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AN APPLICATION OF TOPOLOGICAL ANALYSIS TO STUDYING THE THREE-DIMENSIONAL FLOW IN CASCADES;PART I—TOPOLOGICAL RULES FOR SKIN-FRICTION LINES AND SECTION STREAMLINES 被引量:2
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作者 康顺 《Applied Mathematics and Mechanics(English Edition)》 SCIE EI 1990年第5期489-495,共7页
Based on the working of Lighthill and Hunt et al., in the present paper the author has established the topological rules adapting to analysing the skin-friction lines and the section streamlines in cascades. These rul... Based on the working of Lighthill and Hunt et al., in the present paper the author has established the topological rules adapting to analysing the skin-friction lines and the section streamlines in cascades. These rules are (1) for a rotor cascade without shroud band, the total number of nodal points equals that the saddle points on the skin-friction line vector fields in eachpitch range; (2) for an annular or straight cascade with no-clearances at blade ends, the total number of saddle points is two more than that of nodal points on the skin-friction line fields in a pitch; (3) the total number of saddles in the secondary flow fields on cross-sections in cascade is one less than that of nodes; (4) in the section streamline vector fields on a meridian surface penetrating a flow passage, and on leading and trailing edge sections, the total number of nodes is equal to that of saddles; (5) on the streamline vector fields of a blade-to-blade surface, the total number of nodes is one less than that of saddles. 展开更多
关键词 node topological RULES FOR SKIN-FRICTION LINES AND SECTION STREAMLINES AN APPLICATION OF topological analysis TO STUDYING THE THREE-DIMENSIONAL FLOW IN CASCADES PART I
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AN APPLICATION OF TOPOLOGICAL METHOD TO ANALYSING THE THREE-DIMENSIONAL FLOW IN CASCADES(Ⅱ)-TOPOLOGICAL ANALYSIS ON THE VECTOR FIELD PATTERNS OF SKINFRICTIONS AND SECTION STREAMLINES
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作者 Kang Shun Wang Zhongqi 《Applied Mathematics and Mechanics(English Edition)》 SCIE EI 1990年第12期1119-1127,共9页
With an application of topological analysis,in this paper the skin-friction line patterns on compressor and turbine cascade surfaces are depicted and the streamline patterns of the secondary flow fields in the cross-s... With an application of topological analysis,in this paper the skin-friction line patterns on compressor and turbine cascade surfaces are depicted and the streamline patterns of the secondary flow fields in the cross-section of a curved pipe and a turbine cascade are drawn under given conditions.In addition the structures of vortices within three-dimensional viscous flow fields in cascades are analysed. 展开更多
关键词 topological analysis separation flow three-dimensional flow visualization turbine COMPRESSOR VORTEX
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Combined DFT and geometrical-topological analysis of Li-ion conductivity in complex hydrides
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作者 Valerio Gulino Anna Wolczyk +6 位作者 Andrey A.Golov Roman A.Eremin Mauro Palumbo Carlo Nervi Vladislav A.Blatov Davide M.Proserpio Marcello Baricco 《Inorganic Chemistry Frontiers》 2020年第17期3115-3125,共11页
On the basis of DFT calculations,Li-ion migration was analyzed for LiBH_(4),LiNH_(2),Li_(2) NH,Li_(2)BH_(4)NH_(2),Li_(4)BH_(4)(NH_(2))_(3) and Li_(5)(BH_(4))_(3)NH complex hydrides by means of the nudged elastic band ... On the basis of DFT calculations,Li-ion migration was analyzed for LiBH_(4),LiNH_(2),Li_(2) NH,Li_(2)BH_(4)NH_(2),Li_(4)BH_(4)(NH_(2))_(3) and Li_(5)(BH_(4))_(3)NH complex hydrides by means of the nudged elastic band method.In addition,a Voronoi-partition-based method,as implemented in the ToposPro program package,was adopted to determine cavities and channels in the complex hydrides and possible Li-ion migration pathways were computed.Experimental data for the Li-ion conductivity in the six compounds,measured by electrochemical impedance spectroscopy,have been taken from the literature and activation energies have been determined by a statistical analysis.A link between experimental and calculated activation energies has been evidenced,suggesting that topological analysis can provide good hints for the estimation of ion conductivity in complex hydrides. 展开更多
关键词 dft calculationsli ion nudged elastic band methodin Geometrical topological analysis complex hydrides Li ion conductivity Nudged elastic band method cavities channels DFT calculations
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Flow Visualization and Topological Analysis of a Turbine Rotor Cascade with Tip Clearance
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作者 Han Wanjin Liu Fengjun +1 位作者 Zhong Jingjun Wang Zhongqi (Department of Power Engineering, Harbin Institute of Technology, Harbin, 150001, China) 《Journal of Thermal Science》 SCIE EI CAS CSCD 1997年第3期164-170,共7页
