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波粒二象性 3

粒子群优化 3

烟颗粒 2

粒子群优化算法 2

Fe、Co、Ru 碳化物 1

Hilare 机器人 1

Pickering乳液 1

SPH 1

二维纳米颗粒 1

二维非线性动力学 1

代表性体积元 1

优化调度 1

信息素 1

充电模式；充电时长；随机森林；长短期记忆网络（LSTM）；简化粒子群优化算法（SPSO） 1

光催化 1

光子 1

光波 1

光量子 1

全比尺模型试验 1

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Morphologies of diblock copolymer confined in a slit with patterned surfaces studied by dissipative particle

FENG Jian, HUANG Yongmin, LIU Honglai, HU Ying

《化学科学与工程前沿（英文）》 2007年第1卷第2期页码 132-139 doi: 10.1007/s11705-007-0025-5

摘要： Diblock copolymers with ordered mesophase structures have been used as templates for nano-fabrication. Unfortunately, the ordered structure only exists at micrometer-scale areas, which precludes its use in many advanced applications. To overcome this disadvantage, the diblock copolymer confined in a restricted system with a patterned surface is proved to be an effective means to prohibit the formation of defects and obtain perfect ordered domains. In this work, the morphologies of a thin film of diblock copolymer confined between patterned and neutral surfaces were studied by dissipative particle dynamics. It is shown that the morphology of the symmetric diblock copolymer is affected by the ratio of the pattern period on the surface to the lamellar period of the symmetric diblock copolymer and by the repulsion parameters between blocks and wall particles. To eliminate the defects in the lamellar phase, the pattern period on the surface must match the lamellar period. The difference in the interface energy of different compartments of the pattern should increase with increasing film thickness. The pattern period on the surface has a scaling relationship with the chain length, which is the same as that between the lamellar period and the chain length. The lamellar period is also affected by the polydispersity of the symmetric diblock copolymer. The total period is the average of the period of each component multiplied by the weight of its volume ratio. The morphologies of asymmetric diblock copolymers are also affected by the pattern on the surface, especially when the matching period of the asymmetric diblock copolymer is equal to the pattern period, which is approximately equal to the lamellar period of a symmetric diblock copolymer with the same chain length.

关键词： weight nano-fabrication morphology matching dissipative particle

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Many-body dissipative particle dynamics simulation of wetting phenomena

Ying ZHAO, Ye YUE, Xianren ZHANG, Shuangyang LI, Atul SAJJANHAR,

《化学科学与工程前沿（英文）》 2010年第4卷第3期页码 280-282 doi: 10.1007/s11705-009-0278-2

摘要： With the development of the simulation of particle dynamics, the traditional dissipative particle dynamics (DPD) method can not satisfy the needs of research in static or dynamic wetting phenomena. However, the Many-body DPD approach extends the ability of the traditional method to simulate the interface between solid and liquid or some other situation. In this paper, we propose a Many-body DPD program to simulate the solid-liquid interface and get satisfactory results.

关键词： development satisfactory traditional dissipative phenomena solid-liquid interface

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耗散陀螺系统的李雅普诺夫函数构造：剩余能量函数方法 Personal View

Cem CİVELEK, Özge CİHANBEĞENDİ

《信息与电子工程前沿（英文）》 2020年第21卷第4期页码 629-634 doi: 10.1631/FITEE.1900014

摘要：在自由度为4、张量有逆变（右上标）和协变（右下标）形式的耗散陀螺系统中，使用二阶线性微分方程建立拉格朗日耗散模型，即{L, D}模型。通过系统的{L, D}模型确定广义元素。满足勒让德变换先决条件时，可得哈密顿量。剩余能量函数（REF）由哈密顿量及损耗或耗散能量（为负）之和组成，将其作为李雅普诺夫函数，可通过李雅普诺夫第二方法作稳定性分析，并从数学上推导出稳定性条件。

