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Integration of urchin-like MnCo_(2)O_(4)@C core–shell nanowire arrays within porous copper current collector for superior performance Li-ion battery anodes

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Rare Metals 2024年第2期43卷 599-611页

作者： xue-Ru Zhang Qiong Wu Yong Zhang Xi-Fei Li Ting Xie yu-Cheng Wu Instrumental Analysis Center Hefei University of TechnologyHefei230009China Key Laboratory of Advanced Functional Materials and Devices of Anhui Province Hefei230009China School of Materials Science and Engineering Hefei University of TechnologyHefei230009China Institute of Advanced Electrochemical Energy Xi’an University of TechnologyXi’an710048China

Spinel MnCo_(2)O_(4) is a promising energy storage candidate as anode materials in lithium-ion batteries owing to synergistic effects of two intrinsic solid-state redox ***,low conductivity,poor rate capacity and rapid capacity fading have seriously impaired its practical *** overcome the inferiorities,urchin-like MnCo_(2)O_(4)@C core–shell nanowire arrays have been fabricated directly within a porous copper current collector via a facile hydrothermal method followed by a chemical vapor deposition carbonization *** a typical nanowire,the core is composed of interconnected MnCo_(2)O_(4)nanoparticles and the shell shows as a thin amorphous carbon *** integrated MnCo_(2)O_(4)@C/Cu structure could act as working anodes without using additives or polymer *** MnCo_(2)O_(4)@C/Cu possesses slightly longer Li-ion insertion/desertion pathway than that of MnCo_(2)O_(4)/Cu,the carbon shell could effectively prevent the pulverization of MnCo_(2)O_(4) and lower down charge transfer resistance and actively participate in Li-ion *** rearrangement of carbon atoms during lithiation/delithiation cycling could inhibit the formation of passive solid electrolyte interphase *** a result,the MnCo_(2)O_(4)@C/Cu electrode presents superior rate capacity(600 mAh·g^(−1) at 1 A·g^(−1)) and better stability(797 mAh·g^(−1) after 200 cycles at 100 mA·g^(−1)).The excellent reversible Li ion storage capacity,cycling stability and rate capacity endow MnCo_(2)O_(4)@C/Cu great potential as stable and high output integrated anode materials in Li-ion batteries.

关键词： MnCo_(2)O_(4)@C Urchin-like nanowire arrays Core-shell Integrated anode materials Lithium-ion batteries

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Theoretical insights into efficient oxygen evolution reaction using non-noble metal single-atom catalysts on W2CO2 MXene

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Rare Metals 2024年第10期43卷 5082-5094页

作者： Jing-yu Zhou Zhi-Cheng Han Shu Zhao Tao Yang Da-Zhou Yan Hai-jun yu Institute of Advanced Battery Materials and Devices College of Materials Science and EngineeringBeijing University of Technology Key Laboratory of Advanced Functional Materials Ministry of EducationBeijing University of Technology China ENFI Engineering Corporation National Engineering Research Center of Silicon-Based Materials Manufacturing Technology

The pursuit of highly active oxygen evolution reaction （OER） catalysts,especially those free of noble metals,is a focal point in fuel cell *** extensive density functional theory calculations,this study designed and evaluated the activity and stability of singleatom catalysts （SACs） composed of 3d,4d and 5d transition metals supported on tungsten-based MXene for OER *** highlighted the exceptional OER performance of Ni@W2CO2,Rh@W2CO2and Pt@W2CO2,displaying remarkably low overpotentials The catalytic activity of TM@W2CO2SACs exhibited a robust correlation with surface properties,particularly the d-band center index and surface work *** Ni@W2CO2,Rh@W2CO2and Pt@W2CO2emerged as promising candidates for OER and oxygen reduction reaction （ORR） bifunctional catalysis,while Pt@W2CO2and Rh@ W2CO2showed high potential for OER and hydrogen evolution reaction （HER） bifunctional catalysis The effectiveness of tungsten-based MXene as a substrate for non-noble-metal SACs marks a breakthrough in OER catalyst design,driving advancements towards sustainable energy solutions and addressing critical challenges in energy conversion and storage.