By means of ink trace visualization and topological allalysis, this paper investigates the topological structure of the flow pattern surrounding both endwalls and blade surfaces for a low aspect ratio linear rotor cas... By means of ink trace visualization and topological allalysis, this paper investigates the topological structure of the flow pattern surrounding both endwalls and blade surfaces for a low aspect ratio linear rotor cascade with tip cIearance. The structure of the flow pattern shows that most of the singular points and separation lines are located in the upper half span region of the tested cascade where the aerodynamic behaviors are deteriorated. 展开更多
关键词 turbine rotor cascade tip clearance flow visualization topological analysis
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Topology Data Analysis-Based Error Detection for Semantic Image Transmission with Incremental Knowledge-Based HARQ
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作者 Ni Fei Li Rongpeng +1 位作者 Zhao Zhifeng Zhang Honggang 《China Communications》 2025年第1期235-255,共21页
Semantic communication(SemCom)aims to achieve high-fidelity information delivery under low communication consumption by only guaranteeing semantic accuracy.Nevertheless,semantic communication still suffers from unexpe... Semantic communication(SemCom)aims to achieve high-fidelity information delivery under low communication consumption by only guaranteeing semantic accuracy.Nevertheless,semantic communication still suffers from unexpected channel volatility and thus developing a re-transmission mechanism(e.g.,hybrid automatic repeat request[HARQ])becomes indispensable.In that regard,instead of discarding previously transmitted information,the incremental knowledge-based HARQ(IK-HARQ)is deemed as a more effective mechanism that could sufficiently utilize the information semantics.However,considering the possible existence of semantic ambiguity in image transmission,a simple bit-level cyclic redundancy check(CRC)might compromise the performance of IK-HARQ.Therefore,there emerges a strong incentive to revolutionize the CRC mechanism,thus more effectively reaping the benefits of both SemCom and HARQ.In this paper,built on top of swin transformer-based joint source-channel coding(JSCC)and IK-HARQ,we propose a semantic image transmission framework SC-TDA-HARQ.In particular,different from the conventional CRC,we introduce a topological data analysis(TDA)-based error detection method,which capably digs out the inner topological and geometric information of images,to capture semantic information and determine the necessity for re-transmission.Extensive numerical results validate the effectiveness and efficiency of the proposed SC-TDA-HARQ framework,especially under the limited bandwidth condition,and manifest the superiority of TDA-based error detection method in image transmission. 展开更多
关键词 error detection incremental knowledgebased HARQ joint source-channel coding semantic communication swin transformer topological data analysis
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TopoMSG:A Topology-Aware Multi-Scale Graph Network for Social Bot Detection
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作者 Junhui Xu Qi Wang +1 位作者 Chichen Lin Weijian Fan 《Computers, Materials & Continua》 2026年第3期1164-1178,共15页
Social bots are automated programs designed to spread rumors and misinformation,posing significant threats to online security.Existing research shows that the structure of a social network significantly affects the be... Social bots are automated programs designed to spread rumors and misinformation,posing significant threats to online security.Existing research shows that the structure of a social network significantly affects the behavioral patterns of social bots:a higher number of connected components weakens their collaborative capabilities,thereby reducing their proportion within the overall network.However,current social bot detection methods still make limited use of topological features.Furthermore,both graph neural network(GNN)-based methods that rely on local features and those that leverage global features suffer from their own limitations,and existing studies lack an effective fusion of multi-scale information.To address these issues,this paper proposes a topology-aware multi-scale social bot detection method,which jointly learns local and global representations through a co-training mechanism.At the local level,topological features are effectively embedded into node representations,enhancing expressiveness while alleviating the over-smoothing problem in GNNs.At the global level,a clustering attention mechanism is introduced to learn global node representations,mitigating the over-globalization problem.Experimental results demonstrate that our method effectively overcomes the limitations of single-scale approaches.Our code is publicly available at https://anonymous.4open.science/r/TopoMSG-2C41/(accessed on 27 October 2025). 展开更多