关键词：李雅普诺夫函数；剩余能量函数；耗散陀螺系统稳定性

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我国农村自然村落的未来发展——基于耗散结构理论的分析

单明,刘彦青,马荣江,聂亚洲,丁星利,赖泽民,杨旭东

《中国工程科学》 2021年第23卷第1期页码 141-148 doi: 10.15302/J-SSCAE-2021.01.003

摘要：

近些年随着中国城镇化进程的推进，以及经济的发展和产业结构的调整等，农村常住人口数量逐年减少，并日益趋向老龄化，越来越多的自然村落逐渐衰落甚至消亡。本文在分析了全国农村自然村落整体状况的基础上，选择山东某典型村落为实际对象进行了实地调研，详细分析了农宅闲置情况、人口分布状况等，由此总结出自然村落走向衰落的具体表现。结合耗散结构理论分析了其中的深层次原因，指出应从常规村落的开放激活、特色村落的深化保护和衰败村落的有机整合三个方面来构建出新的耗散结构，并提出通过加强已更新村落的内部管理来提升新系统的凝聚力和自组织能力的发展建议。

关键词：自然村落，农村空心化，耗散结构理论，乡村发展

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Catalyst particle shapes and pore structure engineering for hydrodesulfurization and hydrodenitrogenation

《化学科学与工程前沿（英文）》 2022年第16卷第6期页码 897-908 doi: 10.1007/s11705-021-2127-x

摘要： Catalyst particle shapes and pore structure engineering are crucial for alleviating internal diffusion limitations in the hydrodesulfurization (HDS)/hydrodenitrogenation (HDN) of gas oil. The effects of catalyst particle shapes (sphere, cylinder, trilobe, and tetralobe) and pore structures (pore diameter and porosity) on HDS/HDN performance at the particle scale are investigated via mathematical modeling. The relationship between particle shape and effectiveness factor is first established, and the specific surface areas of different catalyst particles show a positive correlation with the average HDS/HDN reaction rates. The catalyst particle shapes primarily alter the average HDS/HDN reaction rate to adjust the HDS/HDN effectiveness factor. An optimal average HDS/HDN reaction rate exists as the catalyst pore diameter and porosity increase, and this optimum value indicates a tradeoff between diffusion and reaction. In contrast to catalyst particle shapes, the catalyst pore diameter and the porosity of catalyst particles primarily alter the surface HDS/HDN reaction rate to adjust the HDS/HDN effectiveness factor. This study provides insights into the engineering of catalyst particle shapes and pore structures for improving HDS/HDN catalyst particle efficiency.

关键词： hydrodesulfurization hydrodenitrogenation particle shape pore structure

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A novel light fluctuation spectrum method for in-line particle sizing

Shouxuan QIN, Xiaoshu CAI, Li MA

《能源前沿（英文）》 2012年第6卷第1期页码 89-97 doi: 10.1007/s11708-012-0176-z

摘要： This paper discusses two problems in in-line particle sizing when using light fluctuation method. First, by retrieving the ratio of particle concentrations at different time, the intensity of incident light is obtained. There exists narrow error between the calculated and pre-detected value of the intensity of incident light. Secondly, by combining spectrum analysis with Gregory’s theory, a multi-sub-size zone model is proposed, with which the relationship between the distribution of turbidity and the particle size distribution (PSD) can be established, and an algorithm developed to determine the distribution of turbidity. Experiments conducted in the laboratory indicate that the measured size distribution of pulverized coal conforms well with the imaging result.

关键词： in-line measurement particle size distribution (PSD) incident light intensity particle concentration light fluctuation

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Independent cover meshless particle method for complex geotechnical engineering

Jianqiu WU, Yongchang CAI

《结构与土木工程前沿（英文）》 2018年第12卷第4期页码 515-526 doi: 10.1007/s11709-017-0428-4

摘要： A new Independent Cover Meshless Particle (ICMP) method is proposed for the analysis of complex geotechnical engineering. In the ICMP method, the independent rectangular cover regardless of the shape of the analysis model is employed as the influence domain of each discrete node, the general polynomial is employed as the meshless interpolation function of the independent nodal cover, and the Cartesian Transformation Method (CTM) is used for the numerical integration of the nodal covers cut by material interfaces, joints, cracks and faults. The present method has a simple formulation and a low computational cost, and is easy for the numerical analysis and modeling of complex geotechnical engineering. Several typical numerical examples are presented to demonstrate the accuracy and robustness of the proposed method.

