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Metal±organic cage as fluorescent probe for LiPF6 in lithium batteries

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Green Energy & Environment 2024年第10期9卷 1592-1600页

作者： Xi Li Dehua Xu Aoxuan Wang Chengxin Peng Xingjiang Liu Jiayan Luo Key laboratory for Green Chemical technology of Ministry of Education School of Chemical Engineering and TechnologyTianjin University School of Materials science and Engineering University of Shanghai Science and Technology State Key laboratory of Metal Matrix Composites School of Materials Science and EngineeringShanghai Jiao Tong University

Lithium hexafluorophosphate （LiPF6）,the most commonly used lithium battery electrolyte salt,is vulnerable to heat and *** and qualitative determination the variation of Li PF6have always relied on advanced ***,we develop a fast,convenient,high-selective fluorescence detection method based on metal±organic cages （MOC）,whose emission is enhanced by nearly 20 times in the presence of Li PF6with good stability and photobleaching *** fluorescent probe can also detect moisture in battery *** propose and verify that the luminescence enhancement is due to the presence of hydrogen bond-induced enhanced emission effect in *** excitation-emission matrix spectra and variable-temperature nuclear magnetic resonance spectroscopy are employed to clarify the role of hydrogen bonds in guest-loaded *** functional theory （DFT） calculation is applied to simulate the structure of host-guest complexes and estimate the adsorption energy involved in the *** precisely matched lock-and-key model paves a new way for designing and fabricating novel host structures,enabling specific recognition of other target compounds.

关键词： Metal-organic cage Selective fluorescence probe Moisture detection Hydrogen bond Host-guest complex

Atomically precise Ru-O-Ru clusters for enhanced water dissociation in alkaline hydrogen evolution

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Nano Research 2024年第8期17卷 6993-7000页

作者： Dong Liu Li Xu Sicheng Li Airong Xu Yuanhua Sun Tong Liu Mengyuan Liu Huijuan Wang Xiaokang Liu Tao Yao Tao Ding Hefei National Research Center for Physical sciences at the Microscale School of Nuclear Science and TechnologyKey Laboratory of Precision and Intelligent ChemistryNational Synchrotron Radiation LaboratoryUniversity of Science and Technology of ChinaHefei 230029China Experimental Center of Engineering and Materials science University of Science and Technology of ChinaHefei 230026China

Atomic clusters typically exhibit distinctive electronic structures and physicochemical ***,as the size decreases,their ability to adsorb and dissociate water also diminishes,thereby affecting chemical reactions involving water *** the adsorption and dissociation capabilities of atomic clusters towards water molecules and elucidating the mechanisms underlying their performance enhancement have become important research ***,employing the carrier-anchored strategy,Ru-O-Ru atomic clusters were prepared and displayed excellent activity and durability in the hydrogen evolution ***,the Ru-O-Ru atomic clusters exhibited only 86 mV overpotential at 100 mA·cm−^(2) and superior membrane-electrode-assembly activity than commercial Ru/C *** radiation-based Fourier transform infrared spectroscopic measurements revealed that the modification of oxygen in Ru-O-Ru units promoted the reorientation of water molecules from a H-up orientation to H-down,therefore,enhanced the formation of strong hydrogen-bond network of interfacial water on the surface of Ru-O-Ru clusters,leading to enhanced adsorption and dissociation of water and accelerated Volmer *** findings provide a potential strategy and deep insights for the development of atomic clusters in electrocatalysts.