关键词： Density functional theory MXene Non-noble metal Oxygen evolution reaction Single-atom catalysts

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One-pot synthesis of a giant twisted double-layer chiral macrocycle via [4+8] imine condensation and its X-ray structure

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Chinese Chemical Letters 2024年第10期35卷 241-243页

作者： yu Pang Min Wang Ning-Hua Yang Min xue Yong Yang School of Science Department of PhysicsKey Laboratory of Optical Field Manipulation of Zhejiang ProvinceZhejiang Sci-Tech UniversityHangzhou 310018China School of Chemistry and Chemical Engineering Key Laboratory of Surface&Interface Science of Polymer Materials of Zhejiang ProvinceZhejiang Sci-Tech UniversityHangzhou310018China

Trifluoroacetic acid(TFA)catalyzed condensation reaction between tetraaminooxacalix[4]arene and N-alkylcarbazole-3,6-dicarbaldehyde in CH_(2)Cl2afforded a single product in 87%–89%***-defined yet undissolvable1H NMR spectra suggested formation of robust and discrete structures in solution.X-ray single crystal analysis further revealed a giant twisted double-layer chiral macrocycle in the solid state,which was formed from[4+8]condensation of the two reactants via 16 imine *** calculations discovered that only the[4+8]twisted product is thermodynamically favorable,which accounts for its highly selective and efficient formation out of a library of many other combinations.

关键词： One-pot synthesis Oxacalixarene Dynamic covalent chemistry Chiral macrocycle X-ray single crystal

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Inherently Chiral and Symmetrical Heteroatom-Doped Zigzag-Type Hydrocarbon Belts

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CCS Chemistry 2024年第5期6卷 1198-1210页

作者： xue-yuan Wang Xin-yu Zhang Shuo Tong Qing-Hui Guo Mei-Ling Tan Cheng-jun Li Mei-Xiang Wang Key Laboratory of Bioorganic Phosphorous Chemistry and Chemical Biology(Ministry of Education) Department of ChemistryTsinghua UniversityBeijing 100084

hydrocarbon belts due to their potential applications in carbon *** contrast,heteroatomembedded zigzag hydrocarbon belts as advanced design strategies with fascinating structures and desirable,unique properties have remained largely unexplored,and inherently chiral ones are ***,we report the synthesis of a diversity of symmetric and highly enantiopure inherently chiral O-and N-doped zigzag-type hydrocarbon belts starting from strainless macrocycles based on fjord-stitching *** readily available pertriflated resorcin[6]arene underwent partial hydrolyses and intramolecular S_(N)Ar reactions to form a calix[3](9H-xanthene)derivative and a prochiral half-belt *** transformations of calix[3](9H-xanthene)into C_(3v)-symmetric molecular belts were achieved by closing the rest of the fjords with triple intramolecular S_(N)Ar reactions and Yamamoto homo coupling reactions,as well as palladiumcatalyzed intermolecular acridination reactions with primary *** prochiral half-belt underwent enantioselective desymmetrizative mono-acridination to afford an inherently chiral N,O_(4)-bridged pseudo-belt with an enantiomeric excess(ee)value of>99%under the catalysis of Pd(OAc)_(2)and(R)-*** closure reactions of the pseudo-belt produced diverse heteroatom-inlayed zigzag-type hydrocarbon belts of inherent ***,we showed the unique cavity structures of the belts and demonstrated interesting chiroptic properties of the inherently enantiopure chiral *** research opens the door for the exploration of novel and sophisticated symmetric and inherently chiral molecular nanobelt structures with outstanding physical and chemical properties,as well as potential applications.