关键词 Social bot detection graph neural network topological data analysis
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Toward a Neurophysiological Measure of Image Quality Perception Based on Algebraic Topology Analysis
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作者 Chang Liu Xiaoyu Ma +2 位作者 Yijie Zhou Jiaojiao Wang Dingguo Yu 《China Communications》 SCIE CSCD 2022年第2期31-38,共8页
The bandwidth of internet connections is still a bottleneck when transmitting large amounts of images,making the image quality assessment essential.Neurophysiological assessment of image quality has highlight advantag... The bandwidth of internet connections is still a bottleneck when transmitting large amounts of images,making the image quality assessment essential.Neurophysiological assessment of image quality has highlight advantages for it does not interfere with natural viewing behavior.However,in JPEG compression,the previous study is hard to tell the difference between the electroencephalogram(EEG)evoked by different quality images.In this paper,we propose an EEG analysis approach based on algebraic topology analysis,and the result shows that the difference between Euler characteristics of EEG evoked by different distortion images is striking both in the alpha and beta band.Moreover,we further discuss the relationship between the images and the EEG signals,and the results implied that the algebraic topological properties of images are consistent with that of brain perception,which is possible to give birth to braininspired image compression based on algebraic topological features.In general,an algebraic topologybased approach was proposed in this paper to analyze the perceptual characteristics of image quality,which will be beneficial to provide a reliable score for data compression in the network and improve the network transmission capacity. 展开更多
关键词 image quality assessment ELECTROENCEPHALOGRAM algebraic topology analysis Euler characteristic
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Topological data analysis with digital microscope leather images for animal species classification
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作者 Takuya Ehiro Takeshi Onji 《Collagen and Leather》 2025年第2期79-93,共15页
This study presents a method for classifying cow and horse leather using a small number of digital microscope images and topological data analysis.In this method,hair pore coordinates in the images are used as essenti... This study presents a method for classifying cow and horse leather using a small number of digital microscope images and topological data analysis.In this method,hair pore coordinates in the images are used as essential information for classification.First,the coordinates were semiautomatically extracted using conventional image processing methods and persistent homology(PH)computation.Binary images with white pixels corresponding to the coordinates were generated,and their PHs were computed using filtration based on the Manhattan distance.In addition to the pairwise distance between the two pores,zeroth-and first-order lifetimes were used as explanatory variables to construct the classifier.Among the three explanatory variables,the zeroth-order lifetime resulted in the highest classification accuracy(86%)for the test data.Furthermore,we constructed logistic regression(LR)and random forest(RF)models using the zeroth-order lifetime computed from all images and conducted model interpretation.In both LR and RF,information on a zeroth-order lifetime of less than 10 was used as an important explanatory variable.Additionally,the inverse analysis of birth-death pairs suggested that the zeroth-order lifetime contains topological information distinct from the conventional pairwise distance.Our proposed method is designed to be robust in datalimited situations because it only uses hair pore coordinates as explanatory variables and does not require other information,such as hair pore density or pore size.This study demonstrates that accurate classifiers can be obtained using topological features related to hair pore arrangement. 展开更多
关键词 Animal species classification Machine learning topological data analysis Persistent homology LIFETIME
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Hysteresis behaviors of compressor rotating stall with cusp catastrophic model 被引量:4
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作者 Zhiping LI Peng ZHANG +2 位作者 Tianyu PAN Qiushi LI Jian ZHANG 《Chinese Journal of Aeronautics》 SCIE EI CAS CSCD 2018年第5期1075-1084,共10页
