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Electronic Structure Effect on Model Cluster for L1_2 Structure of Al_3Ti Intermetallic Compound with an Addition of Alloying Elements Fe, Ni and Cu
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作者 Senying LIU Rongze HU Dongliang ZHAO and Chongyu WANG(Central Iron and Steel Research Institute, Beijing, 100081, China)(To whom correspondence should be addressed)Ping LUO(National Research Cent or Certified Materials, Beijing, 100013, China)Zhongjie P 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 1995年第5期369-372,共4页
By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L... By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L12 Al3Ti-base intermetallic compound. The results are presented using the density of states (DOS) and one-electron properties, such as relative binding tendency between the atom and the model cluster, and hybrid bonding tendency between the alloying element and the host atoms. By comparing the four models of Ti4Al14X cluster, the effect of the Fe, Ni or Cu atom on the physical properties of Al3Ti-based L12 intermetallic compounds is analyzed. The results indicate that the addition of the Fe, Ni or Cu atom intensifies the relative binding tendency between Ti atom and Ti4Al14X cluster. It was found that the Fermi level (EF) lies in a maximum in the DOS for Ti4Al14Al cluster; on the contrary, the EF comes near a minimum tn the DOS for Ti4Al14X (X=Fe, Ni and Cu) cluster. Thus the L12 crystal structure for binary Al3Ti alloy is unstable, and the addition of the Fe, Ni or Cu atom to Al3Ti is benefical to stabilize L12 crystal structure. The calculation also shows that the Fe, Ni or Cu atom strengthens the hybrid bonding tendency between the central atom and the host atoms for Ti4Al14X cluster and thereby may lead to the constriction of the lattice of Al3Ti-base intermetallic compounds. 展开更多
关键词 FE Electronic Structure Effect on model cluster for L12 Structure of Al3Ti Intermetallic Compound with an Addition of Alloying Elements Fe Al Ti Cu
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User Model Clustering
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作者 Loc Nguyen 《Journal of Data Analysis and Information Processing》 2014年第2期41-48,共8页
User model which is the representation of information about user is the heart of adaptive systems. It helps adaptive systems to perform adaptation tasks. There are two kinds of adaptations: 1) Individual adaptation re... User model which is the representation of information about user is the heart of adaptive systems. It helps adaptive systems to perform adaptation tasks. There are two kinds of adaptations: 1) Individual adaptation regarding to each user;2) Group adaptation focusing on group of users. To support group adaptation, the basic problem which needs to be solved is how to create user groups. This relates to clustering techniques so as to cluster user models because a group is considered as a cluster of similar user models. In this paper we discuss two clustering algorithms: k-means and k-medoids and also propose dissimilarity measures and similarity measures which are applied into different structures (forms) of user models like vector, overlay, and Bayesian network. 展开更多
关键词 USER model cluster
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Optimizing basis wave functions in the generator coordinate method for microscopic cluster models (Ⅰ)
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作者 Yi‑Fan Liu Bo Zhou Yu‑Gang Ma 《Nuclear Science and Techniques》 2025年第10期183-191,共9页
We employed random distributions and gradient descent methods for the Generator Coordinate Method(GCM)to identify effective basis wave functions,taking halo nuclei ^(6)He and ^(6)Li as examples.By comparing the ground... We employed random distributions and gradient descent methods for the Generator Coordinate Method(GCM)to identify effective basis wave functions,taking halo nuclei ^(6)He and ^(6)Li as examples.By comparing the ground state(0^(+))energy of ^(6)He and the excited state(0^(+))energy of 6 Li calculated with various random distributions and manually selected generation coordinates,we found that the heavy tail characteristic of the logistic distribution better describes the features of the halo nuclei.Subsequently,the Adam algorithm from machine learning was applied to optimize the basis wave functions,indicating that a limited number of basis wave functions can approximate the converged values.These results offer some empirical insights for selecting basis wave functions and contribute to the broader application of machine learning methods in predicting effective basis wave functions. 展开更多
关键词 Generator Coordinate Method Effective basis wave functions Nuclear cluster model Machine learning Halo nuclei
