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Microphase Separation of Star-diblock Copolymer Films: a Dissipative Particle Dynamics Simulation
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作者 徐毅 冯剑 +3 位作者 陈捷 相明辉 宋新旺 祝仰文 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2010年第6期738-744,746,共8页
The microphase-separating behaviors of two types of star-diblock copolymers (Ax)4(By)4 and (A^Bg)4 in thin films are studied using the simulation technique of dissipative particle dynamics. A variety of ordered ... The microphase-separating behaviors of two types of star-diblock copolymers (Ax)4(By)4 and (A^Bg)4 in thin films are studied using the simulation technique of dissipative particle dynamics. A variety of ordered mesostructures have been observed and the simulated phase diagrams show obvious symmetries for the (Ax)4(By)a films and asymmetries for the (AxBy)4 films, besides, it is easier for the (Ax)4(By)4 than for the (A^By)4 to carry out microphase separation under the same conditions, which has been recognized in bulk and can be ascribed to the structural difference between the two types of star copolymers. There are some correspondences between the mesostructures formed in the film and those formed in bulk at the same composition fraction. Decreasing the thickness of film and strengthening the A-B repulsion both help the mesostructures enhance the degree of order. Composition fraction dependences of the mean-square radius of gyration in the two types of star copolymer films are almost contrary, which can be attributed to the differences in their respective structures. These findings can provide a guide to designing novel microstructures involving star-diblock copolymers via geometrical confinement. 展开更多
关键词 Microphase separation Star-diblock copolymer films Dissipative particle dynamics
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Flow Separation and Vortex Dynamics in Waves Propagating over A Submerged Quartercircular Breakwater 被引量:3
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作者 JIANG Xue-lian YANG Tian +1 位作者 ZOU Qing-ping GU Han-bin 《China Ocean Engineering》 SCIE EI CSCD 2018年第5期514-523,共10页
The interactions of cnoidal waves with a submerged quartercircular breakwater are investigated by a ReynoldsAveraged Navier–Stokes(RANS) flow solver with a Volume of Fluid(VOF) surface capturing scheme(RANSVOF) model... The interactions of cnoidal waves with a submerged quartercircular breakwater are investigated by a ReynoldsAveraged Navier–Stokes(RANS) flow solver with a Volume of Fluid(VOF) surface capturing scheme(RANSVOF) model. The vertical variation of the instantaneous velocity indicates that flow separation occurs at the boundary layer near the breakwater. The temporal evolution of the velocity and vorticity fields demonstrates vortex generation and shedding around the submerged quartercircular breakwater due to the flow separation. An empirical relationship between the vortex intensity and a few hydrodynamic parameters is proposed based on parametric analysis. In addition, the instantaneous and time-averaged vorticity fields reveal a pair of vortices of opposite signs at the breakwater which are expected to have significant effect on sediment entrainment, suspension, and transportation,therefore, scour on the leeside of the breakwater. 展开更多
关键词 submerged quartercircular breakwater cnoidal wave flow separation vortex dynamics SCOUR
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Growth Dynamics of Phase Separation for Two-dimensional Binary Fluid
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作者 袁银权 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2004年第4期37-39,55,共4页
The dynamics of phase separation in two-dimensional binary fluid with low-middle densities was investigated by molecular dynamics simulation. The spinodal decomposition region for symmetric systems may be divided into... The dynamics of phase separation in two-dimensional binary fluid with low-middle densities was investigated by molecular dynamics simulation. The spinodal decomposition region for symmetric systems may be divided into the diffusive and kinematic region. At an elevated temperature, the motion of particles is diffusive. At a middle temperature, the kinematic mechanism takes effect on the systems with middle density, and the diffusive mechanism holds only for the dilute system. At a low temperature, the phase separation obeys the kinematic mechanism in a wide range of density. For asymmetric systems, the growth of particles A (majority) is different from that of particles B (minority). The diffusive and kinematic regions for the majority are similar to those of symmetric system. The growth exponent for the minority is related to its absolute density and temperature because of its small density. 展开更多
