Two-dimensional non-equilibrium model of liquid chromatography: Analytical solutions and moment analysis

Abstract This paper presents a set of semi-analytical solutions and analytical moments for two-dimensional lumped kinetic model (LKM) describing non-equilibrium solute transport through a chromatographic column of cylindrical geometry. General solutions are derived for the solute concentration by successive implementation of finite Hankel and Laplace transforms assuming different sets of boundary conditions and linear sorption kinetic process. For further analysis, statistical temporal moments are derived from the Laplace transformed solutions. The current solutions extend and generalize the recent solutions of two-dimensional equilibrium dispersive transport model (EDM). Typical examples of concentration profiles and moments resulting from different sets of initial and inlet conditions are presented and briefly discussed. The derived semi-analytical solutions for concentration profiles and analytical moments are validated against the numerical results of a high resolution finite volume scheme. Good agreements in the results verify the correctness of analytical solutions and accuracy of the proposed numerical algorithm.

[1]  Douglas M. Ruthven,et al.  Principles of Adsorption and Adsorption Processes , 1984 .

[2]  Andreas Seidel-Morgenstern,et al.  Analysis and numerical investigation of two dynamic models for liquid chromatography , 2013 .

[3]  E. Kucera,et al.  Contribution to the theory of chromatography: linear non-equilibrium elution chromatography. , 1965, Journal of chromatography.

[4]  D. Gelbin,et al.  Weighted moments and the pore-diffusion model , 1980 .

[5]  Shamsul Qamar,et al.  Efficient and accurate numerical simulation of nonlinear chromatographic processes , 2011, Comput. Chem. Eng..

[6]  John Crank,et al.  The Mathematics Of Diffusion , 1956 .

[7]  A. Rodrigues,et al.  Perturbation chromatography with inert core adsorbent: Moment solution for two-component nonlinear isotherm adsorption , 2011 .

[8]  Vedat Batu,et al.  A generalized two-dimensional analytical solution for hydrodynamic dispersion in bounded media with the first-type boundary condition at the source , 1989 .

[9]  A. Lenhoff Significance and estimation of chromatographic parameters , 1987 .

[10]  A. Seidel-Morgenstern,et al.  Analytical solution of a two-dimensional model of liquid chromatography including moment analysis , 2014 .

[11]  Miroslav Kubín,et al.  Beitrag zur Theorie der Chromatographie , 1965 .

[12]  D. Gelbin,et al.  Heat and mass transfer in packed beds—IV: Use of weighted moments to determine axial dispersion coefficients , 1979 .

[13]  Andreas Seidel-Morgenstern,et al.  Analytical solutions and moment analysis of chromatographic models for rectangular pulse injections. , 2013, Journal of chromatography. A.

[14]  Maria do Carmo Coimbra,et al.  A moving finite element method for the solution of two-dimensional time-dependent models , 2003 .

[15]  A. Rodrigues,et al.  Analytical Breakthrough Curves for Inert Core Adsorbent with Sorption Kinetics (R&D Note) , 2003 .

[16]  K. Miyabe Surface diffusion in reversed-phase liquid chromatography using silica gel stationary phases of different C1 and C18 ligand densities. , 2007, Journal of chromatography. A.

[17]  G. Guiochon,et al.  Influence of the modification conditions of alkyl bonded ligands on the characteristics of reversed-phase liquid chromatography. , 2000, Journal of chromatography. A.

[18]  W. J. Alves,et al.  Analytical solutions of the one-dimensional convective-dispersive solute transport equation , 1982 .

[19]  Xiaoxian Zhang,et al.  An in situ method to measure the longitudinal and transverse dispersion coefficients of solute transport in soil , 2006 .

[20]  G. Carta Exact analytic solution of a mathematical model for chromatographic operations , 1988 .

[21]  Georges Guiochon,et al.  Measurement of the parameters of the mass transfer kinetics in high performance liquid chromatography , 2003 .

[22]  D. Do,et al.  Applied Mathematics and Modeling for Chemical Engineers , 1994 .

[23]  M. V. Genuchten,et al.  Analytical Solutions for Solute Transport in Three‐Dimensional Semi‐infinite Porous Media , 1991 .

[24]  Andreas Seidel-Morgenstern,et al.  Analytical solutions and moment analysis of general rate model for linear liquid chromatography , 2014 .

[25]  A. Rodrigues,et al.  Modeling breakthrough and elution curves in fixed bed of inert core adsorbents: analytical and approximate solutions , 2004 .

[26]  Eungyu Park,et al.  Analytical solutions of contaminant transport from finite one-, two-, and three-dimensional sources in a finite-thickness aquifer. , 2001, Journal of contaminant hydrology.

[27]  J. C. Jaeger,et al.  Operational Methods in Applied Mathematics , 2000 .

[28]  I. N. Sneddon The use of integral transforms , 1972 .

[29]  Jui-Sheng Chen,et al.  Exact analytical solutions for two-dimensional advection–dispersion equation in cylindrical coordinates subject to third-type inlet boundary condition , 2011 .

[30]  Anita M. Katti,et al.  Fundamentals of Preparative and Nonlinear Chromatography , 1994 .

[31]  Georges Guiochon,et al.  Preparative liquid chromatography. , 2002, Journal of chromatography. A.

[32]  Jui-Sheng Chen,et al.  Analytical solutions to two-dimensional advection–dispersion equation in cylindrical coordinates in finite domain subject to first- and third-type inlet boundary conditions , 2011 .

[33]  Miroslav Kubín,et al.  Beitrag zur theorie der chromatographie II. Einfluss der diffusion ausserhalb und der adsorption innerhalb des sorbens-korns , 1965 .

[34]  Vedat Batu,et al.  A generalized two‐dimensional analytical solute transport model in bounded media for flux‐type finite multiple sources , 1993 .

[35]  J. Smith,et al.  Adsorption rate constants from chromatography , 1968 .

[36]  Motoyuki Suzuki NOTES ON DETERMINING THE MOMENTS OF THE IMPULSE RESPONSE FROM THE BASIC TRANSFORMED EQUATIONS , 1974 .

[37]  K. Miyabe,et al.  Moment analysis of chromatographic behavior in reversed-phase liquid chromatography. , 2009, Journal of separation science.

[38]  Concentration dependence of lumped mass transfer coefficients linear versus non-linear chromatography and isocratic versus gradient operation. , 2003, Journal of chromatography. A.

[39]  Roberto Cianci,et al.  Some analytical solutions for two-dimensional convection-dispersion equation in cylindrical geometry , 2006, Environ. Model. Softw..