Rotating stall is a complex nonlinear dynamic phenomenon which is always characterized by catastrophe and hysteresis in high aerodynamic-loading compressor. Exploring the key contributing factors and characteristic ru... Rotating stall is a complex nonlinear dynamic phenomenon which is always characterized by catastrophe and hysteresis in high aerodynamic-loading compressor. Exploring the key contributing factors and characteristic rules of hysteresis is very important for compressor design and flow instability control. In this paper, a novel model method is proposed to analyze the hysteresis behaviors to extend the understanding of compressor rotating stall. The equilibrium states of compressor system under different conditions are first described based on Moore-Greitzer model. Then,through assessing the stability of the equilibrium points by Liapunov's theorem, the ratio of shutoff head to compressor characteristic semi-height is found to affect the stall hysteresis: the size of hysteresis loop will gradually decrease, even disappear with the increase of the ratio. Combing the effects of both the ratio and throttle coefficient, the hysteresis behaviors of compressor stall under multi-parameters can be found to be consistent with the topological properties of cusp catastrophic model by Thom's catastrophe theory. Finally, according to topological invariant rules, from the perspective of potential function, the equilibrium surface equation of compressor system is developed by standard cusp catastrophic model to describe the various hysteresis behaviors of compressor rotating stall along different control routes. 展开更多
关键词 Catastrophe theory COMPRESSOR HYSTERESIS Rotating stall topological analysis
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Topology analysis of metal–organic frameworks based on metal–organic polyhedra as secondary or tertiary building units
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作者 Dongwook Kim Xinfang Liu Myoung Soo Lah 《Inorganic Chemistry Frontiers》 2015年第4期336-360,共25页
The structural features of metal–organic frameworks(MOFs)can be analyzed based on the network structure(net)topology,composed of nodes and linkers.The connectivity and site symmetry of a node are probably the most im... The structural features of metal–organic frameworks(MOFs)can be analyzed based on the network structure(net)topology,composed of nodes and linkers.The connectivity and site symmetry of a node are probably the most important factors affecting the net topology of MOFs.Many MOFs with multiple nodes of different connectivity and site symmetry have complicated net topologies.However,the underlying net topology of some complicated MOFs could be analyzed using a hierarchical simplification approach.The underlying net topology of complicated MOFs with multi-connected nodes could be analyzed using a metal–organic polyhedron composed of multiple nodes as either a secondary building unit or a tertiary building unit.The simplified net topology provides better insight into the structural features of the complicated MOF structures and could be utilized in designing new MOF structures with known and/or unprecedented net topologies. 展开更多
关键词 tertiary building units hierarchical simplification approachthe metal organic polyhedra metal organic frameworks topology analysis net topology metal organic frameworks mofs can secondary building units
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AIM Study on the Reaction of CH2SH Radical with Fluorine Atom
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作者 Cui-hong Suna Yan-li Zeng +1 位作者 Ling-peng Meng Shi-jun Zheng 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 北大核心 2008年第2期123-130,共8页
The reaction of CH2SH radical with fluorine atom was studied at the levels of B3LYP/6-311G(d,p) and MP2(Full)/6-311G(d,p). The computational results show that the reaction has three channels and proceeds by the ... The reaction of CH2SH radical with fluorine atom was studied at the levels of B3LYP/6-311G(d,p) and MP2(Full)/6-311G(d,p). The computational results show that the reaction has three channels and proceeds by the addition of fluorine atoms on carbon or sulfur sites of CH2SH, forming initial intermediates. The calculated results show that the channel, in which fluorine attaches to the carbon atom to form CH2S and HF, is the most likely reaction pathway. Topological analysis of electron density was carried out for the three channels. The change trends of the chemical bonds on the reaction paths were discussed. The energy transition states and the structure transition regions (states) of the three channels were found. The calculated results show that the structure transition regions are broad in unobvious exothermic reactions or unobvious endothermic reactions, and are narrow in obvious exothermic reactions or obvious endothermic reactions. 展开更多
关键词 Radical reaction Energy transition state Structure transition state Structure transition region topological analysis of electronic density
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Syntheses and Crystal Structures of Two Coordination Polymers Based on a Flexible Ligand N,N'-Diacetic Acid Imidazolium
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作者 柴小川 赵玲艳 +2 位作者 张汉辉 陈义平 弓巧娟 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2012年第5期749-757,共9页
