胶束色谱过程的数学理论与模拟方法-化学工程专业论文.docxVIP

浙江大学硕士论文摘要 浙江大学硕士论文 摘要 当多个流动相流过多孔介质时，溶质在多孔介质上吸附的同时，在流动相之 问发生分配，这一过程称为多流动相色谱过程。如果溶质的吸附或分配遵循非线 性的平衡规律，溶质的运动将呈现出典型的非线性波动特征：物质在运动中可能 自发形成陡峭的浓度变化区域一浓度激波，从而给理论分析和数值模拟带来困 难。胶束色谱作为多流动相色谱过程的一种，近些年来得到了飞速的发展并广泛 应用于分析领域。然而，目前对于多流动相色谱过程非线性特征和波动图像还很 少有具体的理论分析。本文对胶束色谱过程进行了研究，以相干理论为基础，结 合特征线法和同胚变换方法，分别研究了单组分、双组分、多组分胶束色谱过程 的各种情况并对不同过程下的色谱图像进行了模拟。通过理论分析和数值模拟， 建立了求解多流动相色谱过程的典型方法，首次得到了各种情况下胶束色谱过程 的波动图像，阐明了各种色谱图像的形成机理和物理意义，揭示了流动、萃取、 吸附对色谱过程的耦合作用。研究表明，随表面活性剂浓度的增加，色谱过程可 能到达反转点，在反转点处，对应的两种溶质组分的运动顺序发生改变。这一方 法物理概念清晰，数学推导严密，可用于一般多相多组分色谱过程的求解。 关键词：色谱，胶束，多相，非线性波，相干性 浙江大学硕士论文ABSTRACT 浙江大学硕士论文 ABSTRACT When multi mobile phases flow through the porous media the solutes are adsorbed on the stationary phase and partitioned in the mobile phases simultaneously, which is called multi mobile phase chromatographic process．In case of the adsorption or partition isotherm is nonlinear,the dynamic behavior ofthe chromatography will be characterized by the propagation of nonlinear wave，which means the concentration wave may selfsharpen to the abrupt concentration discontinuity,i．e．shock wave．The numerical oscillation then occurs in simulation of dynamic coupling multiphase multicomponent chromatography due to the existence of the concentration shock waves．In recent years micellar chromatography,as one of the multi mobile phase chromatographic processes，has developed rapidly and been used widely in the analytical chemistry．However,there is little theoretical analysis on the multi mobile phase chromatography SO far．The micellar chromatographic process is thoroughly researched in this thesis．The approach is based on the theory of coherence and combined with method of characteristics and homeomorphism transform．The various cases of micellar chromatographic process of single component，two components and multicomponent are analyzed relatively,and the chromatographic profiles of different processes are simulated．The typical method for solving the multi mobile phase chromatographic process is established