关键词： hydrogen evolution in-situ Fourier transform infrared(FTIR) Ru catalysts electrocatalysis atomic clusters

Influence of tungsten particle size on microstructure and mechanical properties of high strength and tough tungsten particle-reinforced nickel-based composites by laser-direct energy deposition

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Journal of Materials science & technology 2024年第5期172卷 213-227页

作者： Wenji Song Dengzhi Wang Congwen Tang Pengfei Sun Jiaxing Yang Zhidong Xu Tao Lai Jianqiang Gong Qianwu Hu Xiaoyan Zeng Wuhan National laboratory for Optoelectronics Huazhong University of Science and TechnologyWuhan 430000China

Tungsten(W)particle-reinforced nickel(Ni)-based composites were fabricated via laser-direct energy de-position(L-DED).The influence of the W particle size on the microstructure and mechanical properties of the deposited samples was systematically *** results indicate that refining the W particle size could refine theγ-Ni grains and subgrains,thin the(Ni,Cr)_(4)W interface layer,and increase the disloca-tion density of the intergranular matrix,thus improving the tensile strength and elongation of the L-DED *** W particle size decreased from 75 to 150μm to 6.5-12μm,the tensile strength and elonga-tion of the deposited samples increased by 150 MPa and 2.9 times to 1347.6±15.7 MPa and 17.5±0.4%,*** on the properties of the interface(Ni,Cr)_(4)W,a load-transfer efficiency factor suitable for this composite was proposed and the load-transfer strengthening formula was optimized.A quanti-tative analysis of the strengthening mechanisms was established considering load-transfer strengthening,Hall-Petch strengthening,thermal-mismatch strengthening,and solid-solution *** calcu-lated contribution of each strengthening mechanism to the yield strength and theoretical calculations were in good agreement with the experimental *** article breaks the bottleneck of poor plasticity of W particle-reinforced Ni-based composites prepared by L-DED and provides a theoretical basis for the construction design of W particle-reinforced Ni-based composites with excellent mechanical properties.

关键词： Laser-direct energy deposition(L-DED) Tungsten particle reinforcements Mechanical property Strengthening mechanism

Crack propagation and damage evolution of metallic cylindrical shells under internal explosive loading

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Defence technology（防务技术） 2024年第9期39卷 133-146页

作者： Yusong Luo Weibing Li Junbao Li Wenbin Li Xiaoming Wang ZNDY of Ministerial Key laboratory Nanjing University of Science and TechnologyNanjing210094China

This paper investigates the three-dimensional crack propagation and damage evolution process of metallic column shells under internal explosive *** calibration of four typical failure parameters for 40CrMnSiB steel was conducted through experiments and subsequently applied to *** numerical simulation results employing the four failure criteria were compared with the differences and similarities observed in freeze-recovery tests and ultra-high-speed *** analysis addressed the critical issue of determining failure criteria for the fracture of a metal shell under internal explosive *** upon this foundation,the damage parameter D_(c),linked to the cumulative crack density,was defined based on the evolution characteristics of a substantial number of *** relationship between the damage parameter and crack velocity over time was established,and the influence of the internal central pressure on the damage parameter and crack velocity was *** in the fracture modes were found under different failure criteria,with the principal strain failure criterion proving to be the most effective for simulating 3D crack propagation in a pure shear fracture *** statistical analysis of the shell penetration fracture radius data,it was determined that the fracture radius remained essentially constant during the crack evolution process and could be considered a *** propagation velocity of axial cracks ranged between 5300 m/s and 12600 m/s,surpassing the Rayleigh wave velocity of the shell material and decreasing linearly with *** increase in shell damage exhibited an initial rapid phase,followed by deceleration,demonstrating accelerated damage during the propagation stage of the blast wave and decelerated damage after the arrival of the rarefaction *** study provides an effective approach for investigating crack propagation and damage *** derived crack propagation and damage evolution law s

关键词： Internal explosive loading Failure criterion Crack propagation Damage evolution Freeze-recovery test

Al/Hf ratio-dependent mechanisms of microstructure and mechanical property of nearly fully dense Al—Hf reactive material

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Defence technology（防务技术） 2024年第1期31卷 230-241页

作者： Junbao Li Weibing Li Xiaoming Wang ZNDY of Ministerial Key laboratory Nanjing University of Science and TechnologyNanjing 210094China