关键词 molecular dynamics phase separation binary fluid
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Dynamic scaling behaviour of late-stage phase separation in Ni75AlxV25-x alloys 被引量:5
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作者 李永胜 陈铮 +1 位作者 卢艳丽 徐国栋 《Chinese Physics B》 SCIE EI CAS CSCD 2007年第3期854-861,共8页
The dynamic scaling behaviour of late-stage phase separation and coarsening mechanisms of L12 and D022 in Ni75AlxV25-x (3 ≤ x ≤ 10, at.%) alloys are studied using the microscopic phase-field dynamic model. The mic... The dynamic scaling behaviour of late-stage phase separation and coarsening mechanisms of L12 and D022 in Ni75AlxV25-x (3 ≤ x ≤ 10, at.%) alloys are studied using the microscopic phase-field dynamic model. The microelaso ticity field is incorporated into the diffusion dynamic model. The results show the morphology and coarsening dynamics being greatly changed by the elastic interactions among different precipitates, the particles aligning along the dominant directions, the average domain size (ADS) of L12 and D022 deviating from the exponent of temporal power-law, and the growth slowing down due to the increasing of elastic interactions. The dynamic scaling regime of late-stage coarsening of the precipitates is attained. Thus the scaling behaviour of structure function is also applicable for elastic interaction systems. It is also found that the variations of ADS and scaling function depend on the volume fraction of precipitates. 展开更多
关键词 phase separation dynamic scaling elastic interaction microscopic phase-field simulation
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Analysis for the Deployment of Single-Point Mooring Buoy System Based on Multi-Body Dynamics Method 被引量:5
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作者 常宗瑜 唐原广 +2 位作者 李华军 杨建明 王磊 《China Ocean Engineering》 SCIE EI 2012年第3期495-506,共12页
Deployment of buoy systems is one of the most important procedures for the operation of buoy system. In the present study, a single-point mooring buoy system which contains surface buoy, cable segments with components... Deployment of buoy systems is one of the most important procedures for the operation of buoy system. In the present study, a single-point mooring buoy system which contains surface buoy, cable segments with components, anchor and so on is modeled by applying multi-body dynamics method. The motion equations are developed in discrete node description and fully Cartesian coordinates. Then numerical method is used to solve the ordinary differential equations and dynamics simulations are achieved while anchor is casting from board. The trajectories and velocities of different nodes without current and with current in buoy system are obtained. The transient tension force of each part of the cable is analyzed in the process of deployment. Numerical results indicate that the transient payload increases to a peak value when the anchor is touching the seabed and the maximum tension force will vary with different floating configuration. This work is helpful for design and deployment planning of buoy system. 展开更多
关键词 multi-body dynamics method DEPLOYMENT single-point mooring buoy system fully Cartesian coordinates
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Strain-controlled graphdiyne membrane for CO2/CH4 separation:First-principle and molecular dynamic simulation 被引量:3
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作者 Xin Zheng Shuai Ban +1 位作者 Bei Liu Guangjin Chen 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2020年第7期1898-1903,共6页
