津大学学报(自然科学与工程技术版)》 EI CAS CSCD 北大核心 2024年第10期1053-1061,共9页
为了实现碳中和目标,降低内燃机碳排放,稀薄燃烧技术成为了当前重要的研究方向.该技术不仅能提高发动机燃油热效率,还能有效降低CO_(2)排放.但是稀薄燃烧往往会伴随着大量氮氧化物的产生,为了解决该问题,采用LNT-SCR耦合的NO_(x)净化技... 为了实现碳中和目标,降低内燃机碳排放,稀薄燃烧技术成为了当前重要的研究方向.该技术不仅能提高发动机燃油热效率,还能有效降低CO_(2)排放.但是稀薄燃烧往往会伴随着大量氮氧化物的产生,为了解决该问题,采用LNT-SCR耦合的NO_(x)净化技术,此时LNT的作用是将排气中部分NO_(x)转化为NH_(3),为下游的SCR提供还原剂.基于此,制备了LNT催化剂,研究催化剂对NO选择性生成NH_(3)的影响.采用溶胶-凝胶法制备了La_(1-x)Ce_(x)MnO_(3)系列钙钛矿氧化物,并通过分步浸渍法得到了La_(1-x)Ce_(x)MnO_(3)-Ba/Al_(2)O_(3)负载型催化剂.利用XRD、H_(2)-TPR、NO-TPD等表征手段研究了钙钛矿氧化物的晶相结构,以及负载型催化剂的还原特性、NO_(x)吸附-脱附性能等物化性质,并且通过H_(2)选择性催化还原NO实验探究了催化剂掺杂Ce对NO转化成NH_(3)的影响.结果表明,Ce掺杂催化剂具有良好的NH_(3)产物选择性,并且显著提高了NO转化率.温度是NO转化和NH_(3)产物选择性生成的决定性因素,而H_(2)和NO体积比是NO转化和NH_(3)产物选择性生成的关键性因素.其中,La_(0.95)Ce_(0.05)MnO_(3)-Ba/Al_(2)O_(3)在低温下催化活性表现最佳,在350℃、H_(2)和NO体积比为5.0时NH_(3)产物选择性为65%,NO转化率为100%.此外,所制备的La_(1-x)Ce_(x)MnO_(3)都形成了钙钛矿型结构,而且Ce掺杂催化剂的大部分Ce离子可以进入到LaMnO_(3)结构中.在催化剂适量掺杂Ce后,H_(2)消耗总面积增大、还原峰的峰值温度降低,表明掺杂Ce改善了催化剂的还原特性;同时NO吸附和脱附面积增大,表明Ce掺杂改变了催化剂的NO_(x)吸附-脱附性能. 展开更多
关键词 La_(1-x)Ce_(x)MnO_(3)-Ba/Al_(2)O_(3)催化剂 H_(2)选择性催化还原NO NH_(3)产物选择性 NO转化率 晶相结构 还原特性 NO_(x)吸附-脱附
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基于QCM的工业废水中重金属检测
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作者 王艳 赵宝瑞 +2 位作者 李冲 曾禹 吕天奕 《传感器与微系统》 CSCD 北大核心 2024年第7期125-127,131,共4页
锌离子(Zn^(2+))的检测涉及到食品,水土环境,人体病理等多方面人类安全问题,越发受到国内外学者的关注。为方便且准确地检测排放污水中Zn^(2+)是否达标,采用涂覆能够特异性吸附Zn^(2+)的含醚键离子交换树脂薄膜到石英晶体微天平(QCM)电... 锌离子(Zn^(2+))的检测涉及到食品,水土环境,人体病理等多方面人类安全问题,越发受到国内外学者的关注。为方便且准确地检测排放污水中Zn^(2+)是否达标,采用涂覆能够特异性吸附Zn^(2+)的含醚键离子交换树脂薄膜到石英晶体微天平(QCM)电极上,制备了重金属传感器。通过测量QCM的共振频移,研究了传感器的选择特性,检测精度,检测响应时间和重复性。实验结果表明:制备的涂覆含醚键树脂薄膜石英晶体传感器频率随Zn^(2+)的含量变化明显,检测精确度约为95%,可重复多次检测,检测时长适度。该传感器研究成果在重金属实际检测方面中有潜在的应用前景。 展开更多
关键词 石英晶体微天平 锌离子 含醚键离子交换树脂 传感器
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