行星式化学气相沉积反应器内对流涡旋的数值模拟

针对三重进口行星式CVD反应器的输运过程进行了二维数值模拟研究。通过改变反应腔几何尺寸、导流管位置、三重进口流量组合、压强、温度等条件,研究反应器内对流涡旋的相应变化。根据模拟结果,对这类反应器中输运现象与外部参数的关系,特别是反应腔内对流涡旋的产生和发展作了较全面的分析和讨论,给出了抑制对流涡旋、获得薄膜生长所需的最佳输运过程的条件。     

底部加热长方体腔内自然对流的非线性特性

采用SIMPLE算法,QUICK差分格式,对底部加热三维长方体腔内空气的自然对流进行了数值模拟。根据模拟结果,探讨了方腔内流体流动与换热的静态分岔与振荡等非线性现象。数值结果显示,在固定的几何尺寸和不同Ra的情况下,当初始场不同时,会出现若干不同的解,即存在解的静态分岔;在固定的几何尺寸和相同的初始场情况下,低Ra时流动和换热处于稳态,当Ra超过某一临界值时,流动和换热就会随时间振荡,并通过倍周期分岔过渡到混沌;当方腔的几何尺寸不同时,分岔点的特征值Ra也发生变化。     

水平流作用下行波对流的成长及周期性重复

数值模拟研究了在极其微弱的水平流动作用下，混合流体Rayleigh-Benard对流系统一 维行波斑图的成长及其时空演化问题.揭示了系统行波对流的周期性现象及其对水平流动强 度的依赖性. 关键词： 时空斑图 混合流体对流 水平流     

自然对流的LB方法模拟及其非线性特性

采用LB方法和QUICK差分方法模拟了方腔内竖直平板自然对流和底部加热方腔内自然对流换热问题.实现了LB方法对具有孤立体的封闭空间内耦合的流动和传热问题的数值模拟,所得数值结果与QUICK差分方法的数值结果及已有的烟可视化实验结果一致;两种方法对底部加热方腔内自然对流问题的预测结果均出现了静态分岔和动态分岔;根据底部加热方腔内自然对流换热数值结果给出的极限环型速度相图和功率谱表明,两种方法得到的数值结果的非线性特性一致.     

基于LBM的部分热活跃边界下多孔腔体内自然对流换热

采用Boltzmann方法模拟部分热活跃边界下的多孔腔体内自然对流,探讨不同热边界布置方案、孔隙度、Da数及Ra数对其流动传热的影响.数值计算表明：Da=10^-4时,腔体内中央出现一个循环流模式,只在Ra数很大时孔隙度才对传热有影响; Da=10^-2时,腔体内出现两个循环流,在Ra数很小时孔隙度对传热产生强烈的的影响.热活跃边界位置影响腔体内流体对流传热的强度,加热边界布置在底部、而冷却边界布置在顶部（Bottom-Top布置方式）,对多孔腔体内对流传热最有利,优于全热边界布置方式的传热效果.     

紧致方法对流动换热及静态分岔的模拟

发展了基于投影法的紧致方法求解流动换热问题,对顶盖驱动流和侧壁加热的方腔内自然对流换热问题进行了数值模拟。与其它传统方法相比,紧致方法能在较少的网格结点下获得精度较高的计算结果。进一步,采用所发展的紧致方法对不同工况下的Rayleigh-Benard对流及其静态分岔现象进行了数值模拟。数值计算结果表明当长宽比变大时,底部努塞尔数会有小幅度增加。当长宽比为8时,用所发展的紧致方法不同的初场可以得出三种不同的流场和温度场。与基于QUICK格式的SIMPLE算法相比,所发展的紧致方法可以多预测一种静态分岔现象。     

CFD在换热器局部结构优化设计的应用

本文利用CFD模拟手段对电加热水箱换热器流动传热特性进行三维数值计算,通过对流场和温度场的分析,改进原设计中不利于热量传递的结构特征.在保证水箱基本结构尺寸不变的前提下,对箱体内两块折流板的位置及其几何形状进行多种结构模型的数值模拟和比较分析,实现了基于CFD数值模拟结果进行换热器局部结构优化设计的工程应用.     

考虑Soret和Dufour效应的方腔内双扩散自然对流格子Boltzmann模拟

采用格子Boltzmann方法,考虑Soret和Dufour效应,对内置高浓度发热圆的方腔内部双扩散自然对流现象进行数值模拟.高浓度发热圆位于方腔中心,四周壁面均为低温低浓度.在该模型中,用三个独立的LBGK方程分别模拟速度场、温度场和浓度场,并通过Boussinesq近似将它们耦合起来.分析Soret数和Dufour数对方腔内部双扩散自然对流的影响,得到流线图、等温线图、等浓度线图、发热圆表面平均Nusselt数和平均Sherwood数.结果表明：Soret和Dufour效应对方腔内双扩散自然对流影响明显,不能忽略.     