Tensile strain of porous membrane materials can broaden their capacity in gas separation.In this work,using van der Waals corrected density functional theory(DFT)and molecular dynamics(MD)simulations,the performance a... Tensile strain of porous membrane materials can broaden their capacity in gas separation.In this work,using van der Waals corrected density functional theory(DFT)and molecular dynamics(MD)simulations,the performance and mechanism of CO2/CH4 separation through strain-oriented graphdiyne(GDY)monolayer were studied by applying lateral strain.It is demonstrated that the CO2 permeance peaks at 1.29×10^6 gas permeation units(GPU)accompanied with CO2/CH4 selectivity of 5.27×10^3 under ultimate strain,both of which are far beyond the Robeson’s limit.Furthermore,the GDY membrane exhibited a decreasing gas diffusion energy barrier and increasing permeance with the increase of applied tensile strain.CO2 molecule tends to reoriented itself vertically to permeate the membrane.Finally,the CO2 permeability decreases with the increase of the temperature from300 K to 500 K due to conserving of rotational freedom,suggesting an abnormal permeance of CO2 in relation to temperature.Our theoretical results suggest that the stretchable GDY monolayer holds great promise to be an excellent candidate for CO2/CH4 separation,owing to its extremely high selectivity and permeability of CO2. 展开更多
关键词 Graphdiyne Strain CO2 separation Molecular dynamics Density functional theory
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Vortex dynamics and entropy generation in separated transitional flow over a compressor blade at various incidence angles 被引量:2
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作者 Mingyang WANG Ziliang LI +4 位作者 Ge HAN Chengwu YANG Shengfeng ZHAO Yanfeng ZHANG Xin’gen LU 《Chinese Journal of Aeronautics》 SCIE EI CAS CSCD 2022年第3期42-52,共11页
The transition process within a Laminar Separation Bubble(LSB)that formed on a compressor blade surface was investigated using Large Eddy Simulations(LESs)at a Reynolds number of 1.5×10^(5) and incidence angles o... The transition process within a Laminar Separation Bubble(LSB)that formed on a compressor blade surface was investigated using Large Eddy Simulations(LESs)at a Reynolds number of 1.5×10^(5) and incidence angles of 0°,+3°,and+5°.The vortex dynamics in the separated shear layers were compared at various incidence angles and its effects on the loss generation were clarified through entropy analysis.Results showed that transition onset,which was accurately identified by the Linear Stability Theory(LST),was significantly promoted at the increased incidence angle.As such,the development of LSB was suppressed and the relative role of viscous instability played in the transition process was weakened.At the incidence angle of 0°,two-dimensional spanwise vortices detached from the blade surface and roiled up periodically,which were further stretched and eventually evolved into large-scale hairpin vortices.As time passed,the fully developed hairpin vortices broke down into small-scale eddies.Meanwhile,the flow near the wall reversely ejected into the outer separated shear layers and a sweeping process happened subsequently,forcing the separated shear layers to reattach and accelerating the generation of turbulent fluctuations.By comparison,the strength of vortex rolling-up was weakened at higher incidence angles,and the vortex pairing and breakdown of large-scale vortices were less pronounced.Therefore,the level of turbulent fluctuations that generated in the separated shear layers was reduced.Detailed entropy analysis showed that the turbulent dissipation effect related to the Reynolds shear stresses determined the largest amount of positive entropy generation,which declined to a lower level as the incidence angle increased from 0°to+5°.Correspondingly,the profile loss was reduced by 50.4%. 展开更多
关键词 Aerodynamic performance Compressor airfoil ENTROPY Incidence angle separation bubble Vortex dynamics
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Multi-Body Dynamics Modeling and Simulation Analysis of a Vehicle Suspension Based on Graph Theory 被引量:1
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作者 Jun Zhang Xin Li Renjie Li 《Journal of Beijing Institute of Technology》 EI CAS 2018年第4期518-526,共9页
Multi-body dynamics,relative coordinates and graph theory are combined to analyze the structure of a vehicle suspension.The dynamic equations of the left front suspension system are derived for modeling.First,The pure... Multi-body dynamics,relative coordinates and graph theory are combined to analyze the structure of a vehicle suspension.The dynamic equations of the left front suspension system are derived for modeling.First,The pure tire theory model is used as the input criteria of the suspension multibody system dynamic model in order to simulate the suspension K&C characteristics test.Then,it is important to verify the accuracy of this model by comparing and analyzing the experimental data and simulation results.The results show that the model has high precision and can predict the performance of the vehicle.It also provides a new solution for the vehicle dynamic modeling. 展开更多