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Symplectic symmetry approach to clustering in atomic nuclei:the case of ^(24)Mg
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作者 H G Ganev 《Communications in Theoretical Physics》 2025年第5期118-130,共13页
Symplectic symmetry approach to clustering(SSAC)in atomic nuclei,recently proposed,is modified and further developed in more detail.It is firstly applied to the light two-cluster^(20)Ne+αsystem of^(24)Mg,the latter e... Symplectic symmetry approach to clustering(SSAC)in atomic nuclei,recently proposed,is modified and further developed in more detail.It is firstly applied to the light two-cluster^(20)Ne+αsystem of^(24)Mg,the latter exhibiting well developed low-energy K^(π)=0_(1)^(+),k^(π)=2_(1)^(+) and π^(π)=0_(1)^(-) rotational bands in its spectrum.A simple algebraic Hamiltonian,consisting of dynamical symmetry,residual and vertical mixing parts is used to describe these three lowest rotational bands of positive and negative parity in^(24)Mg.A good description of the excitation energies is obtained by considering only the SU(3)cluster states restricted to the stretched many-particle Hilbert subspace,built on the leading Pauli allowed SU(3)multiplet for the positive-and negative-parity states,respectively.The coupling to the higher cluster-model configurations allows us to describe the known low-lying experimentally observed B(E2)transition probabilities within and between the cluster states of the three bands under consideration without the use of an effective charge. 展开更多
关键词 symplectic symmetry approach to clustering algebraic cluster model microscopic cluster model
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Reduced-width amplitude in nuclear cluster physics
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作者 De-Ye Tao Bo Zhou 《Nuclear Science and Techniques》 2025年第4期23-44,共22页
As a cluster overlap amplitude,the reduced-width amplitude is an important physical quantity for analyzing clustering in the nucleus depending on specified channels and has been calculated and widely applied in nuclea... As a cluster overlap amplitude,the reduced-width amplitude is an important physical quantity for analyzing clustering in the nucleus depending on specified channels and has been calculated and widely applied in nuclear cluster physics.In this review,we briefly revisit the theoretical framework for calculating the reduced-width amplitude,as well as the outlines of cluster models to obtain microscopic or semi-microscopic cluster wave functions.We also introduce the recent progress related to cluster overlap amplitudes,including the implementation of cross-section estimation and extension to three-body clustering analysis.Comprehensive examples are provided to demonstrate the application of the reduced-width amplitude in analyzing clustering structures. 展开更多
关键词 Nuclear clustering Microscopic cluster model Reduced-width amplitude
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Enhancing BERTopic with Pre-Clustered Knowledge: Reducing Feature Sparsity in Short Text Topic Modeling
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作者 Qian Wang Biao Ma 《Journal of Data Analysis and Information Processing》 2024年第4期597-611,共15页
Modeling topics in short texts presents significant challenges due to feature sparsity, particularly when analyzing content generated by large-scale online users. This sparsity can substantially impair semantic captur... Modeling topics in short texts presents significant challenges due to feature sparsity, particularly when analyzing content generated by large-scale online users. This sparsity can substantially impair semantic capture accuracy. We propose a novel approach that incorporates pre-clustered knowledge into the BERTopic model while reducing the l2 norm for low-frequency words. Our method effectively mitigates feature sparsity during cluster mapping. Empirical evaluation on the StackOverflow dataset demonstrates that our approach outperforms baseline models, achieving superior Macro-F1 scores. These results validate the effectiveness of our proposed feature sparsity reduction technique for short-text topic modeling. 展开更多
关键词 Topic model BERTopic Short Text Feature Sparsity cluster
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Macro and micro mechanics behavior of granite after heat treatment by cluster model in particle flow code 被引量:8
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作者 Wen-Ling Tian Sheng-Qi Yang Yan-Hua Huang 《Acta Mechanica Sinica》 SCIE EI CAS CSCD 2018年第1期175-186,共12页
