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Numerical Simulation of Ion Drift within Ion Mobility Spectrometers in High Peclet Conditions using FEM Techniques

机译:高Peclet条件下离子迁移谱仪中离子漂移的有限元数值模拟

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The goal of this paper is to model and simulate the transport of ions through a miniaturised drift tube of ion mobility spectrometer (IMS). In the first part of this work we test and compare three numerical methods to solve the transient diffusion-advection equation in high Peclet conditions. These methods are the following: Streamline upwind Petrov Galerkin (SUPG), the modified-PDE (MPDE) and the finite calculus method (FIC). In the second part we use the last two numerical methods to study ion transport in a one-dimensional IMS model. Ion peak broadening effects, namely coulombic repulsion, diffusion, transport of two ionic species, have been explored for different initial conditions.
机译:本文的目的是对离子通过离子迁移谱仪(IMS)的小型漂移管的传输进行建模和仿真。在这项工作的第一部分中,我们测试并比较了三种数值方法,以解决高Peclet条件下的瞬态扩散对流方程。这些方法如下:简化顺风Petrov Galerkin(SUPG),改进的PDE(MPDE)和有限演算方法(FIC)。在第二部分中,我们使用后两种数值方法研究一维IMS模型中的离子迁移。对于不同的初始条件,已经研究了离子峰展宽效应,即库仑排斥,扩散,两种离子物质的迁移。

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