关键词 multi-body dynamics MATLAB SUSPENSION graph theory
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STUDY ON DYNAMICS, STABILITY AND CONTROL OF MULTI-BODY FLEXIBLE STRUCTURE SYSTEM IN FUNCTIONAL SPACE 被引量:1
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作者 XU Jian-guo(徐建国) +1 位作者 JIA Jun-guo(贾军国) 《Applied Mathematics and Mechanics(English Edition)》 SCIE EI 2001年第12期1410-1421,共12页
The dynamics, stability and control problem of a kind of infinite dimensional system are studied in the functional space with the method of modern Mathematics. First, the dynamical control model of the distributed par... The dynamics, stability and control problem of a kind of infinite dimensional system are studied in the functional space with the method of modern Mathematics. First, the dynamical control model of the distributed parameter system with multi-body flexible and multi-topological structure was established which has damping, gyroscopic parts and constrained damping. Secondly, the necessary and sufficient condition of controllability and observability, the stability theory and asymptotic property of the system were obtained. These results expand the theory of the field about the dynamics and control of the system with multi-body flexible structure, and have important engineering significance. 展开更多
关键词 multi-body flexible system dynamics STABILITY CONTROL functional space
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Dynamics Simulation and Optimization of Hydraulic Excavator Working Device
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作者 Dongjun He 《机械工程与设计(中英文版)》 2025年第2期1-6,共6页
The performance and efficiency of hydraulic excavators heavily depend on the design and optimization of their working devices.The working device,which consists of the boom,arm,and bucket,plays a crucial role in determ... The performance and efficiency of hydraulic excavators heavily depend on the design and optimization of their working devices.The working device,which consists of the boom,arm,and bucket,plays a crucial role in determining the machine's digging capacity,stability,and overall operational efficiency.This paper presents a comprehensive study on the dynamics simulation and optimization of hydraulic excavator working devices.The paper outlines the fundamental principles of dynamic modeling,incorporating multi-body dynamics and hydraulic system analysis.It further explores various simulation techniques to evaluate the performance of the working device under varying operational conditions,including load and hydraulic system effects.The study also addresses performance optimization,focusing on multi-objective optimization methods that balance multiple factors such as energy efficiency,speed,and load capacity.Additionally,the paper discusses key factors influencing performance,such as mechanical design,material properties,and operational conditions.The results of the dynamic simulations and optimization analyses demonstrate potential improvements in operational efficiency and system stability,providing a valuable framework for the design and enhancement of hydraulic excavator working devices. 展开更多
关键词 Hydraulic Excavator Working Device dynamic Modeling Performance Optimization multi-body dynamics Hydraulic System SIMULATION Design Optimization Multi-objective Optimization Excavator Performance
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Numerical investigation on vortex dynamics of flow around a pitching hydrofoil via the finite-domain impulse theory
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作者 Hui-Yun Hao Yun-Qing Liu +1 位作者 Qin Wu Ying Liu 《Acta Mechanica Sinica》 2025年第1期82-94,共13页