In this paper, a cluster model in particle flow code was used to simulate granite specimens after heat treatment under uniaxial compression. The results demonstrated that micro-cracks are randomly distributed in the s... In this paper, a cluster model in particle flow code was used to simulate granite specimens after heat treatment under uniaxial compression. The results demonstrated that micro-cracks are randomly distributed in the specimen when the temperature is below 300?C, and have partial coalescence when the temperature is up to 450?C, then form macro-cracks when the temperature is above 600?C. There is more inter-granular cracking than intra-granular cracking, and their ratio increases with increasing temperature.The micro-cracks are almost constant when the temperature decreases from 900?C to room temperature, except for quartz α–β phase transition temperature(573?C). The fracture evolution process is obviously affected by these cracks, especially at 600–900?C. Elevated temperature leads to easily developed displacement between the grains, and the capacity to store strain energy becomes weaker, corresponding to the plasticity of granite after heat treatment. 展开更多
关键词 cluster model GRANITE Thermal damage MICRO-CRACK Energy
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Load Cluster Characteristic and Modeling of EV Charge Station in Residential District 被引量:23
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作者 ZHENG Jinghong DAI Mengting ZHANG Man WANG Wenzhuo ZHUShouzhen 《中国电机工程学报》 EI CSCD 北大核心 2012年第22期I0005-I0005,21,共1页
电动汽车的大规模发展将会对配电网带来较大影响,开展电动汽车充电的负荷特性研究是保证电网安全运行的前提,是引导电动汽车进行有序充电的基础。在简化锂电池恒流–恒压2阶段充电模型的基础上,得到单个电动汽车的充电模型,以此为基本元... 电动汽车的大规模发展将会对配电网带来较大影响,开展电动汽车充电的负荷特性研究是保证电网安全运行的前提,是引导电动汽车进行有序充电的基础。在简化锂电池恒流–恒压2阶段充电模型的基础上,得到单个电动汽车的充电模型,以此为基本元素,从充电汽车电池的初始荷电状态(initial state-of-charge,SOC0)和车辆到达充电站时间的随机分布为出发点,提出2阶段泊松分布的电动汽车充电站集聚模型进行充电站集聚特性的模拟,并提出基于充电站的日充电负荷曲线的电动汽车充电站负荷集聚模型的建模方法,最后通过仿真算例验证了其有效性。 展开更多
关键词 电动汽车 住宅小区 充电特性 充电站 建模 集群 负载 智能调度
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Theoretical study of NO adsorbed on the surface of TiO2(110) cluster model 被引量:4
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作者 汪洋 YANAGISAWAYasunori 《Journal of Zhejiang University Science》 EI CSCD 2004年第8期932-935,共4页
The chemisorption properties of N^18O adsorption on TiO2(110) surface were investigated by experimental and theoretical methods. The results of temperature programmed desorption (TPD) indicated that the temperatures o... The chemisorption properties of N^18O adsorption on TiO2(110) surface were investigated by experimental and theoretical methods. The results of temperature programmed desorption (TPD) indicated that the temperatures of the three desorption peaks of the main N2 molecules were at (low) temperature of 230 K, 450 K, and (high) temperature of 980 K. This meant that N^18O decomposed and recombined during the process of N2 desorption after N^18O was exposed. Analysis of thestable combination and orbital theory calculation of the surface reaction of NO adsorption on the TiO2(110) cluster modelshowed that there was clear preference for the Ti-NO orientation. 展开更多
关键词 ADSORPTION TPD cluster model Molecular orbital theory calculation
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Cluster modeling of the short-range correlation of acoustically emitted scattering signals 被引量:2
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作者 Dongjie Xue Lele Lu +2 位作者 Jie Zhou Lan Lu Yintong Liu 《International Journal of Coal Science & Technology》 EI CAS CSCD 2021年第4期575-589,共15页
As a widely used measurement technique in rock mechanics,spatial correlation modeling of acoustic emission(AE)scattering signals is attracting increasing focus for describing mechanical behavior quantitatively.Unlike ... As a widely used measurement technique in rock mechanics,spatial correlation modeling of acoustic emission(AE)scattering signals is attracting increasing focus for describing mechanical behavior quantitatively.Unlike the statistical description of the spatial distribution of randomly generated AE signals,spatial correlation modeling is based mainly on short-range correlation considering the interrelationship of adjacent signals.As a new idea from percolation models,the covering strategy is used to build the most representative cube cluster,which corresponds to the critical scale at peak stress.Its modeling process of critical cube cluster depends strongly on the full connection of the main fracture network,and the corresponding cube for coverage is termed the critical cube.The criticality pertains to not only the transition of local-to-whole connection of the fracture network but also the increasing-to-decreasing transition of the deviatoric stress with an obvious stress drop in the brittle failure of granite.Determining a reasonable critical cube guarantees the best observation scale for investigating the failure process.Besides,the topological connection induces the geometric criticality of three descriptors,namely anisotropy,pore fraction,and specific surface area,which are evaluated separately and effectively.The results show that cluster modeling based on the critical cube is effective and has criticality in both topology and geometry,as well as the triaxial behavior.Furthermore,the critical cube length presents a high confidence probability of being correlated to the mineral particle size.Besides,its pore fraction of cube cluster is influenced strongly by the critical cube length and confining pressure. 展开更多
