Impact of mathematical model selection on prediction of steady state and dynamic behaviour of a reactive distillation column

The objective of this paper was to compare the prediction of the equilibrium (EQ) and nonequilibrium (NEQ) models during safety analysis of a reactive distillation column focusing on the identification of hazardous situations or particular operability problems. The safety and operability analyses are based on application of the HAZOP procedure integrated with a mathematical model with the aim to determine the column response to deviations from normal operation conditions or during a nonstandard procedure, e.g. the start-up of the reactive distillation column. A significant part of the safety and operability problems analysis is the identification of multiple steady states and their stability. A reactive distillation column can in general exhibit multiple steady states which reduce the column operability and controllability during perturbations of the manipulated variables and particularly during the start-up and shut down procedures. The EQ and NEQ models were compared focusing on prediction of the multiple steady states phenomenon and of the consequences which can result from this phenomenon.

[1]  Rajamani Krishna,et al.  Comparison of equilibrium stage and nonequilibrium stage models for reactive distillation , 2000 .

[2]  Ľudovít Jelemenský,et al.  Impact of mass transfer coefficient correlations on prediction of reactive distillation column behaviour , 2008 .

[3]  Ulrich Hoffmann,et al.  Kinetics of methyl tertiary butyl ether liquid phase synthesis catalyzed by ion exchange resin—I. Intrinsic rate expression in liquid phase activities , 1990 .

[4]  Milan Kubíček,et al.  Book-Review - Computational Methods in Bifurcation Theory and Dissipative Structures , 1983 .

[5]  Rajamani Krishna,et al.  Modelling reactive distillation , 2000 .

[6]  J. Reavell,et al.  Institution of Chemical Engineers , 1930 .

[7]  R. Krishna,et al.  The Maxwell-Stefan approach to mass transfer , 1997 .

[8]  Rajamani Krishna,et al.  Multiple solutions in reactive distillation for methyl tert-butyl ether synthesis , 1993 .

[9]  Ross Taylor,et al.  A nonequilibrium stage model of multicomponent separation processes. