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Atmospheric chemistry of trifluorodicarbonyls initiated by Cl atoms:Reactivity trends,mechanism,and acid formation yields

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Journal of Environmental Sciences 2025年第5期151卷 12-25页

作者： Pedro L.Lugo Vianni g.Straccia Cynthia b.Rivela mariano A.Teruel maría b.blanco Laboratorio Universitario de Química y Contaminación del Aire(L.U.Q.C.A) Instituto de Investigaciones en Fisicoquímica de Córdoba(I.N.F.I.Q.C.)Dpto.de Fisicoquímica.Facultad de Ciencias QuímicasUniversidad Nacional de Córdoba.Ciudad Universitaria5000 CórdobaArgentina Institute for Atmospheric and Environmental Research University of WuppertalDE-42097 WuppertalGermany

Rate coefficients of the gas-phase reactions of Cl atoms with a series of fluorinated diketones(FDKs):CF_(3)C(O)CH_(2)C(O)CH_(3)(TFP),CF_(3)C(O)CH_(2)C(O)CH_(2)CH_(3)(TFH)and CF_(3)C(O)CH_(2)C(O)CH(CH_(3))2(TFMH),have been measured at(298±2)K and under atmospheric *** experiments were performed using the relative-rate method with a gC-FID detection *** different determinations and references used,the following rate coefficients were obtained(in cm3/(molecule·sec)):k_(4)(TFP+Cl)=(1.75±0.21)×10^(−10),k_(5)(TFH+Cl)=(2.05±0.23)×10^(−10),k_(6)(TFMH+Cl)=(2.71±0.34)×10^(−10).Reactivity trends of FDKs were discussed and Free Energy Relationships analysis was *** expression lgkOH=1.68 lgkCl+5.71 was obtained for the reactivity of the studied FDKs together with similar unsaturated VOCs with Cl and OH radicals Additionally,acetic acid(CH_(3)C(O)OH)and trifluoroacetic acid(CF_(3)C(O)OH)were positively identified and quantified as degradation products using in situ FTIR *** to the identified products,atmospheric chemical mechanisms were *** atmospheric implications of the studied reactions were assessed by the estimation of the tropospheric lifetimes of TFP,TFH,and TFMH concerning their reaction with Cl atoms to be 48,41,and 31 hours,*** relatively short residence in the atmosphere of the fluorocarbons studied will have a local/regional impact with restricted *** warming potential(gWP(20 yr))calculated for the studied fluoro diketones were 0.014,0.003 and 0.001 for TFP,TFH and TFMH,respectively with a negligible contribution to the greenhouse effect.

关键词： Fluorinated diketones Kinetics SPME-gC-FID FTIR in situ SAR Free energy relationships

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Conversion-type cathode materials for high energy density solid-state lithium batteries

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Journal of Energy Chemistry 2025年第1期100卷 409-425页

作者： Yuhao ma Shihong Qing Hongyu Liu Chuntao ma Yuan Yu Chuang Yu Liping Wang School of materials and Energy University of Electronic Science and Technology of ChinaChengdu 611731SichuanChina Zhejiang Provincial Key Laboratory of Fiber materials and manufacturing Technology Zhejiang Sci-Tech UniversityHangzhou 310018ZhejiangChina State Key Laboratory of Advanced Electromagnetic Engineering and Technology School of Electrical and Electronic EngineeringHuazhong University of Science and TechnologyWuhan 430074HubeiChina

Solid-state lithium batteries(SSLbs)are regarded as an essential growth path in energy storage systems due to their excellent safety and high energy *** particular,SSLbs using conversion-type cathode materials have received widespread attention because of their high theoretical energy densities,low cost,and *** the great progress in research and development of SSLbs based on conversiontype cathodes,their practical applications still face challenges such as blocked ionic-electronic migration pathways,huge volume change,interfacial incompatibility,and expensive processing *** review focuses on the advantages and critical issues of coupling conversion-type cathodes with solid-state electrolytes(SSEs),as well as state-of-the-art progress in various promising cathodes(e.g.,FeS_(2),CuS,FeF_(3),FeF_(2),and S)in ***,representative research on conversion-type solid-state full cells is discussed to offer enlightenment for their practical ***,the energy density exhibited by the S cathode stands out impressively,while sulfide SSEs and halide SSEs have demonstrated immense potential for coupling with conversion-type ***,perspectives on conversion-type cathodes are provided at the material,interface,composite electrode,and battery levels,with a view to accelerating the development of conversion-type cathodes for high-energy–density SSLbs.