This study proposed three types of Al—Hf reactive materials with particle size ratios(a),which were almost completely dense(porosity of<5.40%)owing to their preparation using hot-pressing *** characteristics and phase composition were analyzed,and the influence of particle size ratios on dynamic mechanical behavior and damage mechanism were *** prepared sample with a=0.1 exhibited continuous wrapping of the Hf phase by the Al ***—Hf contact(continuous Hf phase)within the sample gradually increased with increasing a,and a small amount of fine Hf appeared for the sample with a=*** reactive materials exhibited clear strain-rate sensitivity,with flow stressσ0.05and failure strainεfincreasing approximately linearly with increasing strain rate.ε.It is found that the plastic deformation of the material increased with increasing strain *** a increased from 0.1 to 1,the flow stress gradually *** failure of the material was dominated by ductile fracture with a large Al phase plastic deformation band for lower a,while brittle fracture with crushed Hf particles occurred at higher ***,a constitutive model based on BP neural network was proposed to describe the stress-strain relationships of the materials,with an average relative error of 2.22%.

关键词： Reactive material Particle size Split Hopkinson pressure bar test Stressestrain relationship Impact failure BP neural network

Molecular Dynamics Simulation of Shock Response of CL-20 Co-crystals Containing Void Defects

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Defence technology（防务技术） 2024年第1期31卷 364-374页

作者： Changlin Li Wei Yang Qiang Gan Yajun Wang Lin Liang Wenbo Zhang Shuangfei Zhu Changgen Feng State Key laboratory of Explosion science and technology Beijing Institute of TechnologyBeijing 100081China School of Materials science&Engineering Beijing Institute of TechnologyBeijing 100081China

To investigate the effect of void defects on the shock response of hexanitrohexaazaisowurtzitane(CL-20)co-crystals,shock responses of CL-20 co-crystals with energetic materials ligands trinitrotoluene(TNT),1,3-dinitrobenzene(DNB),solvents ligands dimethyl carbonate(DMC) and gamma-butyrolactone(GBL)with void were simulated,using molecular dynamics method and reactive force *** is found that the CL-20 co-crystals with void defects will form hot spots when impacted,significantly affecting the decomposition of molecules around the *** degree of molecular fragmentation is relatively low under the reflection velocity of 2 km/s,and the main reactions are the formation of dimer and the shedding of nitro *** existence of voids reduces the safety of CL-20 co-crystals,which induced the sensitivity of energetic co-crystals CL-20/TNT and CL-20/DNB to increase more *** has occurred under the reflection velocity of 4 km/s,energetic co-crystals are easier to polymerize than solvent co-crystals,and are not obviously affected by *** results show that the energy of the wave decreases after sweeping over the void,which reduces the chemical reaction frequency downstream of the void and affects the detonation performance,especially the solvent co-crystals.

关键词： CL-20 co-crystals Molecular dynamics simulation Reactive forcefield Impact response Hot spot Void defect

Flexible one-dimensional photonic crystal films composed of chalcogenide glass and water-soluble polymer for curvature sensing

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Chinese Optics Letters 2024年第2期22卷 135-140页

作者：陈新宇黎张成赵若兰何钰何月梁治陶光明侯冲 School of Optical and Electronic Information Huazhong University of Science and TechnologyWuhan 430074China Wuhan National laboratory for Optoelectronics Huazhong University of Science and TechnologyWuhan 430074China Key laboratory of Vascular Aging Ministry of EducationTongji Hospital Tongji Medical CollegeHuazhong University of Science and TechnologyWuhan 430030China State Key laboratory of Material Processing and Die&Mould technology School of Materials Science and EngineeringHuazhong University of Science and TechnologyWuhan 430074China Shenzhen Huazhong University of science and technology Research Institute Shenzhen 518063China

Curvature sensing plays an important role in structural health monitoring,damage detection,real-time shape control,modification,*** curvature sensors with large measurement ranges,high sensitivity,and linearity remains a major *** this study,a curvature sensor based on flexible one-dimensional photonic crystal(1D-PC)films was *** flexible 1D-PC films composed of dense chalcogenide glass and water-soluble polymer materials were fabricated by solution *** flexible 1D-PC film curvature sensor has a wide measurement range of 33-133 m-1and a maximum sensitivity of0.26 nm/m^(-1).The shift of the transmission peak varies approximately linearly with the curvature in the entire measurement *** kind of 1D-PC film curvature sensor provides a new idea for curvature sensing and measurement.