底部局部加热多孔介质自然对流传热的格子Boltzmann模拟

运用格子Boltzmann方法研究了底部局部加热多孔介质方腔的自然对流传热.方腔的上壁面为低温热源,下壁面为局部高温热源,左右壁面为绝热条件.重点分析了高温热源位置a及尺寸b对多孔介质方腔自然对流传热性能的影响,提出了平均Nusselt数Nu和位置a及尺寸b的拟合关系式.研究结果表明:高温热源位置及尺寸对多孔介质方腔内自然对流传热性质的影响很大,且存在最佳高温热源位置(a=4/16)和尺寸(b=0.75),以达到最强的对流换热强度(Nu_(max)≈10.35)和最大的对流换热量(Q_(max)≈5.69).     

充满金属泡沫的方腔自然对流数值模拟

本文使用格子-Boltzmann方法模拟了充满金属泡沫的封闭方腔自然对流.通过构建适用于上下边界绝热,左右边界恒定温度的封闭方腔自然对流的双分布函数热模型,模拟了充满不同孔隙率和不同孔密度的金属泡沫,在不同Ra数下的封闭方腔自然对流,结果表明金属泡沫具有强化传热的作用,并随着Ra数和孔密度的增大,换热增强.     

Exponential DNA replication by laminar convection

It is shown that laminar thermal convection can drive a chain reaction of DNA replication. The convection is triggered by a constant horizontal temperature gradient, moving molecules along stationary paths between hot and cold regions. This implements the temperature cycling for the classical polymerase chain reaction (PCR). The amplification is shown to be exponential and reaches 100,000-fold gains within 25 min. Besides direct applications, the mechanism might have implications for the molecular evolution of life.     

基于低马赫数方法的内嵌边界数值算法研究

低马赫数方法通过对可压缩方程中的压力波进行过滤,得到的方程能够对于反应或者传热造成密度出现较大波动问题进行很好描述。此方面的研究大多数集中在多相反应等问题上,然而工程实际上普遍存在的流固耦合以及多场耦合问题却鲜有涉及。本文将低马赫数方法与内嵌边界方法进行结合发展出可以用来求解弱可压缩流动中的流固耦合以及传热问题的数值算法。本文对加热圆柱在封闭腔体内的自然对流进行研究,同时也对本文提出的算法的正确性以及准确性进行了验证。     

X射线辐照引起的线粒体D310片段突变的快速检测

采用4 Gy X射线辐照人乳腺癌细胞MCF 7, 分别在照射后0, 2, 4, 8, 16, 24, 48, 72和144 h时间点收集细胞, 提取DNA并以聚合酶链式反应进行扩增, 再以BsaXI限制性内切酶对扩增产物进行消化, 消化产物以琼脂糖凝胶电泳进行分离。 结果表明, 4 Gy X射线辐照可引起D310片段突变, 且该突变在经辐照之后144 h检测水平明显超过野生型。 Human breast cancer cell line MCF 7 was irradiated with 4 Gy X ray, collected at 0, 2, 4, 8, 16, 24, 48, 72, 144 h after irradiation, respectively. Whole genome DNA including mtDNA were extracted at each time point, and amplified by polymerase chain reaction(PCR). Then the PCR product was subjected to BSAXI digestion, all of digestion product then underwent a brief electrophoresis. Results showed D310 mutation can be induced by 4 Gy X ray irradiation and D310 mutation can overwhelm the normal phenotype 144 h after irradiation.     

Natural and forced convective heat transfer on slender cylinders

This paper presents an experimental study of free and forced convective heat transfer along vertical slender cylinders. The local heat transfer coefficient is determined from the measurement of the surface temperature distribution performed by quantitative infrared thermography. It is found that the convective heat transfer is strongly dependent on the cylinder curvature and misalignment with the flow. The effect of proximity of two cylinders is emphasized in the case of forced convection. Correlations are proposed for the two types of convection. It is worth noting that circumstances exist where the turbulent heat transfer in free convection can be of the same order of magnitude as for laminar forced convection. The outcome of the study demonstrates the suitability of quantitative infrared thermography to solve complex problems and to provide a deeper understanding of the heat transfer on slender cylinders.     

Stability of convective patterns in reaction fronts: a comparison of three models

Autocatalytic reaction fronts generate density gradients that may lead to convection. Fronts propagating in vertical tubes can be flat, axisymmetric, or nonaxisymmetric, depending on the diameter of the tube. In this paper, we study the transitions to convection as well as the stability of different types of fronts. We analyze the stability of the convective reaction fronts using three different models for front propagation. We use a model based on a reaction-diffusion-advection equation coupled to the Navier-Stokes equations to account for fluid flow. A second model replaces the reaction-diffusion equation with a thin front approximation where the front speed depends on the front curvature. We also introduce a new low-dimensional model based on a finite mode truncation. This model allows a complete analysis of all stable and unstable fronts.     