Two coordination compounds with a flexible ligand N,N?-diacetic acid imidazolium(HDAM),{[Co(trans-DAM)(bipy)(H2O)2](OH)·4H2O}n 1 and {[Cd(trans-DAM)(bipy)(H2O)](NO3)?2H2O}n 2(bipy = 4,4'-bip... Two coordination compounds with a flexible ligand N,N?-diacetic acid imidazolium(HDAM),{[Co(trans-DAM)(bipy)(H2O)2](OH)·4H2O}n 1 and {[Cd(trans-DAM)(bipy)(H2O)](NO3)?2H2O}n 2(bipy = 4,4'-bipyridine),were prepared and characterized by single-crystal X-ray diffraction.Compound 1 crystallizes in monoclinic,space group P2/n with a = 7.589(6),b = 11.444(2),c = 12.894(3)(A°),β = 90.99(3)°,V = 1119.8(4)(A°)^3,Z = 4,C8.5H14N2O5.5Co0.5,Mr = 261.68,Dc = 1.552 g/cm^3,F(000) = 546,μ = 0.832 mm^-1,the final R = 0.0657 and wR = 0.1958.Compound 2 crystallizes in the monoclinic C2 space group with a = 17.479(4),b = 11.689(2),c = 11.670(2),β = 117.13(3)°,V = 2121.9(7)3,Z = 4,C17H21N5O10Cd,Mr = 567.79,Dc = 1.777 g/cm^3,F(000) = 1144,μ = 1.096 mm^-1,the final R = 0.0233 and wR = 0.0638.In 1,the Co(II) ions are linked by μ2-trans-DAM-and bipy ligands to build a 2D(4,4) rectangular grid layer,exhibiting a 4-connected sql net.As for 2,μ3-trans-DAM-and bipy bridge Cd(II) ions form a 2D double-layer,consisting of a couple of(4,4) grid layers,which can be viewed as a(3,4)-connected network.In both compounds,the 2D structures are stabilized by hydrogen bonding interactions to give 3D supramolecular frameworks.Additionally,FT-IR spectroscopy,UV-Visible spectroscopy,and the fluorescent properties are discussed. 展开更多
关键词 N N'-diacetic acid imidazolium crystal structure topological analysis fluorescent properties
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Natural movement:Measuring optimal pathway configuration of museum layout and pedestrian accessibility through visibility graph analysis and intelligent agent simulation
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作者 Xiang Wang Mengsi Yang +4 位作者 Weicong Li Lin Yuan Qimeng Ren Qian Xie Runze Liu 《Frontiers of Architectural Research》 2025年第5期1228-1248,共21页
This study explores the interaction between spatial configuration,natural mobility,and visual accessibility in exhibition spaces,an area that remains underexplored.By integrating visibility graph analysis(VGA),intelli... This study explores the interaction between spatial configuration,natural mobility,and visual accessibility in exhibition spaces,an area that remains underexplored.By integrating visibility graph analysis(VGA),intelligent agent simulation(IAS),topological analysis,and field observation,the research examines functional layout and accessibility across four museums.Findings indicate that corridors and pathways,second only to exhibition halls,play a crucial role in spatial mobility.Composite layouts(e.g.,circular and L-shaped designs)exhibit superior mean depth and integration,yet connectivity and mean depth demonstrate a nonlinear relationship.Elongated or complex path turns increase cognitive load,complicating navigation,while open passageways promote smoother visitor distribution.Topological analysis effectively identifies optimal nodes,key locations,and path-turn efficiency under accessibility constraints.Visitor dwell time is shaped not only by exhibit content but also by spatial location,entry sequence,and visitor density.Results support the assumption that space syntax models align with realworld visitor flow patterns,yet predictive models fail to fully capture variations in mobility across different timeframes and behavioral contexts.These insights contribute to optimizing museum design for improved visitor experience and spatial efficiency. 展开更多
关键词 MUSEUM Functional configuration Layout structure Spatial mobility Space syntax topological analysis
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Theoretical Study on Hydrogen Interaction between 5-Fluorouracil and Glycine 被引量:3
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作者 和芹 霍爱新 +1 位作者 孟祥军 杨静 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2010年第5期738-746,共9页
The geometries,electronic structure,IR spectrum and other properties of hydrogen interaction between 5-fluorouracil and glycine were studied at the B3LYP/6-31+G* level.Single point energy calculations were executed ... The geometries,electronic structure,IR spectrum and other properties of hydrogen interaction between 5-fluorouracil and glycine were studied at the B3LYP/6-31+G* level.Single point energy calculations were executed at the B3LYP/6-311++G** and B3LYP/aug-cc-pvdz levels,and natural bond orbital (NBO) analysis was carried out at the B3LYP/6-31+G* level.Finally,the hydrogen bonds were discussed via AIM electronic density topology analysis. 展开更多
关键词 B3LYP hydrogen bond 5-FLUOROURACIL GLYCINE electronic density topology analysis
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A Combined Shape and Topology Optimization Based on Isogeometric Boundary Element Method for 3D Acoustics 被引量:2
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作者 Jie Wang Fuhang Jiang +1 位作者 Wenchang Zhao Haibo Chen 《Computer Modeling in Engineering & Sciences》 SCIE EI 2021年第5期645-681,共37页