关键词： zigzag-type molecular belt heterocycle chiroptical property fjord-stitching strategy resorcinarene

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Second Harmonic Generation in Nanowires

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Chinese Physics Letters 2024年第10期41卷 43-60页

作者： Bi-jun Zhao Jian-Lin Zhao xue-Tao Gan Microelectronics and Nanoelectronics Department School of MicroelectronicsNorthwestern Polytechnical UniversityXi’an 710072China Key Laboratory of Light Field Manipulation and Information Acquisition Ministry of Industry and Information Technologyand Shaanxi Key Laboratory of Optical Information TechnologySchool of Physical Science and TechnologyNorthwestern Polytechnical UniversityXi’an 710072China

Second harmonic generation(SHG)in optical materials serves as important techniques for laser source generations in awkward spectral ranges,physical identities of materials in crystalline symmetry and interfacial ***,we present a comprehensive review on SHGs in nanowires(NWs),which have been recognized as an important element in constructing photonic and optoelectronic devices with compact footprint and high quantum *** on NW’s one-dimensional geometry,its SHG could be employed as a sophisticated spectroscopy to determine the crystal phase and orientation,as well as the internal *** enhancements of SHG efficiency in NWs are discussed then,which were realized by hybrid integrating them with two-dimensional materials,nanophotonic and plasmonic ***,the potential applications of NW SHGs are concluded,including the areas of optical correlators and constructions of on-chip nano-laser sources.

关键词： nanowires integrating constructing

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Modelling the viscoplastic behaviour of Callovo-Oxfordian claystone with consideration of damage effect

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Journal of Rock Mechanics and Geotechnical Engineering 2024年第1期16卷 303-316页

作者： Hao Wang yu-jun Cui Minh Ngoc Vu Jean Talandier Ecole des Ponts ParisTech Laboratoire Navier/CERMES6 et 8 avenue Blaise PascalMarne La Vallée cedex 277455France Andra R&D DepartmentChâtenay-Malabry92290France

In order to evaluate the performance of deep geological disposal of radioactive waste,an underground research laboratory(URL)was constructed by Andra in the Callovo-Oxfordian(COx)claystone formation at the Meuse/Haute-Marne(MHM).The construction of URL induced the excavation damage of host formations,and the ventilation in the galleries desaturated the host formation close to the gallery ***,it is expected that the mechanical behaviour of COx claystone is *** study presents a constitutive model developed to describe the viscoplastic behaviour of unsaturated and damaged COx *** this model,the unsaturation effect is considered by adopting the Bishop effective stress and the van Genuchten(VG)water retention *** terms of the viscoplastic behaviour,the nonstationary flow surface(NSFS)theory for unsaturated soils is used with consideration of the coupled effects of strain rate and suction on the yield stress.A progressive hardening law is ***,a non-associated flow rule is used,which is similar to that in Barcelona basic model(BBM).In addition,to describe the damage effect induced by suction change and viscoplastic loading,a damage function is defined based on the crack volume *** damage function contains two variables:unsaturated effective stress and viscoplastic volumetric strain,with the related parameters determined based on the mercury intrusion porosimetry(MIP)*** the model validation,different tests on COx claystone under different loading paths are *** between experimental and simulated results indicated that the present model is able to well describe the viscoplastic behaviour of damaged COx claystone,including swelling/shrinkage,triaxial extension and compression,and triaxial creep.