关键词： meshless method particle method independent cover CTM geotechnical engineering

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Microdamage study of granite under thermomechanical coupling based on the particle flow code

《结构与土木工程前沿（英文）》页码 1413-1427 doi: 10.1007/s11709-023-0953-2

摘要： The thermomechanical coupling of rocks refers to the interaction between the mechanical and thermodynamic behaviors of rocks induced by temperature changes. The study of this coupling interaction is essential for understanding the mechanical and thermodynamic properties of the surrounding rocks in underground engineering. In this study, an improved temperature-dependent linear parallel bond model is introduced under the framework of a particle flow simulation. A series of numerical thermomechanical coupling tests are then conducted to calibrate the micro-parameters of the proposed model by considering the mechanical behavior of the rock under different thermomechanical loadings. Good agreement between the numerical results and experimental data are obtained, particularly in terms of the compression, tension, and elastic responses of granite. With this improved model, the thermodynamic response and underlying cracking behavior of a deep-buried tunnel under different thermal loading conditions are investigated and discussed in detail.

关键词： thermomechanical coupling effect granite improved linear parallel bond model thermal property particle flow code

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Study on direct measurement method of vorticity from particle images

RUAN Xiaodong, FU Xin, YANG Huayong

《能源前沿（英文）》 2007年第1卷第4期页码 408-412 doi: 10.1007/s11708-007-0059-1

摘要： To overcome the shortcomings of conventional methods for vorticity measurement, a new direct measurement of vorticity (DMV) method extracting vorticity from particle images was proposed. Based on the theory of fluid flow, two matc

关键词： conventional vorticity measurement particle DMV theory

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Response surface regression analysis on FeCrBSi particle in-flight properties by plasma spray

Runbo MA,Lihong DONG,Haidou WANG,Shuying CHEN,Zhiguo XING

《机械工程前沿（英文）》 2016年第11卷第3期页码 250-257 doi: 10.1007/s11465-016-0401-2

摘要：

This work discusses the interactive effects between every two of argon flow rate, voltage, and spray distance on in-flight particles by plasma spray and constructs models that can be used in predicting and analyzing average velocity and temperature. Results of the response surface methodology show that the interactive effects between voltage and spray distance on particle in-flight properties are significant. For a given argon flow rate, particle velocity and temperature response surface are obviously bending, and a saddle point exists. With an increase in spray distance, the interactive effects between voltage and argon flow rate on particle in-flight properties appear gradually and then weaken. With an increase in voltage, the interactive effects between spray distance and argon flow rate on particle in-flight properties change from appearing to strengthening and then to weakening.

关键词： particle velocity particle temperature interactive effects response surface

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Analysis of molten metal spreading and solidification behaviors utilizing moving particle full-implicit

《能源前沿（英文）》 2021年第15卷第4期页码 959-973 doi: 10.1007/s11708-021-0753-0

摘要： To retrieve the fuel debris in Fukushima Daiichi Nuclear Power Plants (1F), it is essential to infer the fuel debris distribution. In particular, the molten metal spreading behavior is one of the vital phenomena in nuclear severe accidents because it determines the initial condition for further accident scenarios such as molten core concrete interaction (MCCI). In this study, the fundamental molten metal spreading experiments were performed with different outlet diameters and sample amounts to investigate the effect of the outlet for spreading-solidification behavior. In the numerical analysis, the moving particle full-implicit method (MPFI), which is one of the particle methods, was applied to simulate the spreading experiments. In the MPFI framework, the melting-solidification model including heat transfer, radiation heat loss, phase change, and solid fraction-dependent viscosity was developed and implemented. In addition, the difference in the spreading and solidification behavior due to the outlet diameters was reproduced in the calculation. The simulation results reveal the detailed solidification procedure during the molten metal spreading. It is found that the viscosity change and the solid fraction change during the spreading are key factors for the free surface condition and solidified materials. Overall, it is suggested that the MPFI method has the potential to simulate the actual nuclear melt-down phenomena in the future.

关键词： molten metal spreading solidification particle method severe accident fuel debris decommissioning

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Particle size distribution and shape control of Au nanoparticles used for particle gun

S. Kida, M. Ichiji, J. Watanabe, I. Hirasawa

《化学科学与工程前沿（英文）》 2013年第7卷第1期页码 60-64 doi: 10.1007/s11705-013-1313-x

摘要： Au nanoparticles are expected for the media to transfer genes into plants. However, the control of particle size distribution (PSD) and shape of Au nanoparticles is too difficult to design and prepare particles with suitable quality for the gene supporting media. Reduction crystallization experiments were performed in aqueous solution in order to clarify the effect of feeding conditions such as feeding profile, feeding rate, and feeding amount on PSD and shape of Au nanoparticles. Ascorbic acid (AsA) was selected as a reducing agent because it is safe for plants. Au particles of 50 nm, 50–200 nm, and 150–400 nm were obtained in batch operation, single-jet, and double-jet, respectively. Moreover, in single-jet and double-jet, the mean size of the obtained Au particles increases with the decrease of feeding rate or the increase of feeding amount. It is concluded that PSD of Au nanoparticles can be controlled in the range of 50–400 nm by changing feeding conditions of AsA and HAuCl aqueous solution.