Linear polymer with hydrogen bonds as a nonequilibrium system

A two-temperature nonequilibrium model of a linear polymer with possible formation of hydrogen bonds between monomers is proposed. A molecule is considered to be in an adiabatic stationary state far from equilibrium. The dependence of the mean-square distance between the chain ends on the number of monomers is calculated with the simplest approach of Flory in case T > Θ.     

Precise mass measurement of a double-stranded 500 base-pair (309 kDa) polymerase chain reaction product by negative ion electrospray ionization Fourier transform ion cyclotron resonance mass spectrometry

Electrospray ionization Fourier transform ion cyclotron resonance mass spectrometry (ESI-FTICRMS) has been used to determine the mass of a double-stranded 500 base-pair (bp) polymerase chain reaction (PCR) product with an average theoretical mass of the blunt-ended (i.e. unadenylated) species of 308 859.35 Da. The PCR product was generated from the linearized bacteriophage Lambda genome which is a double-stranded template. Utilization of ethanol precipitation in tandem with a rapid microdialysis step to purify and desalt the PCR product was crucial to obtain a precise mass measurement. The PCR product (0.8 pmol/μL) was electrosprayed from a solution containing 75% acetonitrile, 25 mM piperidine, and 25 mM imidazole and was infused at a rate of 200 nL/min. The average molecular mass and the corresponding precision were determined using the charge-states ranging from 172 to 235 net negative charges. The experimental mass and corresponding precision (reported as the 95% confidence interval of the mean) was 309 406 +/- 27 Da (87 ppm). The mass accuracy was compromised due to the fact that the PCR generates multiple products when using Taq polymerase due to the non-template directed 3'-adenylation. This results in a mixture of three PCR products with nearly identical mass (i.e. blunt-ended, mono-adenylated and di-adenylated) with unknown relative abundances that were not resolved in the spectrum. Thus, the experimental mass will be a weighted average of the three species which, under our experimental conditions, reflects a nearly equal concentration of the mono- and di-adenylated species. This report demonstrates that precise mass measurements of PCR products up to 309 kDa (500 bp) can be routinely obtained by ESI-FTICR requiring low femtomole amounts. Copyright 1999 John Wiley & Sons, Ltd.     

Controllable equilibrium of an inhomogeneously heated liquid in a vibrational field

Equations of thermal vibrational convection of an inhomogeneously heated liquid are analytically solved for arbitrary orientation of vectors determining the heating direction, force of gravity, and vibrations in a closed cavity in the shape of an infinite horizontal cylinder. It is demonstrated that for any orientation of these vectors in the plane perpendicular to the cylinder, the gravitational and vibrational convection mechanisms can completely compensate each other. The ratio is determined between the vibrational and the gravitational Grashof numbers such that mechanical equilibrium conditions are satisfied. This ratio is proved by direct numerical calculation of complete equations of thermal vibrational convection.     

Simulation of the Oxygen Dissociation Reaction under Thermally Nonequilibrium Conditions: Models,Trajectory Calculations,and the Experiment

The aim of this work was to perform a comparative study of the well-known models of physicochemical processes based on the dissociation of oxygen as an example. The comparison was conducted with the use of the available results of calculations obtained by a method of quasi-classical trajectories. The principle of the information provision of models and the complexity of their computational implementation were taken into account in the study. The dissociation process was considered in the framework of one-temperature, two-temperature, and level approximations. The MD Trajectory software was used for the simulation of molecular reaction dynamics. Computer experiments with theoretical models were carried out using an Internet catalog of physical and chemical process models. A modification of the Marrone–Treanor level model was proposed for the approximation of the rate constant of oxygen dissociation obtained by the method of quasi-classical trajectories in the level approximation. The empirical parameter of this model was replaced by a new parameter, which took into account its possible dependence on translational temperature. For a two-temperature approximation, recommendations were formulated in terms of the applicability ranges of the models taking into account the vibrational temperature of dissociating molecules based on a comparison of the results of trajectory calculations and theoretical models. The results of trajectory calculations and theoretical models in a two-temperature approximation were also compared with the available experimental data on the dissociation of oxygen molecules.     

全景环形透镜原理与特点剖析

本文从分析传统中心投影法入手，介绍了平面圆柱投影（ＦＣＰ）的基本概念、主要特点，深入地探讨了实现ＦＣＰ的一种光学器件——全景环形透镜（ＰＡＬ）的工作原理。ＰＡＬ具有线性投影关系、方向选择性、景深无限远等重要特性。优化设计了一个口径为３４ｍｍ的ＰＡＬ，模拟计算进一步证实了ＰＡＬ的上述特性。