关键词： Callovo-Oxfordian(COx)claystone Excavation damage Time-dependent behaviour Suction Viscoplastic model

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Micro-nanoarchitectonic of aluminum-hydrogel propellant with static stability and dynamic rheology

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Frontiers of Chemical Science and Engineering 2024年第4期18卷 87-96页

作者： Huiyan Guo Huaiyu Li Hongzhi Zhang Lun Pan Chengxiang Shi Kang xue Xiangwen Zhang Ji-jun Zou Key Laboratory for Advanced Fuel and Propellant of Ministry of Education School of Chemical Engineering and TechnologyTianjin UniversityTianjin 300072China

The aluminum-water system is a promising propellant due to high energy and low signal characteristics,and the gel form is easier to store and *** this work,hydrogels of water and aluminum particles were prepared using the low-molecular-weight gellant *** various physical properties of gel systems,including the water loss rate,phase transition temperature,and centrifugal stability at different gellant and aluminum contents,were *** properties were assessed through shear thinning tests,thixotropy tests,strain sweep analysis,and frequency sweep *** microstructure of the gel was obtained through scanning electron microscopy *** results show that the aluminum-hydrogel network structure is composed of micron-scale aluminum and agarose nanosheets,and the unique micro-nanostructure endows the gel with excellent mechanical strength and thermal stability,which improve with increasing gellant and aluminum ***,the gel with 2% agarose and 20% aluminum had the best performance;the storage modulus reached 90647 Pa,which was within the linear viscoelastic region,and the maximum withstand pressure was 111.2 kPa,which was 118.8% greater than that of the pure ***,the gel demonstrates remarkable shear thinning behavior and can undergo gel-sol transformation upon shearing or heating to exceeding 114℃.

关键词： aluminum-water propellant gelled propellant rheological property mechanical strength

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A phylogenetic approach identifies patterns of beta diversity and floristic subregions of the Qinghai-Tibet Plateau

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Plant Diversity 2024年第1期46卷 59-69页

作者： Haibin yu Man Yang Zixin Lu Weitao Wang Fangyuan yu Yonghua Zhang xue Yin Hongjun yu junjie Hu David C.Deane Key Laboratory of Conservation and Application in Biodiversity of South China School of Life SciencesGuangzhou UniversityGuangzhou 510006China School of Ecology Sun Yat-Sen UniversityShenzhen 510275China School of Geography and Remote Sensing Guangzhou UniversityGuangzhou 510006China College of Life and Environmental Science Wenzhou UniversityWenzhou 325035China Centre for Future Landscapes and Department of Environment and Genetics La Trobe UniversityBundooraVIC 3083Australia

Patterns of taxonomic and phylogenetic beta diversity and their relationships with environmental correlates can help reveal the origin and evolutionary history of regional *** Qinghai-Tibet Plateau(QTP)harbors an exceptionally diverse flora,however,a phylogenetic perspective has rarely been used to investigate its beta diversity and floristic *** this study,we used a phylogenetic approach to identify patterns of beta diversity and quantitatively delimit floristic regions on the Qinghai-Tibet *** also examined the relationships between multifaceted beta diversity,geographical distance,and climatic difference,and evaluated the relative importance of various factors(i.e.,climate,topography and history)in shaping patterns of beta diversity.Sørensen dissimilarity indices indicated that patterns of species turnover among sites dominated the *** also found that patterns of both taxonomic and phylogenetic beta diversity were significantly related to geographical distance and climatic *** environmental factors that contributed most to these patterns of beta diversity include annual precipitation,mean annual temperature,climatic gradients and climatic *** dendrograms of dissimilarity and non-metric multidimensional scaling ordination based on phylogenetic beta diversity data identified ten floristic subregions in the *** results suggest that the contemporary environment and historical climate changes have filtered species composition among sites and eventually determined beta diversity patterns of plants in the QTP.

关键词： Biogeographical regionalization Phylogenetic beta diversity Seed plants Sørensen dissimilarity Qinghai-Tibet Plateau

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Spray pyrolysis-derived W-doped MoSe_(2)/rGO paper-like microspheres:optimization of microstructure and mesostructure for enhanced lithium storage

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Rare Metals 2024年第7期43卷 3019-3031页

