基于能思-普朗克、位移电流和Navier-Stokes方程的电膜系统超极限传质随时间的二维模型

IF 1.9 Q2 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Computation Pub Date : 2023-10-16 DOI:10.3390/computation11100205
Aminat Uzdenova
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引用次数: 0

摘要

电膜工艺是电渗析装置、纳米和微流体装置功能的基础,其范围正在稳步扩大。决定膜系统有效性的主要方面之一是选择最佳的电气模式。这个问题的解决,连同实验研究,需要各种电模式下离子输运过程的理论分析工具。能斯特-普朗克-泊松和纳维-斯托克斯(NPP-NS)方程组被广泛用于描述与电对流发展相关的超极限传质。本文提出了一种用位移电流方程描述膜系统电模式的新方法。位移电流的方程使模拟电流动力学模式成为可能,其中电场由给定的电流密度决定。基于能思-普朗克、位移电流和Navier-Stokes (NPD-NS)方程组,建立了直流电流模式下离子交换膜表面扩散层电对流过限传质模型。基于NPP-NS和NPD-NS方程的数学模型,用于描述膜系统中相同的传质物理情况,但在数值解的特性上有所不同。在过限电流下,基于NPP-NS方程的方法比NPD-NS方程方法的时间步长更小,达到了数值解的精度要求。与基于NPP-NS方程的模型相比,基于NPD-NS方程的模型在平行膜表面边界处的电流密度计算精度更高。
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Time-Dependent Two-Dimensional Model of Overlimiting Mass Transfer in Electromembrane Systems Based on the Nernst–Planck, Displacement Current and Navier–Stokes Equations
Electromembrane processes underlie the functioning of electrodialysis devices and nano- and microfluidic devices, the scope of which is steadily expanding. One of the main aspects that determine the effectiveness of membrane systems is the choice of the optimal electrical mode. The solution of this problem, along with experimental studies, requires tools for the theoretical analysis of ion-transport processes in various electrical modes. The system of Nernst–Planck–Poisson and Navier–Stokes (NPP–NS) equations is widely used to describe the overlimiting mass transfer associated with the development of electroconvection. This paper proposes a new approach to describe the electrical mode in a membrane system using the displacement current equation. The equation for the displacement current makes it possible to simulate the galvanodynamic mode, in which the electric field is determined by the given current density. On the basis of the system of Nernst–Planck, displacement current and Navier–Stokes (NPD–NS) equations, a model of the electroconvective overlimiting mass transfer in the diffusion layer at the surface of the ion-exchange membrane in the DC current mode was constructed. Mathematical models based on the NPP–NS and NPD–NS equations, formulated to describe the same physical situation of mass transfer in the membrane system, differ in the peculiarities of numerical solution. At overlimiting currents, the required accuracy of the numerical solution is achieved in the approach based on the NPP–NS equations with a smaller time step than the NPD–NS equation approach. The accuracy of calculating the current density at the boundaries parallel to the membrane surface is higher for the model based on the NPD–NS equations compared to the model based on the NPP–NS equations.
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来源期刊
Computation
Computation Mathematics-Applied Mathematics
CiteScore
3.50
自引率
4.50%
发文量
201
审稿时长
8 weeks
期刊介绍: Computation a journal of computational science and engineering. Topics: computational biology, including, but not limited to: bioinformatics mathematical modeling, simulation and prediction of nucleic acid (DNA/RNA) and protein sequences, structure and functions mathematical modeling of pathways and genetic interactions neuroscience computation including neural modeling, brain theory and neural networks computational chemistry, including, but not limited to: new theories and methodology including their applications in molecular dynamics computation of electronic structure density functional theory designing and characterization of materials with computation method computation in engineering, including, but not limited to: new theories, methodology and the application of computational fluid dynamics (CFD) optimisation techniques and/or application of optimisation to multidisciplinary systems system identification and reduced order modelling of engineering systems parallel algorithms and high performance computing in engineering.
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