The behaviors of unsteady flow structures and corresponding hydrodynamics for a pitching hydrofoil are investigated numerically and theoretically in the present paper.The aims are to derive the total lift by finite-do... The behaviors of unsteady flow structures and corresponding hydrodynamics for a pitching hydrofoil are investigated numerically and theoretically in the present paper.The aims are to derive the total lift by finite-domain impulse theory for subcavitating flow(σ=8.0)and cavitating flow(σ=3.0),and to quantify the distinct impact of individual vortex structures on the transient lift to appreciate the interplay among cavitation,flow structures,and vortex dynamics.The motion of the hydrofoil is set to pitch up clockwise with an almost constant rate from 0°to 15°and then back to 0°,for the Reynolds number,7.5×105,and the frequency,0.2 Hz,respectively.The results reveal that the presence of cavities delays the migration of the laminar separation bubble(LSB)from the trailing edge(TE)to the leading edge(LE),consequently postponing the hysteresis in the inflection of lift coefficients.The eventual stall under the sub-cavitation regime is the result of LSB bursting.While the instabilities within the leading-edge LSB induce the convection of cavitation-dominated vortices under the cavitation regime instead.Having validated the lift coefficients on the hydrofoil through the finite-domain impulse theory using the standard force expression,the Lamb vector integral emerges as the main contribution to the generation of unsteady lift.Moreover,the typical vortices’contributions to the transient lift during dynamic stall are accurately quantified.The analysis indicates that the clockwise leading-edge vortex(−LEV)contributes positively,while the counterclockwise trailing-edge vortex(+TEV)contributes negatively.The negative influence becomes particularly pronounced after reaching the peak of total lift,as the shedding of the concentrated wake vortex precipitates a sharp decline due to a predominant negative lift contribution from the TEV region.Generally,the vortices’contribution is relatively modest in sub-cavitating flow,but it is notably more significant in the context of incipient cavitating flow. 展开更多
关键词 Cavitation Vortex dynamics Finite-domain impulse theory Pitching hydrofoil Laminar separation bubble dynamic stall
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Molecular simulation study on phase separation of immunoglobulin G
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作者 Lv-Meng Hu Yuan-Qiang Chen +1 位作者 Hong-Ming Ding Yu-Qiang Ma 《Chinese Physics B》 2025年第8期444-455,共12页
Understanding the liquid-liquid phase separation(LLPS)of immunoglobulin G(IgG)is crucial,as it profoundly influences IgG’s biological activity and stability.In this study,we employed coarse-grained molecular dynamics... Understanding the liquid-liquid phase separation(LLPS)of immunoglobulin G(IgG)is crucial,as it profoundly influences IgG’s biological activity and stability.In this study,we employed coarse-grained molecular dynamics simulations to systematically investigate the phase separation behavior of IgG.We first constructed two types of IgG models:all-pair IgG model and partial-pair IgG model,and compared the coexistence curve from our simulations with experimental data.Our results showed that the partial-pair IgG model aligns better with the experimental critical temperature and critical density.Using this model,we then calculated the temperature-dependent variations of IgG’s radius of gyration,surface tension,viscosity,etc.More importantly,we demonstrated that variations in the interaction strengths among IgG molecules significantly influence their phase separation behavior.Specifically,a higher standard deviation of interaction strength at different temperatures is found to lead to more stable phase-separated states.Furthermore,we observed that the introduction of repulsive polymers and strongly attractive polymers consistently enhances IgG phase separation,while weakly attractive polymers exhibit a dual regulatory effect on the phase separation.Overall,this study provides valuable insights into the mechanisms governing IgG phase behavior,with potential implications for optimizing biopharmaceutical products. 展开更多
关键词 phase separation immunoglobulin G COARSE-GRAINING molecular dynamics
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Enhanced fluid-flow-field and electric-field synergistic interaction mechanism for lithium-ion separation in dilute solutions:A numerical analysis of electrochemically switched ion exchange system
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作者 Kangjun Ji Jingxuan Yang +5 位作者 Xuefeng Zhang Mengbo Zhao Xiao Du Xiaogang Hao Abuliti Abudula Guoqing Guan 《Chinese Journal of Chemical Engineering》 2025年第9期228-237,共10页