关键词： Conversion-type cathode Lithium-free cathode Solid-state electrolyte Solid-state lithium battery High energy density

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Fracture behavior of sandstone with partial filling flaw under mixed-mode loading: Three-point bending tests and discrete element method

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Journal of Rock Mechanics and geotechnical Engineering 2025年第1期17卷 291-308页

作者： Dongdong ma Yu Wu Xiao ma Xunjian Hu Wenbao Dong Decheng Li Lingyu Li State Key Laboratory for geomechanics and Deep Underground Engineering China University of Mining and TechnologyXuzhou221116China State Key Laboratory of Structural Health and Safety of bridges Wuhan430034China Research Center of Coastal and Urban geotechnical Engineering Zhejiang UniversityHangzhou310058China State Key Laboratory of geomechanics and geotechnical Engineering Institute of Rock and Soil MechanicsChinese Academy of SciencesWuhan430071China

The fracture behavior of natural fracture in the geological reservoir subjected to filling property,affects the crack initiation and propagation under stress *** filling flaws were intermediate between open fractures and filled fractures,the fracture response may be worth *** this work,the effect of the filling property of sandstone with partial filling flaws on the fracture behavior was systematically investigated based on three-point bending tests and the numerical approach of discrete element method(DEM).In the laboratory,semi-circular three-point bending tests were carried out with partial filling flaws of various filling *** on this,numerical simulations were used to further investigate the effect of the filling ratio and the inclination of the partial filling flaw on the mechanical and fracture responses,and the effect of the partial filling flaw under mixed-mode loading on the fracture mechanism was elucidated coupled with acoustic emission(AE)*** obtained results showed that the increase in filling strength and filling ratio of partial filling flaw led to an increase in peak strength,with a decreasing trend in peak strength with the inclination of partial filling *** terms of crack propagation pattern,the increasing filling strength of the partial filling flaw induced the transformation of the fracture mechanism toward deflection,with a tortuosity path,while the filling ratio and inclination of partial filling flaw led to fracture mechanism change from deflection to penetration and attraction,accompanied with a larger AE event source in ***,the b-value based on the gutenberg-Richter equation fluctuated between 5 and 4 at low filling ratio and inclination and remained around 5 at high filling ratio and inclination of partial filling *** results may provide an application prospective for reservoir stimulation using the natural fracture system.

关键词： Partial filling flaw Mixed-mode loading Semi-circular three-point bending Acoustic emission(AE) b-value

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Lattice dynamics of FeMnP_(0.5)Si_(0.5) compound from first principles calculation

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Journal of materials Science & Technology 2019年第1期35卷 127-133页

作者： b.wurentuya.shua.g ma b.Narsu O.Tegus Zhidong Zhang Shenyang National Laboratory for materials Science Institute of Metal Research Chinese Academy of Sciences and University of Chinese Academy of Sciences College of Physics and Electronic Information Inner Mongolia Normal University

Understanding the role of lattice vibrations on first-order magnetic transitions is essential for their fundamental description, as well as for the optimization of the related functional properties. Here, we present a first principles study on the lattice dynamics of the MnFeP_(0.5)Si_(0.5) compound. The phonon spectra are obtained by Density Functional Theory(DFT) calculations in combination with frozen phonon *** calculations reproduce most of the features observed in experiments including the lattice softening across the magnetic phase transition and the pronounced shift of phonon peak. The site projected phonon density of states(pDOS) shows that the local vibrations of Mn atoms have an essential contribution to the overall lattice softening. Moreover, the local lattice vibrations of Mn atoms are rather featureless in the paramagnetic state(PM) and thus the total pDOS evolution across the transition appears to be dominated by Fe. The lattice vibrations of both Fe and Mn in the PM state are very sensitive to the local environment,which shows that the magnetic order and the local chemical environment are strongly coupled in this compound.

关键词： Lattice dynamics magnetic phase transition Phonon softening First principles calculation

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Research status and prospects of the fractal analysis of metal material surfaces and interfaces

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International Journal of Minerals,Metallurgy and materials 2025年第1期32卷 20-38页

作者： Qinjin Dai Xuefeng Liu Xin ma Shaojie Tian Qinghe Cui beijing Advanced Innovation Center for materials genome Engineering University of Science and Technology BeijingBeijing 100083China beijing Laboratory of Metallic materials and Processing for Modern Transportation University of Science and Technology BeijingBeijing 100083China Laboratory for Advanced materials Processing of Ministry of Education University of Science and Technology BeijingBeijing 100083China School of Mechanical and Electrical Engineering Xinjiang Institute of EngineeringUrumqi 830023China

As a mathematical analysis method,fractal analysis can be used to quantitatively describe irregular shapes with self-similar or self-affine *** analysis has been used to characterize the shapes of metal materials at various scales and *** methods make it difficult to quantitatively describe the relationship between the regular characteristics and properties of metal material surfaces and ***,fractal analysis can be used to quantitatively describe the shape characteristics of metal materials and to establish the quantitative relationships between the shape characteristics and various properties of metal *** the perspective of two-dimensional planes and three-dimensional curved surfaces,this paper reviews the current research status of the fractal analysis of metal precipitate interfaces,metal grain boundary interfaces,metal-deposited film surfaces,metal fracture surfaces,metal machined surfaces,and metal wear *** relationship between the fractal dimensions and properties of metal material surfaces and interfaces is *** from three perspectives of fractal analysis,namely,research scope,image acquisition methods,and calculation methods,this paper identifies the direction of research on fractal analysis of metal material surfaces and interfaces that need to be *** is believed that revealing the deep influence mechanism between the fractal dimensions and properties of metal material surfaces and interfaces will be the key research direction of the fractal analysis of metal materials in the future.