A combined shape and topology optimization algorithm based on isogeometric boundary element method for 3D acoustics is developed in this study.The key treatment involves using adjoint variable method in shape sensitiv... A combined shape and topology optimization algorithm based on isogeometric boundary element method for 3D acoustics is developed in this study.The key treatment involves using adjoint variable method in shape sensitivity analysis with respect to non-uniform rational basis splines control points,and in topology sensitivity analysis with respect to the artificial densities of sound absorption material.OpenMP tool in Fortran code is adopted to improve the efficiency of analysis.To consider the features and efficiencies of the two types of optimization methods,this study adopts a combined iteration scheme for the optimization process to investigate the simultaneous change of geometry shape and distribution of material to achieve better noise control.Numerical examples,such as sound barrier,simple tank,and BeTSSi submarine,are performed to validate the advantage of combined optimization in noise reduction,and to demonstrate the potential of the proposed method for engineering problems. 展开更多
关键词 Combined shape and topology optimization isogeometric boundary element method shape sensitivity analysis topology sensitivity analysis adjoint variable method sound absorption material
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A Method for the Configuration Design of a Space Truss Deployable Mechanism and Its Application 被引量:1
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作者 LI Bo 《International Journal of Plant Engineering and Management》 2010年第4期236-241,共6页
A method based on the metamorphic principle is proposed for the analysis of the configuration design of a space truss deployable mechanism. The configuration change and correspondent topological graphs and adjacency m... A method based on the metamorphic principle is proposed for the analysis of the configuration design of a space truss deployable mechanism. The configuration change and correspondent topological graphs and adjacency matrixes at different work-stage of the mechanism, which is helpful to completely understand the composition and change rules of the metamorphic mechanism, are analyzed to indicate the metamorphic relationship in one working cycle. Furthermore, the static distance matrix, dynamic distance matrix and stiffness matrix of the mechanism are derived to assess the ability of the designed configuration to reveal some of the topological characteristics like compactness, dynamic sensitivity and stiffness. Using this proposed method in a space truss deployable mechanism helps the designer to evaluate its performance at the conceptual stage of design and make a rapid, reasonable selection for configuration design, which provides means for processing its type of analysis by computer. 展开更多
关键词 space truss deployable mechanism metamorphic mechanism configuration change topology analysis
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A Weibo local network growth model constructed from the perspective of following-followed
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作者 Fu-Zhong Nian Ran-Qing Yao 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第12期497-504,共8页
In order to explore the evolution process of the Weibo local network,this study first defines four factors influencing the evolution of the Weibo network.On this basis,the BA scale-free network model was enhanced by i... In order to explore the evolution process of the Weibo local network,this study first defines four factors influencing the evolution of the Weibo network.On this basis,the BA scale-free network model was enhanced by incorporating these four factors and accounting for directionality,resulting in a Weibo local network evolution model based on user attributes and behavioral similarity.The model's validity was validated by comparing simulation results with real data.The findings indicate that the Weibo local network exhibits both small-world characteristics and distinctive features.The results show that the Weibo local network exhibits both small-world characteristics and distinctive properties.The in-degree distribution follows a mixed pattern of exponential and power-law distributions,the degree-degree shows isomatching,and both the in-degree centrality and eigenvector centrality values are relatively low.This research contributes to our understanding of user behaviour in the Weibo network,and provides a structural basis for exploring the impact of Weibo network structure on information dissemination. 展开更多
关键词 Weibo network user similarity attribute characteristics network evolution topology analysis
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Study on the Intramolecular Hydrogen Bonds of Dibenzofurans, Xanthones and Anthraquinones with One or Two Positions Substituted by Hydroxyls
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作者 仇静 石佳奇 陈国松 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2013年第2期185-192,共8页