关键词 Acoustic emission Spatial correlation modeling Cover strategy CRITICALITY Critical cube cluster modeling
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Projection pursuit cluster model and its application in water quality assessment 被引量:20
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作者 WANGShun-jiu YANGZhi-feng DINGJing 《Journal of Environmental Sciences》 SCIE EI CAS CSCD 2004年第6期994-995,共2页
One of the difficulties frequently encountered in water quality assessment is that there are many factors and they cannot be assessed according to one factor, all the effect factors associated with water quality must ... One of the difficulties frequently encountered in water quality assessment is that there are many factors and they cannot be assessed according to one factor, all the effect factors associated with water quality must be used. In order to overcome this issues the projection pursuit principle is introduced into water quality assessment, and projection pursuit cluster(PPC) model is developed in this study. The PPC model makes the transition from high dimension to one-dimension. In other words, based on the PPC model, multifactor problem can be converted to one factor problem. The application of PPC model can be divided into four parts: (1) to estimate projection index function Q(); (2) to find the right projection direction ; (3) to calculate projection characteristic value of the i th sample z-i, and (4) to draw comprehensive analysis on the basis of z-i. On the other hand, the empirical formula of cutoff radius R is developed, which is benefit for the model to be used in practice. Finally, a case study of water quality assessment is proposed in this paper. The results showed that the PPC model is reasonable, and it is more objective and less subjective in water quality assessment. It is a new method for multivariate problem comprehensive analysis. 展开更多
关键词 projection pursuit cluster model water quality assessment
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Adding-Point Strategy for Reduced-Order Hypersonic Aerothermodynamics Modeling Based on Fuzzy Clustering 被引量:8
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作者 CHEN Xin LIU Li +1 位作者 ZHOU Sida YUE Zhenjiang 《Chinese Journal of Mechanical Engineering》 SCIE EI CAS CSCD 2016年第5期983-991,共9页
Reduced order models(ROMs) based on the snapshots on the CFD high-fidelity simulations have been paid great attention recently due to their capability of capturing the features of the complex geometries and flow confi... Reduced order models(ROMs) based on the snapshots on the CFD high-fidelity simulations have been paid great attention recently due to their capability of capturing the features of the complex geometries and flow configurations. To improve the efficiency and precision of the ROMs, it is indispensable to add extra sampling points to the initial snapshots, since the number of sampling points to achieve an adequately accurate ROM is generally unknown in prior, but a large number of initial sampling points reduces the parsimony of the ROMs. A fuzzy-clustering-based adding-point strategy is proposed and the fuzzy clustering acts an indicator of the region in which the precision of ROMs is relatively low. The proposed method is applied to construct the ROMs for the benchmark mathematical examples and a numerical example of hypersonic aerothermodynamics prediction for a typical control surface. The proposed method can achieve a 34.5% improvement on the efficiency than the estimated mean squared error prediction algorithm and shows same-level prediction accuracy. 展开更多
关键词 reduced order model fuzzy clustering hypersonic aerothermodynamics adding-point strategy
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基于Blending-Clustering集成学习的大坝变形预测模型 被引量:1
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作者 冯子强 李登华 丁勇 《水利水电技术(中英文)》 北大核心 2024年第4期59-70,共12页