作者： Wei Wang jun-yu Chen Jie Ouyang Hong Yin Ao-Jie Li Liang Chen jun-Lin Huang yu-Can Zhu Gang-Yong Li Zhao-Hui Hou Key Laboratory of Hunan Province for Advanced Carbon-based Functional Materials Hunan Institute of Science and TechnologyYueyang 414006China School of Chemistry and Chemical Engineering Hunan Institute of Science and TechnologyYueyang414006China Hunan Province Key Laboratory of Materials Surface&Interface Science and Technology Material Science and Engineering SchoolCentral South University of Forestry and TechnologyChangsha 410004China International Iberian Nanotechnology Laboratory(INL) AvMestre Jose Veiga4715-330 BragaPortuga

Two-dimensional MoSe_(2) is a promising candidate for lithium-ion battery ***,its conductivity and lithium storage volumetric effect still need to be *** this work,W-doped MoSe_(2)/rGO paper-like microspheres are successfully prepared through ultrasonic spray pyrolysis,achieving optimization at both the microstructure and mesostructure to enhance the lithium storage performance of the ***,by utilizing the similar two-dimensional structure between MoSe_(2) and rGO,self-assembly is achieved through spray pyrolysis,resulting in a well-defined van der Waals heterostructure at the interface on the microscale,enhancing the electron and ion transfer capability of the ***,the mesoscale paper-like microsphere morphology provides additional volume expansion buffering ***,W-doping not only increases the interlayer spacing of MoSe_(2)(0.73 nm),thereby reducing the diffusion resistance of Li+,but also allow for the modulation of the energy band structure of the *** functional theory(DFT)calculations confirm that W-doped MoSe_(2)/rGO exhibits the narrowest bandgap(0.892 eV).Therefore,the composite demonstrates excellent lithium storage performance,maintaining a specific capacity of 732.9 mAh·g^(-1)after 300 cycles at a current density of 1 A·g^(-1).

关键词： Molybdenum selenide Heterostructure Microspheres Li-ion batteries Kinetics

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An attention-based teacher-student model for multivariate short-term landslide displacement prediction incorporating weather forecast data

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Journal of Mountain Science 2024年第8期21卷 2739-2753页

作者： CHEN jun HU Wang ZHANG yu QIU Hongzhi WANG Renchao Sichuan Artificial Intelligence Research Institute Yibin 644000China School of Computer Science and Engineering University of Electronic Science and Technology of ChinaChengdu 611731China School of Architecture and Civil Engineering Chengdu UniversityChengdu 610106China

Predicting the displacement of landslide is of utmost practical importance as the landslide can pose serious threats to both human life and ***,traditional methods have the limitation of random selection in sliding window selection and seldom incorporate weather forecast data for displacement prediction,while a single structural model cannot handle input sequences of different lengths at the same *** order to solve these limitations,in this study,a new approach is proposed that utilizes weather forecast data and incorporates the maximum information coefficient(MIC),long short-term memory network(LSTM),and attention mechanism to establish a teacher-student coupling model with parallel structure for short-term landslide displacement *** MIC,a suitable input sequence length is selected for the LSTM *** investigate the influence of rainfall on landslides during different seasons,a parallel teacher-student coupling model is developed that is able to learn sequential information from various time series of different *** teacher model learns sequence information from rainfall intensity time series while incorporating reliable short-term weather forecast data from platforms such as China Meteorological Administration(CMA)and Reliable Prognosis(https://***)to improve the model’s expression capability,and the student model learns sequence information from other time *** attention module is then designed to integrate different sequence information to derive a context vector,representing seasonal temporal attention ***,the predicted displacement is obtained through a linear *** proposed method demonstrates superior prediction accuracies,surpassing those of the support vector machine(SVM),LSTM,recurrent neural network(RNN),temporal convolutional network(TCN),and LSTM-Attention *** achieves a mean absolute error(MAE)of 0.072 mm,root mean square error(RMSE)of 0.096 mm,and pearson correlation coefficients(PC

关键词： Landslide prediction MIC LSTM Attention mechanism Teacher Student model Prediction stability and interpretability

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