Electrochemically switched ion exchange(ESIX)is an effective technology for extracting high-valueadded ions from dilute solutions.This study focuses on Li^(+)extraction by employing a comprehensive model to analyze in... Electrochemically switched ion exchange(ESIX)is an effective technology for extracting high-valueadded ions from dilute solutions.This study focuses on Li^(+)extraction by employing a comprehensive model to analyze interaction between fluidic dynamics,electric field and ion transport.The model combines Butler-Volmer equation modified by electroactive site concentration,Nernst-Planck equation and Navier-Stokes equation.It is found that the chamber width affects solution phase resistance,thereby altering the pote ntial distribution and influencing the current distribution within the membrane.A narrow chamber increases current density in the solid phase of the membrane,enhancing Li^(+) extraction.The solution flow-field not only enhances convective transport but also increases the current density in the solid phase,promoting Li^(+) extraction.There is a synergistic effect between fluid-flow-field and electric-field for ion separation,which is only significant when the chamber width is greater than 2 mm.The synergistic mechanism differs from that in the capacitive deionization system.Therefore,the performance decline caused by a wide chamber can be compensated for by increasing the fluid-flow rate,utilizing the synergistic effect between the flu id-flow-field and electric-field to optimize the lithium extraction efficiency in the ESIX system. 展开更多
关键词 Electrochemically switched ion exchange Mass transfer and separation Synergistic effect Fluid-flow-field Fluidic dynamics ELECTRIC-FIELD
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Adsorption equilibrium, kinetics, and dynamic separation of Ca2+ and Mg2+ ions from phosphoric acid–nitric acid aqueous solution by strong acid cation resin
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作者 Rui Lü Qing Xi +7 位作者 Tan Li Rui Li Xiaochao Zhang Jianxin Liu Caimei Fan Junqiang Feng Lingyun Zhang ZhihuaWang 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2019年第12期2930-2936,共7页
The separation of Ca2+and Mg2+ions from phosphoric acid-nitric acid aqueous solution is very significant for the neutralization process of nitrophosphate fertilizer.This paper studied the adsorption equilibrium,kineti... The separation of Ca2+and Mg2+ions from phosphoric acid-nitric acid aqueous solution is very significant for the neutralization process of nitrophosphate fertilizer.This paper studied the adsorption equilibrium,kinetics,and dynamic separation of Ca2+and Mg2+ions by strong acid cation resin,and the effects of phosphoric acid and nitric acid on the adsorption process were investigated.The results reveal that the adsorption process of Ca2+and Mg2+ions in pure water on resin is in good agreement with the Langmuir isotherm model and their maximal adsorption capacities are 1.86 mmol·g-1 and 1.83 mmol·g-1,respectively.The adsorption kinetics of Ca2+and Mg2+ions on resin fits better with the pseudo-first-order model,and the adsorption equilibrium in pure water is reached within 10 min contact time,while at the present of phosphoric acid,the adsorption rate of Ca2+and Mg2+ions on resin will go down.The dynamic separation experiments demonstrate that the designed column adsorption is able to undertake the separation of metal ions from the mix acids aqueous solution,but the dynamic operation should control the flow rate of mix acid solution.Besides nitric acid solution was proved to be effective to completely regenerate the spent resin and achieve the recyclable operation of separation process. 展开更多
关键词 Ca2+and Mg2+ions Strong acid CATION resin Adsorption equilibrium KINETICS dynamIC separation
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Articulated Lifting System Modeling Based on Dynamics of Flexible Multi-Body Systems
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作者 徐妍 冯雅丽 张文明 《China Ocean Engineering》 SCIE EI 2007年第4期715-722,共8页