The thermodynamic properties of dibenzofurans (DFs), xanthones (XTs) and an-thraquinones (AQs) with one and two positions substituted with hydroxyls in the ideal gas state at 298.15 K and 1.013×10^5 pa were... The thermodynamic properties of dibenzofurans (DFs), xanthones (XTs) and an-thraquinones (AQs) with one and two positions substituted with hydroxyls in the ideal gas state at 298.15 K and 1.013×10^5 pa were calculated at the B3LYP/6-311G^* level using Gaussian 03 program. The isodesmic reactions were designed to calculate the standard free energy of formation (△fG^θ). Three types of hydrogen bonds exist in the three kinds of chemicals and their bond energies were ascertained as 7-15, 15-23 and 49-58 kJ·mo1^-1 respectively by comparing the △fG^θ values. Electronic density topology analysis was applied to validate the strength of bond. 展开更多
关键词 DIBENZOFURAN xanthones and anthraquinones hydroxyl substituent intramolecular hydrogen bond density functional theory electronic density topology analysis
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Topological Data Analysis of Potentiometric Multisensor Measurements in Treated Wastewater
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作者 Valeria Belikova Vitaly Panchuk +3 位作者 Evgeny Legin Anastasia Melenteva Andrey Legin Dmitry Kirsanov 《Journal of Analysis and Testing》 EI 2018年第4期291-298,共8页
In this study,a multisensor system consisting of 23 potentiometric sensors was applied for long-term online measurements in outlet flow of the water treatment plant.Within 1 month of continuous measurements,the data s... In this study,a multisensor system consisting of 23 potentiometric sensors was applied for long-term online measurements in outlet flow of the water treatment plant.Within 1 month of continuous measurements,the data set of more than 295,000 observations was acquired.The processing of this dataset with conventional chemometric tools was cumbersome and not very informative.Topological data analysis(TDA)was recently suggested in chemometric literature to deal with large spectroscopic datasets.In this research,we explore the opportunities of TDA with respect to multisensor data with only 23 variables.It is shown that TDA allows for convenient data visualization,studying the evolution of water quality during the measurements and tracking the periodical structure in the data related to the water quality depending on the time of the day and the day of the week.TDA appears to be a valuable tool for multisensor data exploration. 展开更多
关键词 topological data analysis Multisensor systems Potentiometric sensors Water quality
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Plant multiscale networks:charting plant connectivity by multi-level analysis and imaging techniques 被引量:6
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作者 Xi Zhang Yi Man +21 位作者 Xiaohong Zhuang Jinbo Shen Yi Zhang Yaning Cui Meng Yu Jingjing Xing Guangchao Wang Na Lian Zijian Hu Lingyu Ma Weiwei Shen Shunyao Yang Huimin Xu Jiahui Bian Yanping Jing Xiaojuan Li Ruili Li Tonglin Mao Yuling Jiao Sodmergen Haiyun Ren Jinxing Lin 《Science China(Life Sciences)》 SCIE CAS CSCD 2021年第9期1392-1422,共31页
In multicellular and even single-celled organisms,individual components are interconnected at multiscale levels to produce enormously complex biological networks that help these systems maintain homeostasis for develo... In multicellular and even single-celled organisms,individual components are interconnected at multiscale levels to produce enormously complex biological networks that help these systems maintain homeostasis for development and environmental adaptation.Systems biology studies initially adopted network analysis to explore how relationships between individual components give rise to complex biological processes.Network analysis has been applied to dissect the complex connectivity of mammalian brains across different scales in time and space in The Human Brain Project.In plant science,network analysis has similarly been applied to study the connectivity of plant components at the molecular,subcellular,cellular,organic,and organism levels.Analysis of these multiscale networks contributes to our understanding of how genotype determines phenotype.In this review,we summarized the theoretical framework of plant multiscale networks and introduced studies investigating plant networks by various experimental and computational modalities.We next discussed the currently available analytic methodologies and multi-level imaging techniques used to map multiscale networks in plants.Finally,we highlighted some of the technical challenges and key questions remaining to be addressed in this emerging field. 展开更多
关键词 multiscale network connectivity CYTOSKELETON membrane contact site organelle interaction MULTICELLULARITY CONNECTOME CYTOARCHITECTURE topological analysis multi-level imaging techniques
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