关键词： metal material surfaces and interfaces fractal analysis fractal dimension homogeneity

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A Wind Tunnel Experimental Study on the Wake Characteristics of a Horizontal Axis Wind Turbine

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Journal of Thermal Science 2025年第1期34卷 145-158页

作者： gUO Xingduo LI Yinran LI Rennian ma Yulong WEI Kui College of Energy and Power Engineering Lanzhou University of TechnologyLanzhou 730050China Key Laboratory of Fluid machinery and Systems Lanzhou 730050China gansu Provincial Technology Centre for Wind Turbines Lanzhou 730050China

The characteristics of wind turbine wakes are influenced by multiple factors,including the atmospheric boundary layer(AbL)wind and wind turbine operating conditions(e.g.,tip speed ratio and yaw angle).In this study,two types of AbL winds with different velocity gradients and turbulence intensities are generated in a wind tunnel through configurations of spires,baffles,and various numbers of roughness elements.A wind turbine with a rotor diameter of 0.8 m and a hub height of 0.6 m is tested under varying tip speed ratios,yaw angles,and AbL wind *** results indicate that the streamwise velocity deficit in the near-wake region becomes more pronounced with an increase in the tip speed ratio,while the far-wake velocity deficit remains largely unaffected by changes in the tip speed *** the yaw angle increases,the wake deflection becomes more prominent and the wake narrows;the offset of the wake center at various downstream positions grows linearly,reaching a maximum value of approximately half the rotor ***,the turbulence level and influence range in the wake region are reduced when the turbine is *** AbL wind conditions,high turbulence intensity in the incoming flow accelerates wake recovery,and the Reynolds stress at different lateral positions tends to become consistent with increasing longitudinal ***,turbulence has a significant impact on the meandering characteristics of the wind turbine wake,with greater fluctuations in the wake center observed under higher turbulence ***,this study provides insights that could inform the optimal operation of wind farms.

关键词： horizontal axis wind turbine wind tunnel experiment wind turbine wake turbulence

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magnetron sputtered nickel oxide with suppressed interfacial defect states for efficient inverted perovskite solar cells

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Journal of Energy Chemistry 2025年第1期100卷 348-355页

作者： guoqiang ma Qin Tan Zhaoning Li Jingwei Xiu Jiafeng Wang Tianle Cheng Dong He Qiang Sun Xuhang ma Francesco Lamberti Zhubing He Department of materials Science and Engineering Institute of Innovative Materials(I2M)Shenzhen Key Laboratory of Full Spectral Solar Electricity Generation(FSSEG)Southern University of Science and Technology(SUSTech)Shenzhen 518055GuangdongChina Core Research Facilities Southern University of Science and TechnologyShenzhen 518055GuangdongChina Department of Chemical Sciences Department of Industrial EngineeringUniversity of PadovaVia Gradenigo 6a35131 PadovaItaly

Widely used spin-coated nickle oxide (NiOx) based perovskite solar cells often suffer from severe interfacial reactions between the NiOxand adjacent perovskite layers due to surface defect states,which inherently impair device performance in a long-term view,even with surface molecule *** this study,we developed high-quality magnetron-sputtered NiOxthin films through detailed process optimization,and compared systematically sputtered and spin-coated NiOxthin film surfaces from materials to *** sputtered NiOxfilms exhibit improved crystallinity,smoother surfaces,and significantly reduced Ni3+or Ni vacancies compared to their spin-coated ***,the interface between the perovskite and sputtered NiOxfilm shows a substantially reduced density of defect *** solar cells (PSCs) fabricated with our optimally sputtered NiOxfilms achieved a high power conversion efficiency (PCE) of up to 19.93%and demonstrated enhanced stability,maintaining 86.2% efficiency during 500 h of maximum power point tracking under one standard sun ***,with the surface modification using (4-(2,7-dibromo-9,9-dimethylacridin-10(9H)-yl)butyl)p hosphonic acid (DmacPA),the device PCE was further promoted to 23.07%,which is the highest value reported for sputtered NiOxbased PSCs so far.