In lifting sub-system of deep-sea mining system, spherical joint is used to connect lifting pipes to replace fixed joint. Based on Dynamics of Flexible Multi-body systems, the mechanics model of articulated lifting sy... In lifting sub-system of deep-sea mining system, spherical joint is used to connect lifting pipes to replace fixed joint. Based on Dynamics of Flexible Multi-body systems, the mechanics model of articulated lifting system is established. Under the four-grade and six-grade oceanic condition, dynamic responses of lifting system are simulated and experiment verified. The simulation results are consistent with experimental ones. The maximum moment of flexion is 322 kN-m on the first pipe under six-grade sea condition. It is seen that the articulated connection can reduce the moment of flexion. The bending deformation of pipe center is researched, and the maximum is 0. 000479 m on the first pipe. Deformation has a little effect on the motion of system. It is feasible to analyze articulated lifting system by applying the theory of flexible multi-body dynamics. The articulated lifting system is obviously better than the fixed one. 展开更多
关键词 articulated lifting system flexible multi-body dynamics bending deformation dynamics modeling
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Manual Transmission Gear Rattle Vibration Research Based on Mathematical and Multi-Body Dynamics Co-simulation and Experiment
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作者 LI Meng ZHANG Yong +1 位作者 LIU Fengyu YIN Chengliang 《Journal of Shanghai Jiaotong university(Science)》 EI 2019年第4期524-533,共10页
A method, which compares the angular acceleration and vibration spectrums of shafts and gears with physical characteristics of gearbox as tooth numbers and speed ratios, is proposed to find the source of gear rattle v... A method, which compares the angular acceleration and vibration spectrums of shafts and gears with physical characteristics of gearbox as tooth numbers and speed ratios, is proposed to find the source of gear rattle vibration. A mathematical and multi-body dynamics co-simulation model is built to reproduce the gear rattle phenomenon of one typical type of manual transmission. In the model, multi-body dynamics part is used for rotational motion and engagement simulation of gearbox shafts and gears, while mathematical part for control and data processing. The simulation results show that the sound source of the gear rattle from the first gear to the third gear is similar to the experimental results;different parameters like rotating damping, contact stiffness,contact damping, inertia moment and torque fluctuation making effects on gear rattle vibration strength are researched and simulated. The comparison of the simulation and experimental results shows that this method can provide recommendations for solving practical gear rattle problems. 展开更多
关键词 gear rattle manual transmission mathematical model multi-body dynamics CO-SIMULATION
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Temperature-controlled flexible metal—organic frameworks for propylene/propane separation
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作者 Jiamin Zhang Yanhui Dai +2 位作者 Yang Chen Jinping Li Libo Li 《Chinese Journal of Chemical Engineering》 2025年第10期72-78,共7页
The efficientseparation of C_(3)H_(6) and C_(3)H_(8) is a key challenge in the petrochemical industry.A zinc-based flexible metal—organic framework(Zn—anthracenedicarboxylic acid(ADC)—triazole(TRZ))was designed thr... The efficientseparation of C_(3)H_(6) and C_(3)H_(8) is a key challenge in the petrochemical industry.A zinc-based flexible metal—organic framework(Zn—anthracenedicarboxylic acid(ADC)—triazole(TRZ))was designed through dual ligand construction.The material forms a two-dimensional layered structure via TRZ ligands,with ADC ligands serving as interlayer pillars to construct a three-dimensional pillarlayered structure,combining the stability of rigid aromatic rings with the dynamic responsiveness of flexible structures.The flexible pores of Zn—ADC—TRZ can be reversibly opened and closed under the thermal effect,and the adsorption capacity and the opening pressure of the gas can be adjusted with the increase of temperature,thereby enabling achieve the best separation effect under different partial pressures of the gas.Specifically,temperature modulation leads to increase the opening pressure of Zn—ADC—TRZ,enabling significantadsorption difference between C_(3)H_(6) and C_(3)H_(8).At 313 K and 50 kPa,Zn—ADC—TRZ achieves the highest adsorption ratio(24)of C_(3)H_(6) and C_(3)H_(8) while maintaining substantial C_(3)H_(6) adsorption capacity,thereby facilitating efficientseparation of equimolar gases.This work demonstrates the potential of temperature-responsive flexible metal—organic frameworks for energyefficientolefinpurification,offering novel insights into low-energy consumption separation technology. 展开更多
