Numerical Approximation of the Nonequilibrium Model of Gradient Elution Chromatography Considering Linear and Nonlinear Solvent Strength Models

[Image: see text] In both linear and nonlinear chromatography, the lumped kinetic model is a suitable model for predicting elution bands when appropriate equilibrium functions and mass transfer coefficients are accessible. This model also works well in the case of gradient elution chromatography if variations in the equilibrium functions due to changes in the mobile phase composition are known. The rational selection of an optimum gradient is explored in this study from three different perspectives using the lumped kinetic model. Elution profiles generated by using (a) linear solvent strength, (b) quadratic solvent strength, and (c) power law are investigated. The effectiveness and reliability of the suggested numerical approach, utilizing the flux-limiting finite volume method, are demonstrated through numerical simulations. The impacts of axial dispersion, nonlinearity coefficient, Henry’s constant, mass transfer coefficient, and gradient parameters are studied on single and two-component elution profiles.