关键词： reduction crystallization particle size distribution gene transferring media

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Effect of adjusted mesoscale drag model on flue gas desulfurization in powder-particle spouted beds

《化学科学与工程前沿（英文）》 2022年第16卷第6期页码 909-920 doi: 10.1007/s11705-021-2100-8

摘要： An energy minimum multiscale model was adjusted to simulate the mesoscale structure of the flue gas desulfurization process in a powder-particle spouted bed and verified experimentally. The obtained results revealed that the spout morphology simulated by the adjusted mesoscale drag model was unstable and discontinuous bubbling spout unlike the stable continuous spout obtained using the Gidaspow model. In addition, more thorough gas radial mixing was achieved using the adjusted mesoscale drag model. The mass fraction of water in the gas mixture at the outlet determined by the heterogeneous drag model was 1.5 times higher than that obtained by the homogeneous drag model during the simulation of water vaporization. For the desulfurization reaction, the experimental desulfurization efficiency was 75.03%, while the desulfurization efficiencies obtained by the Gidaspow and adjusted mesoscale drag models were 47.63% and 75.08%, respectively, indicating much higher accuracy of the latter technique.

关键词： adjusted mesoscale drag model particle image velocimetry water vaporization desulfurization reaction numerical simulation

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Effect of particle size on coal char----NO reaction

Xiumin JIANG, Xiangyong HUANG, Jiaxun LIU, Chaoqun ZHANG

《能源前沿（英文）》 2011年第5卷第2期页码 221-228 doi: 10.1007/s11708-011-0146-x

摘要： Surface nitrogen complex formation upon reaction of coal char with NO at 600°C was studied by X-ray photoelectron spectroscopy. Particle size had a noticeable effect on the magnitude of changes, which was observed on the surface of the coal char in the nitrogen functional group. The surface increased its -NO, pyridine-N-oxide, and -NO functional group contents with a decrease in particle size. The chemisorption processes of NO molecules on the char were simulated using the ab initio Hartree–Fock method and density functional theory. Molecular modeling was applied to determine the thermodynamics of the reactions. Mechanisms were proposed to explain the formation of the -NO, pyridine-N-oxide, and -NO functional groups at 600°C.

关键词： NO reduction chemisorption particle size X-ray photoelectron spectroscopy density functional theory (DFT)

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Crack detection of the cantilever beam using new triple hybrid algorithms based on Particle Swarm Optimization

Amin GHANNADIASL; Saeedeh GHAEMIFARD

《结构与土木工程前沿（英文）》 2022年第16卷第9期页码 1127-1140 doi: 10.1007/s11709-022-0838-9

摘要： The presence of cracks in a concrete structure reduces its performance and increases in the size of cracks result in the failure of the structure. Therefore, the accurate determination of crack characteristics, such as location and depth, is one of the key engineering issues for assessment of the reliability of structures. This paper deals with the inverse analysis of the crack detection problems using triple hybrid algorithms based on Particle Swarm Optimization (PSO); these hybrids are Particle Swarm Optimization-Genetic Algorithm-Firefly Algorithm (PSO-GA-FA), Particle Swarm Optimization-Grey Wolf Optimization-Firefly Algorithm (PSO-GWO-FA), and Particle Swarm Optimization-Genetic Algorithm-Grey Wolf Optimization (PSO-GA-GWO). A strong correlation exists between the changes in the natural frequency of a concrete beam and the crack parameters. Thus, the location and depth of a crack in a beam can be predicted by measuring its natural frequency. Hence, the measured natural frequency can be used as the input parameter of the algorithm. In this paper, this is applied to identify crack location and depth in a cantilever beam using the new hybrid algorithms. The results show that among the proposed triple hybrid algorithms, the PSO-GA-FA and PSO-GWO-FA algorithms are much more effective than PSO-GA-GWO algorithm for the crack detection.

关键词： crack cantilever beam triple hybrid algorithms Particle Swarm Optimization