A dynamic coupling model for hybrid atomistic-continuum computations

A dynamic coupling model is developed for a hybrid atomistic-continuum computation in micro- and nano-fluidics. In the hybrid atomistic-continuum computation, a molecular dynamics (MD) simulation is utilized in one region where the continuum assumption breaks down and the Navier-Stokes (NS) equations are used in another region where the continuum assumption holds. In the overlapping part of these two regions, a constrained particle dynamics is needed to couple the MD simulation and the NS equations. The currently existing coupling models for the constrained particle dynamics have a coupling parameter, which has to be empirically determined. In the present work, a novel dynamic coupling model is introduced where the coupling parameter can be calculated as the computation progresses rather than inputing a priori. The dynamic coupling model is based on the momentum constraint and exhibits a correct relaxation rate. The results from the hybrid simulation on the Couette flow and the Stokes flow are in good agreement with the data from the full MD simulation and the solutions of the NS equations, respectively. (c) 2007 Elsevier Ltd. All rights reserved.

Response of the Bucket Foundation in Calcareous Sand under Horizontal Dynamic Load

Abstract: Experiments to determine the horizontal static bearing capacity are carried out first. The static bearing capacity is a reference for choosing the amplitudes of dynamic load. Then a series of experiments under dynamic horizontal load are carried out in laboratory to study the influences of factors, such as the scales of bucket, the amplitude and frequency of load, the density of soils etc.. The responses of bucket foundations in calcareous sand under horizontal dynamic load are analyzed according to the experimental results. The displacements of bucket and sand layer are analyzed.

Dimensionless Analysis of the Simulation of Bucket Foundations under Dynamic Load

Firstly, the main factors are obtained by use of dimensionless analysis. Secondly, the time scaling factors in centrifuge modeling of bucket foundations under dynamic load are analyzed based on dimensionless analysis and control- ling equation. A simplified method for dealing with the conflict of scaling factors of the inertial and the percolation in sand foundation is presented. The presented method is that the material for experiments is not changed while the effects are modified by perturbation method. Thirdly, the characteristic time of liquefaction state and the characteristic scale of affected zone are analyzed.

Stability Of Adhesion Clusters And Cell Reorientation Under Lateral Cyclic Tension

This work is motivated by experimental observations that cells on stretched substrate exhibit different responses to static and dynamic loads. A model of focal adhesion that can consider the mechanics of stress fiber, adhesion bonds, and substrate was developed at the molecular level by treating the focal adhesion as an adhesion cluster. The stability of the cluster under dynamic load was studied by applying cyclic external strain on the substrate. We show that a threshold value of external strain amplitude exists beyond which the adhesion cluster disrupts quickly. In addition, our results show that the adhesion cluster is prone to losing stability under high-frequency loading, because the receptors and ligands cannot get enough contact time to form bonds due to the high-speed deformation of the substrate. At the same time, the viscoelastic stress fiber becomes rigid at high frequency, which leads to significant deformation of the bonds. Furthermore, we find that the stiffness and relaxation time of stress fibers play important roles in the stability of the adhesion cluster. The essence of this work is to connect the dynamics of the adhesion bonds (molecular level) with the cell's behavior during reorientation (cell level) through the mechanics of stress fiber. The predictions of the cluster model are consistent with experimental observations.

Dynamic damage and failure in viscoplastic materials

In this paper, a dynamic damage model in ductile solids under the application of a dynamic mean tensile stress is developed. The proposed model considers void nucleation and growth as parts of the damage process under intense dynamic loading (strain rates epsilon greater than or equal to 10(3) s(-1)). The evolution equation of the ductile void has the closed form, in which work-hardening behavior, rate-dependent contribution and inertial effects are taken into account. Meanwhile, a plate impact test is performed for simulating the dynamic fracture process in LY12 aluminum alloy. The damage model is incorporated in a hydrodynamic computer code, to simulate the first few stress reverberations in the target as it spalls and postimpact porosity in the specimen. Fair agreement between computed and experimental results is obtained. Numerical analysis shows that the influence of inertial resistance on the initial void growth in the case of high loading rate can not be neglected. It is also indicated that the dynamic growth of voids is highly sensitive to the strain rates.