关键词： Nickle oxide magnetron sputter Defect Stability Perovskite solar cell

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Electromagnetic wave absorption and corrosion resistance performance of carbon nanoclusters/Ce-Mn codoped barium ferrite composite materials

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International Journal of Minerals,Metallurgy and materials 2025年第3期32卷 699-709页

作者： bo Li Lin ma Sinan Li Jiewu Cui Xiaohui Liang Wei Sun Pengjie Zhang Nan Huang Song ma Zhidong Zhang Shenyang National Laboratory for materials Science Institute of Metal ResearchChinese Academy of SciencesShenyang 110016China School of materials Science and Engineering University of Science and Technology of ChinaShenyang 110016China School of Metallurgy Engineering Liaoning Institute of Science and TechnologyBenxi 117004China School of materials Science and Engineering Hefei University of TechnologyHefei 230009China Institute of Microelectronics Hangzhou Dianzi UniversityHangzhou 310018China bgRIMM magnetic materials&Technology Co. Ltd.Beijing 100160China

To realize the application of electromagnetic wave absorption(EWA)devices in humid marine environments,bifunctional EWA materials with better EWA capacities and anticorrosion properties have great exploration significance and systematic research *** utilizing the low-cost and excellent magnetic and stable chemical characteristics of barium ferrite(baFe_(12)O_(19))and using the high dielectric loss and excellent chemical inertia of nanocarbon clusters,a new type of nanocomposites with carbon nanoclusters en-capsulating baFe_(12)O_(19)was designed and synthesized by combining an impregnation method and a high-temperature calcination ***,Ce-Mn ions were introduced into the baFe_(12)O_(19)lattice to improve the dielectric and magnetic properties of baFe_(12)O_(19)cores significantly,and the energy band structure of the doped lattice and the orders of Ce replacing Fe sites were *** from Ce-Mn ion doping and carbon nanocluster encapsulation,the composite material exhibited excellent dual functionality of corrosion resist-ance and *** baCe_(0.2)Mn_(0.3)Fe_(11.5)O_(19)-C(bCM-C)was calcined at 600°C,the minimum reflection loss of-20.1 db was achieved at 14.43 *** Ku band’s effective absorption bandwidth of 4.25 gHz was achieved at an absorber thickness of only 1.3 *** bCM-C/polydimethylsiloxane coating had excellent corrosion resistance in the simulated marine environment(3.5wt%NaCl solution).The|Z|0.01Hz value of bCM-C remained at 106Ω·cm^(2)after 12 soaking *** successful preparation of the baFe_(12)O_(19)composite en-capsulated with carbon nanoclusters provides new insights into the preparation of multifunctional absorbent materials and the fabrication of absorbent devices applied in humid marine environments in the future.

关键词： electromagnetic wave absorption anticorrosion barium ferrite cerium and manganese doping carbon nanoclusters

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Hydration, Microstructure, and Properties of Sulphoaluminate Cement in Pure Water and Simulated Seawater

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Journal of Wuhan University of Technology(materials Science) 2025年第1期40卷 187-193页

作者： ma Jie China Railway Design Corporation Tianjin 300250China

Paste and mortar specimens were prepared with sulfoaluminate cement(SAC),P⋅O 42.5 ordinary Portland cement(OPC),and standard sand,and mixed and cured with pure water and artificial seawater,*** mechanical properties of mortar specimens were *** and microstructure of paste specimens were also investigated using X-ray diffraction(XRD),scanning electron microscope(SEM),and 27Al nuclear magnetic resonance(NMR),*** results indicate that SAC mortar samples mixed and cured by seawater have faster strength growth before 28 d and higher compressive strength than OPC mortar *** to curing in deionized water,the hydration products of SAC are somewhat coarser when cured in simulated *** evolution of aluminum phase hydration products during the hydration process of SAC mixed and cured in simulated seawater is quite different from that of *** 3 to 28 d,the content of each aluminum phase hydration product in SAC paste cured in simulated seawater changed little,while that in OPC paste changed significantly;for example,from 7 to 28 d,the content of ettringite(AFt)in OPC paste increased *** type of AFt formed loosely,harming the mortar's microstructure.

关键词： sulfoaluminate cement seawater mixing and curing 27Al NMR AFt

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NOTES ON THE LOg-MINKOWSKI INEQUALITY OF CURVATURE ENTROPY

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Acta mathematica Scientia 2025年第1期45卷 16-26页

作者： Deyi LI Lei ma Chunna ZENg School of Science Wuhan University of Science and TechnologyWuhan430081China School of Sciences Guangdong Preschool Normal College in MaomingMaoming525200China School of mathematical Sciences Chongqing Normal UniversityChongqing401331China

An upper estimate of the new curvature entropy is provided,via the integral inequality of a concave *** two origin-symmetric convex bodies in R^(n),this bound is sharper than the log-Minkowski inequality of curvature ... 详细信息

关键词： convex bodies the log-Minkowski inequality curvature entropy the log-Minkowski inequality of curvature entropy

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