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Aris-Taylor dispersion in tubes with dead ends

机译:Aris-Taylor分散液在有死角的管中

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摘要

This paper deals with transport of point Brownian particles in a cylindrical tube with dead ends in the presence of laminar flow of viscous fluid in the cylindrical part of the tube (Poiseuille flow). It is assumed that the dead ends are identical and are formed by spherical cavities connected to the cylindrical part of the tube by narrow necks. The focus is on the effective velocity and diffusivity of the particles as functions of the mean flow velocity and geometric parameter of the tube. Entering a dead end, the particle interrupts its propagation along the tube axis. Later it returns, and the axial motion continues. From the axial propagation point of view, the particle entry into a dead end and its successive return to the flow is equivalent to the particle reversible binding to the tube wall. The effect of reversible binding on the transport parameters has been previously studied assuming that the particle survival probability in the bound state decays as a single exponential. However, this is not the case when the particle enters a dead end, since escape from the dead end is a non-Markovian process. Our analysis of the problem consists of two steps: First, we derive expressions for the effective transport parameters in the general case of non-Markovian binding. Second, we find the effective velocity and diffusivity by substituting into these expressions known results for the moments of the particle lifetime in the dead end [L. Dagdug, A. M. Berezhkovskii, Yu. A. Makhnovskii, and V. Yu. Zitserman, J. Chem. Phys. 141, 224712 (2007)] [] []. To check the accuracy of our theory, we compare its predictions with the values of the effective velocity and diffusivity obtained from Brownian dynamics simulations. The comparison shows excellent agreement between the theoretical predictions and numerical results.
机译:本文讨论了在具有死角的圆柱管中,在管的圆柱部分中存在层流(泊流)时,点布朗粒子的传输。假定死角是相同的,并且由球形腔形成,球形腔通过狭窄的颈部连接到管子的圆柱形部分。重点是作为管道平均流速和几何参数的函数的粒子的有效速度和扩散率。进入死角时,粒子会中断其沿管轴的传播。稍后返回,并且轴向运动继续。从轴向传播的角度来看,颗粒进入死角并连续返回流中等效于颗粒可逆地结合到管壁上。可逆结合对传输参数的影响先前已经进行了研究,假设结合状态下的粒子存活概率以单指数衰减。但是,当粒子进入死角时情况并非如此,因为从死角逃逸是非马尔可夫过程。我们对该问题的分析包括两个步骤:首先,在非马尔可夫绑定的一般情况下,我们得出有效传输参数的表达式。其次,通过将已知结果代入死角中的粒子寿命时刻,将有效速度和扩散率代入这些表达式中,即可得出有效速度和扩散率。 Dagdug,A。M. Berezhkovskii,于。 A. Makhnovskii和V. Yu。 Zitserman,J.Chem。物理141,224712(2007)] [] []。为了检验我们理论的准确性,我们将其预测结果与从布朗动力学模拟获得的有效速度和扩散率值进行了比较。比较表明理论预测与数值结果之间具有极好的一致性。

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