关键词 Metal—organic frameworks dynamic recognition Temperature-controlled C_(3)H_(6)/C_(3)H_(8)separation
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Prediction of Instability Separation Modes and Its Application in Practical Dynamic Security Region
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作者 曾沅 余贻鑫 +3 位作者 王红梅 闵亮 张沛 LEES T 《Transactions of Tianjin University》 EI CAS 2007年第3期157-162,共6页
The transient critical boundary of dynamic security region (DSR) can be approximated by a few hyper planes correlated with instability separation modes. A method to fast predict instability separation modes is propose... The transient critical boundary of dynamic security region (DSR) can be approximated by a few hyper planes correlated with instability separation modes. A method to fast predict instability separation modes is proposed for DSR calculation in power injection space. The method identifies coherent generation groups by the developed K-medoids algorithm, taking a similarity matrix derived from the reachability Grammian as the index. As an experimental result, reachability Grammian matrices under local injections are approximately invariant. It indicates that the generator coherency identifications are nearly consistent for different injections. Then instability separation modes can be predicted at the normal operating point, while average initial acceleration is considered as the measure of the critical generator group to amend the error. Moreover, based on these predicted instability separation modes, a critical point search strategy for DSR calculation is illustrated in the reduced injection space of the critical generators. The proposed method was evaluated using New England Test System, and the computation accuracy and speed in determining the practical DSR were improved. 展开更多
关键词 instability separation mode dynamic security region K-medoids algorithm reachability Grammian
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Energy Separation and Explicit Dynamic Analysis of Low Temperature Impact Toughness of Transmission Tower Material Q420B
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作者 YU Xingxue ZHANG Yinghua +1 位作者 ZHANG Xiaomin JIANG Yu 《Journal of Shanghai Jiaotong university(Science)》 EI 2019年第3期381-387,共7页
To determine the physical significance of the impact toughness parameters and accurately characterize the low temperature impact toughness of transmission tower material Q420 B,the finite element model of Charpy impac... To determine the physical significance of the impact toughness parameters and accurately characterize the low temperature impact toughness of transmission tower material Q420 B,the finite element model of Charpy impact test is established on the basis of experiment.The simulation and test results are verified,and the specimen fracture is analyzed by scanning electron microscope.The formation and growth mechanism of the crack are dynamically analyzed.On this basis,energy separation method is used to investigate the effect of low temperature on impact toughness.The results show that the simulation and test results are in good agreement,and the ductile-brittle transition temperature of Q420 B is about-50 ℃.The breaking process of the specimen is divided into the crack formation and propagation.When temperature drops from 20 to-60 ℃,the crack propagation energy decreases from 51.0 to 11.9 J,the crack formation energy reduces from 39.9 to 15.8 J,and the fracture time of the material drops from 1.8 to 0.6 ms. 展开更多
关键词 Q420B low temperature impact toughness SIMULATION explicit dynamic energy separation
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基于Aspen Dynamics超精馏塔的动态模拟与控制 被引量:8
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作者 张治山 王超 +1 位作者 张青军 高军 《现代化工》 CAS CSCD 北大核心 2017年第4期190-193,共4页
以异戊烷/正戊烷分离过程为例,利用Aspen Dynamics对超精馏塔的动态控制特性进行了研究。在稳态模拟的基础上,通过进料组成灵敏度分析和动态模拟,对3种单产品纯度控制结构进行了比较,运用Aspen Dynamics对4种双产品纯度控制方案进行了... 以异戊烷/正戊烷分离过程为例,利用Aspen Dynamics对超精馏塔的动态控制特性进行了研究。在稳态模拟的基础上,通过进料组成灵敏度分析和动态模拟,对3种单产品纯度控制结构进行了比较,运用Aspen Dynamics对4种双产品纯度控制方案进行了动态模拟与分析。结果表明,面临进料流量和组成扰动时,R/F(摩尔比)结构为最优单产品纯度控制方案,D-BR结构为最佳双产品控制方案且优于R/F(摩尔)结构。 展开更多
关键词 超精馏塔 动态控制 模拟 异戊烷/正戊烷分离
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