关键词： curvature sensor one-dimensional photonic crystals solution processing chalcogenide glass flexible film

Surface-sensitive electronic structure of kagome superconductor CsV_(3)Sb_(5)

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Chinese Physics B 2024年第10期33卷 35-40页

作者： Zhisheng Zhao Jianghao Yao Rui Xu Yuzhe Wang Sen Liao Zhengtai Liu Dawei Shen Shengtao Cui Zhe Sun Yilin Wang Donglai Feng Juan Jiang School of Emerging technology and Department of Physics University of Science and Technology of ChinaHefei 230026China Shanghai Synchrotron Radiation Facility Shanghai Advanced Research InstituteChinese Academy of SciencesShanghai 201210China National Synchrotron Radiation laboratory School of Nuclear science and technology and New Cornerstone Science LaboratoryUniversity of Science and Technology of ChinaHefei 230026China

We systematically study the electronic structure of a kagome superconductor CsV_(3)Sb_(5)at different temperatures coveringboth its charge density wave state and normal state with angle-resolved photoemission *** observe thatthe V-shaped band aroundГshows three different behaviors,referred to as a/a',βandγ,mainly at different *** investigations confirm that these bands are all from the same bulk Sb-p_(z)origin,but they are quite sensitiveto the sample surface conditions mainly modulated by ***,the intriguing temperature dependent electronicbehavior of the band nearГis affected by the sample surface condition,rather than intrinsic electronic behavior originatingfrom the phase *** result systematically reveals the confusing electronic structure behavior of the energy bandsaroundГ,facilitating further exploration of the novel properties in this material.

关键词： kagome ARPES charge density wave surface sensitive

Microstructure evolution,mechanical properties and fracture behavior of Al-xSi/AZ91D bimetallic composites prepared by a compound casting

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Journal of Magnesium and Alloys 2024年第5期12卷 1944-1964页

作者： Guangyu Li Wenming Jiang Feng Guan Junwen Zhu Yang Yu Zitian Fan State Key laboratory of Materials Processing and Die&Mould technology School of Materials Science and EngineeringHuazhong University of Science and TechnologyWuhan 430074China

In this paper,the effect of the Si content on microstructure evolution,mechanical properties,and fracture behavior of the Al-xSi/AZ91D bimetallic composites prepared by compound casting was investigated *** obtained results showed that all the Al-xSi/AZ91D bimetallic composites had a metallurgical reaction layer(MRL),whose thickness increased with increasing Si content for the hypoeutectic Al-Si/AZ91D composites,while the hypereutectic Al-Si/AZ91D composites were *** MRL included eutectic layer(E layer),intermetallic compound layer(IMC layer)and transition region layer(T layer).In the IMC layer,the hypereutectic Al-Si/AZ91D composites contained some Si solid solution and flocculent Mg_(2)Si+Al-Mg IMCs phases not presented in the hypoeutectic Al-Si/AZ91D ***,increasing Si content,the thickness proportion of the T layer increased,forming an inconsistent preferred orientation of the *** shear strengths of the Al-xSi/AZ91D bimetallic composites enhanced with increasing Si content,and the Al-15Si/AZ91D composite obtained a maximum shear strength of 58.6 MPa,which was 73.4% higher than the Al-6Si/AZ91D *** fractures of the Al-xSi/AZ91D bimetallic composites transformed from the T layer into the E layer with the increase of the Si *** improvement of the shear strength of the Al-xSi/AZ91D bimetallic composites was attributed to the synergistic action of the Mg_(2)Si particle reinforcement,the reduction of oxidizing inclusions and the ratio of Al-Mg IMCs as well as the orientation change of the MRL.

关键词： Al/Mg bimetallic composites Si content Mg_(2)Si reinforcement Microstructure Mechanical properties Fracture behavior