【目的】变形是反映大坝结构性态最直观的效应量,构建科学合理的变形预测模型是保障大坝安全健康运行的重要手段。针对传统大坝变形预测模型预测精度低、误报率高等问题导致的错误报警现象,【方法】选取不同预测模型和聚类算法集成,构... 【目的】变形是反映大坝结构性态最直观的效应量,构建科学合理的变形预测模型是保障大坝安全健康运行的重要手段。针对传统大坝变形预测模型预测精度低、误报率高等问题导致的错误报警现象,【方法】选取不同预测模型和聚类算法集成,构建了一种Blending-Clustering集成学习的大坝变形预测模型,该模型以Blending对单一预测模型集成提升预测精度为核心,并通过Clustering聚类优选预测值改善模型稳定性。以新疆某面板堆石坝变形监测数据为实例分析,通过多模型预测性能比较,对所提出模型的预测精度和稳定性进行全面评估。【结果】结果显示:Blending-Clustering模型将预测模型和聚类算法集成,均方根误差(RMSE)和归一化平均百分比误差(nMAPE)明显降低,模型的预测精度得到显著提高;回归相关系数(R~2)得到提升,模型具备更强的拟合能力;在面板堆石坝上22个测点变形数据集上的预测评价指标波动范围更小,模型的泛化性和稳定性得到有效增强。【结论】结果表明:Blending-Clustering集成预测模型对于预测精度、泛化性和稳定性均有明显提升,在实际工程具有一定的应用价值。 展开更多
关键词 大坝 变形 预测模型 Blending集成 clustering集成 模型融合
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The Accumulation of He on a W Surface During keV-He Irradiation:Cluster Dynamics Modeling 被引量:1
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作者 李永钢 周望怀 +3 位作者 黄良锋 宁荣辉 曾雉 巨新 《Plasma Science and Technology》 SCIE EI CAS CSCD 2012年第7期624-628,共5页
The accumulation of He on a W surface during keV-He ion irradiation has been simulated using cluster dynamics modeling. This is based mainly on rate theory and improved by involving different types of objects, adoptin... The accumulation of He on a W surface during keV-He ion irradiation has been simulated using cluster dynamics modeling. This is based mainly on rate theory and improved by involving different types of objects, adopting up-to-date parameters and complex reaction processes, as well as considering the diffusion process along with depth. These new features make the simulated results compare very well with the experimental ones. The accumulation and diffusion processes are analyzed, and the depth and size dependence of the He concentrations contributed by different types of He clusters is also discussed. The exploration of the trapping and diffusion effects of the He atoms is helpful in understanding the evolution of the damages in the near-surface of plasma-facing materials under He ion irradiation. 展开更多
关键词 cluster dynamics model rate diffusion theory helium in tungsten accumulation and
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Clustered张拉整体结构的动力学建模 被引量:1
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作者 张子宇 王彤 周斌 《振动与冲击》 EI CSCD 北大核心 2024年第16期287-294,共8页
针对clustered张拉整体结构,提出了一种基于任意拉格朗日-欧拉(arbitrary Lagrangian-Eulerian, ALE)法的多体动力学模型。相较于传统的拉格朗日法模型,该研究中的模型具有更为简单的运动学约束。首先,引入了一种ALE时变长度索单元,其... 针对clustered张拉整体结构,提出了一种基于任意拉格朗日-欧拉(arbitrary Lagrangian-Eulerian, ALE)法的多体动力学模型。相较于传统的拉格朗日法模型,该研究中的模型具有更为简单的运动学约束。首先,引入了一种ALE时变长度索单元,其网格节点与物质点可以独立运动,提供了一种自然的方式描述结构中运动的滑轮和滑动绳索;其次,利用达朗贝尔原理,推导了该单元的广义力向量并计算了相应的雅可比矩阵;然后,建立了张拉整体系统的动力学方程,并利用广义α算法对其进行求解,选取节点的全局位置坐标和物质坐标作为广义坐标,其中全局位置坐标可以被不同物体共享,以减少动力学方程的自由度数和消除物体间的约束;最后,展示了一个数值算例,10层可折叠张拉整体塔架,对其折叠过程进行了准静态和动力学仿真,验证了模型的有效性。所提出的模型和算法可为clustered张拉整体结构的设计提供理论指导,具有工程意义。 展开更多
关键词 多体动力学模型 clustered张拉整体 任意拉格朗日-欧拉(ALE) 可展开空间结构
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Mask R-CNN and multifeature clustering model for catenary insulator recognition and defect detection 被引量:8
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作者 Ping TAN Xu-feng LI +5 位作者 Jin DING Zhi-sheng CUI Ji-en MA Yue-lan SUN Bing-qiang HUANG You-tong FANG 《Journal of Zhejiang University-Science A(Applied Physics & Engineering)》 SCIE EI CAS CSCD 2022年第9期745-756,共12页
Rod insulators are vital parts of the catenary of high speed railways(HSRs).There are many different catenary insulators,and the background of the insulator image is complicated.It is difficult to recognise insulators... Rod insulators are vital parts of the catenary of high speed railways(HSRs).There are many different catenary insulators,and the background of the insulator image is complicated.It is difficult to recognise insulators and detect defects automatically.In this paper,we propose a catenary intelligent defect detection algorithm based on Mask region-convolutional neural network(R-CNN)and an image processing model.Vertical projection technology is used to achieve single shed positioning and precise cutting of the insulator.Gradient,texture,and gray feature fusion(GTGFF)and a K-means clustering analysis model(KCAM)are proposed to detect broken insulators,dirt,foreign bodies,and flashover.Using this model,insulator recognition and defect detection can achieve a high recall rate and accuracy,and generalized defect detection.The algorithm is tested and verified on a dataset of realistic insulator images,and the accuracy and reliability of the algorithm satisfy current requirements for HSR catenary automatic inspection and intelligent maintenance. 展开更多
关键词 High speed railway(HSR)catenary insulator Mask region-convolutional neural network(R-CNN) Multifeature fusion K-means clustering analysis model(KCAM) Defect detection
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Parallel Computation of Shallow-water Model on Workstations Cluster 被引量:2
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作者 Song Junqiang Sun An-clang, Li Xiaomei(epartment Of CO,mp’uter Science, Changsha Institute of Technology Hunan 410073, P.R. of China) 《Wuhan University Journal of Natural Sciences》 CAS 1996年第Z1期522-525,共4页