On the computation of space-time correlations by large-eddy simulation

The effect of subgrid-scale (SGS) modeling on velocity (space-) time correlations is investigated in decaying isotropic turbulence. The performance of several SGS models is evaluated, which shows superiority of the dynamic Smagorinsky model used in conjunction with the multiscale large-eddy simulation (LES) procedure. Compared to the results of direct numerical simulation, LES is shown to underpredict the (un-normalized) correlation magnitude and slightly overpredict the decorrelation time scales. This can lead to inaccurate solutions in applications such as aeroacoustics. The underprediction of correlation functions is particularly severe for higher wavenumber modes which are swept by the most energetic modes. The classic sweeping hypothesis for stationary turbulence is generalized for decaying turbulence and used to analyze the observed discrepancies. Based on this analysis, the time correlations are determined by the wavenumber energy spectra and the sweeping velocity, which is the square root of the total energy. Hence, an accurate prediction of the instantaneous energy spectra is most critical to the accurate computation of time correlations. (C) 2004 American Institute of Physics.

一种基于比例反馈控制原理的动载荷时域反演方法

通过借鉴系统控制论中的比例反馈控制原理，提出了一种新的结构动载荷时域反演方法。该方法在原开环系统的输出与结构模型之间连接一个虚拟的比例反馈增益，使得原来的开环系统成为一个虚拟的闭环反馈控制系统，系统控制信号为实测的结构加速度响应。反馈控制器将系统输出与控制信号之间的差值进行放大后作为反馈不断输入到结构模型中，直到差值趋于稳定，此时该差值与反馈增益的乘积经过高通滤波后即得到所反演的动态载荷。该方法将载荷反演问题的求解转化为正问题中的结构瞬态响应求解，采用一般的数值解法如New-mark法即可实现，因此计算比较简便迅速。该方法仅需要测量结构的加速度响应即可进行反演，便于实际应用，而且并不十分依赖于真实的初始条件，由于不存在误差累积的现象，反演结果具有较好的稳定性。最后，通过海洋平台结构冰载荷反演的模型实验和数值仿真证明了该方法的有效性。

Effects of temperature on the threshold of phosphorus for algal blooms

Algal blooms, worsening marine ecosystems and causing great economic loss, have been paid much attention to for a long time. Such environmental factors as light penetration, water temperature, and nutrient concentration are crucial in blooms processes. Among them, only nutrients can be controlled. Therefore, the threshold of nutrients for algal blooms is of great concern. To begin with, a dynamic eutrophication model has been constructed to simulate the algal growth and phosphorus cycling. The model encapsulates the essential biological processes of algal growth and decay, and phosphorus regeneration due to algal decay. The nutrient limitation is based upon commonly used Monod's kinetics. The effects of temperature and phosphorus limitation are particularly addressed. Then, we have endeavored to elucidate the threshold of phosphorus at different temperature for algal blooms. Based on the numerical simulation, the isoquant contours of change rate of alga as shown in the figure are obtained, which obviously demonstrate the threshold of nutrient at an arbitrary reasonable temperature. The larger the change rate is, the more rapidly the alga grows. If the phosphorus concentration at a given temperature remains larger than the threshold the algal biomass may increase monotonically, leading to the algal blooming. With the rising of temperature, the threshold is apparently reduced, which may explain why likely red tide disasters occur in a fine summer day. So, high temperature and sufficient phosphorus supply are the major factors which result in algal growth and blowout of red tide.

An Atomistic-Continuum Hybrid Simulation Of Fluid Flows Over Superhydrophobic Surfaces

Recent experiments have found that slip length could be as large as on the order of 1 mu m for fluid flows over superhydrophobic surfaces. Superhydrophobic surfaces can be achieved by patterning roughness on hydrophobic surfaces. In the present paper, an atomistic-continuum hybrid approach is developed to simulate the Couette flows over superhydrophobic surfaces, in which a molecular dynamics simulation is used in a small region near the superhydrophobic surface where the continuum assumption is not valid and the Navier-Stokes equations are used in a large region for bulk flows where the continuum assumption does hold. These two descriptions are coupled using the dynamic coupling model in the overlap region to ensure momentum continuity. The hybrid simulation predicts a superhydrophobic state with large slip lengths, which cannot be obtained by molecular dynamics simulation alone.

An atomistic-continuum hybrid simulation of fluid flows over superhydrophobic surfaces

Recent experiments have found that slip length could be as large as on the order of 1 mu m for fluid flows over superhydrophobic surfaces. Superhydrophobic surfaces can be achieved by patterning roughness on hydrophobic surfaces. In the present paper an atomistic-continuum hybrid approach is developed to simulate the Couette flows over superhydrophobic surfaces in which a molecular dynamics simulation is used in a small region near the superhydrophobic surface where the continuum assumption is not valid and the Navier-Stokes equations are used in a large region for bulk flows where the continuum assumption does hold. These two descriptions are coupled using the dynamic coupling model in the overlap region to ensure momentum continuity. The hybrid simulation predicts a superhydrophobic state with large slip lengths which cannot be obtained by molecular dynamics simulation alone.