ParallelComputationofShallow-waterModelonWorkstationsClusterSongJunqiang;SunAn-clang,;LiXiaomei(epartmentOfC... ParallelComputationofShallow-waterModelonWorkstationsClusterSongJunqiang;SunAn-clang,;LiXiaomei(epartmentOfCO,mp'uterScience,... 展开更多
关键词 Parallel Computation of Shallow-water model on Workstations cluster
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New Results on PWARX Model Identification Based on Clustering Approach 被引量:1
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作者 Zeineb Lassoued Kamel Abderrahim 《International Journal of Automation and computing》 EI CSCD 2014年第2期180-188,共9页
This paper deals with the problem of piecewise auto regressive systems with exogenous input(PWARX) model identification based on clustering solution. This problem involves both the estimation of the parameters of the ... This paper deals with the problem of piecewise auto regressive systems with exogenous input(PWARX) model identification based on clustering solution. This problem involves both the estimation of the parameters of the affine sub-models and the hyper planes defining the partitions of the state-input regression. The existing identification methods present three main drawbacks which limit its effectiveness. First, most of them may converge to local minima in the case of poor initializations because they are based on the optimization using nonlinear criteria. Second, they use simple and ineffective techniques to remove outliers. Third, most of them assume that the number of sub-models is known a priori. To overcome these drawbacks, we suggest the use of the density-based spatial clustering of applications with noise(DBSCAN) algorithm. The results presented in this paper illustrate the performance of our methods in comparison with the existing approach. An application of the developed approach to an olive oil esterification reactor is also proposed in order to validate the simulation results. 展开更多
关键词 Hybrid systems piecewise autoregressive systems with exogenous input(PWARX) model clusterING identification density-based spatial clustering of applications with noise(DBSCAN) clustering technique experimental validation.
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A numerical model for cloud cavitation based on bubble cluster 被引量:1
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作者 Tezhuan Du Yiwei Wang +1 位作者 Chenguang Huang Lijuan Liao 《Theoretical & Applied Mechanics Letters》 CAS CSCD 2017年第4期231-234,共4页
The cavitation cloud of different internal structures results in different collapse pressures owing to the interaction among bubbles. The internal structure of cloud cavitation is required to accurately predict collap... The cavitation cloud of different internal structures results in different collapse pressures owing to the interaction among bubbles. The internal structure of cloud cavitation is required to accurately predict collapse pressure. A cavitation model was developed through dimensional analysis and direct numerical simulation of collapse of bubble cluster. Bubble number density was included in proposed model to characterize the internal structure of bubble cloud. Implemented on flows over a projectile, the proposed model predicts a higher collapse pressure compared with Singhal model. Results indicate that the collapse pressure of detached cavitation cloud is affected by bubble number density. 展开更多
关键词 Cavitation model Bubble number density Bubble cluster Collapse
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Study on electronic density topology of various cluster models of Mg/Al hydrotalcite by density functional theory
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作者 Renqing Lu Nina Zhang 《Journal of Natural Gas Chemistry》 EI CAS CSCD 2010年第2期179-184,共6页
The geometry and electronic topology properties of Mg/Al hydrotalcite cluster models were comparatively investigated by means of density functional theory at GGA/DND levels.The results suggested that cluster model con... The geometry and electronic topology properties of Mg/Al hydrotalcite cluster models were comparatively investigated by means of density functional theory at GGA/DND levels.The results suggested that cluster model containing seven octahedral cations was the smallest size to be employed to simulate other properties.The fact that the n+ charge of cluster models containing n aluminum atoms can reflect electronic properties of anionic clay layer sheet.The bond lengths of clusters can be modified by terminating with or without OH-/H2O groups in terms of principle of bond order conservation. 展开更多
关键词 HYDROTALCITE density functional theory cluster model Mg/Al
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