基于反馈机制的网格动态授权新模型

网格现有的授权系统存在静态性问题,表现为没有提供机制来反馈用户对授予的权限的使用情况.当一个本来可信的用户或服务变成不可信时,授权系统不能及时发现,对其权限进行调整可能导致恶意用户对网格系统的破坏.因此,在授权系统中建立反馈机制,根据用户的行为动态地调整用户角色,对于网格系统的安全具有重大意义.文中分析了网格中现有的授权系统及信任模型的特点,指出它们存在的不足.在此基础上提出一种基于反馈机制的动态授权新模型,很好地解决了现有授权系统的静态性的缺点.该模型是对CAS授权系统的改进,增加了反馈机制和信任度计算机制.其中,信任度计算机制中提出的基于行为的分层信任新模型较以往的信任模型相比,使用服务权值来区分重要服务和普通服务,从而保护了网格中的重要服务并且能有效地抑制恶意节点的行为;文中提出了一种新的更加精确地计算域间推荐信任度的方法,从而解决了不诚实反馈的问题.反馈机制则利用基于行为分层信任模型给出的用户信任度的变化,实现了根据用户的行为动态调整他的角色.文中还设计了三组模型实验,分别验证新模型的特点、对网格中恶意实体行为的抑制情况,从不同的角度对模型进行了实验,对基于行为的分层信任模型对行为的敏感性、收敛性、有效性及合理性加以了证明.

钙质砂地基中桶形基础水平动载响应实验研究

针对钙质砂地基中桶形基础动态响应问题进行了实验研究.首先进行了水平静极限承载力实验,获得了水平载荷位移曲线,并为确定水平动载荷幅值的选择提供参考;然后针对主要因素,包括桶形基础尺寸、载荷幅值和频率、土体密度、压重等,进行了系列的室内小模型实验,并对结果进行了分析,获得了水平动载下桶形基础在钙质砂地基中的响应特点.结果表明:载荷幅值、频率、土体密度、桶形基础尺寸对动态响应有明显影响;动载下桶形基础周围钙质砂中孔压上升,但是较其他类砂土中的慢;在结构重量小时,桶形基础上升;有上覆较硬粘土层时,桶形基础和地基的响应减弱.

Study on spatial pattern of land-use change in China during 1995-2000

It is more and more acknowledged that land-use/cover dynamic change has become a key subject urgently to be dealt with in the study of global environmental change. Supported by the Landsat TM digital images, spatial patterns and temporal variation of land-use change during 1995 -2000 are studied in the paper. According to the land-use dynamic degree model, supported by the 1km GRID data of land-use change and the comprehensive characters of physical, economic and social features, a dynamic regionalization of land-use change is designed to disclose the spatial pattern of land-use change processes. Generally speaking, in the traditional agricultural zones, e.g., Huang-Huai-Hai Plains, Yangtze River Delta and Sichuan Basin, the built-up and residential areas occupy a great proportion of arable land, and in the interlock area of farming and pasturing of northern China and the oases agricultural zones, the reclamation I of arable land is conspicuously driven by changes of production conditions, economic benefits and climatic conditions. The implementation of "returning arable land into woodland or grassland" policies has won initial success in some areas, but it is too early to say that the trend of deforestation has been effectively reversed across China. In this paper, the division of dynamic regionalization of land-use change is designed, for the sake of revealing the temporal and spatial features of land-use change and laying the foundation for the study of regional scale land-use changes. Moreover, an integrated study, including studies of spatial pattern and temporal process of land-use change, is carried out in this paper, which is an interesting try on the comparative studies of spatial pattern on change process and the change process of spatial pattern of land-use change.

Cellular automata: Simulating alpine tundra vegetation dynamics in response to global warming

This study attempts to model alpine tundra vegetation dynamics in a tundra region in the Qinghai Province of China in response to global warming. We used Raster-based cellular automata and a Geographic Information System to study the spatial and temporal vegetation dynamics. The cellular automata model is implemented with IDRISI's Multi-Criteria Evaluation functionality to simulate the spatial patterns of vegetation change assuming certain scenarios of global mean temperature increase over time. The Vegetation Dynamic Simulation Model calculates a probability surface for each vegetation type, and then combines all vegetation types into a composite map, determined by the maximum likelihood that each vegetation type should distribute to each raster unit. With scenarios of global temperature increase of I to 3 degrees C, the vegetation types such as Dry Kobresia Meadow and Dry Potentilla Shrub that are adapted to warm and dry conditions tend to become more dominant in the study area.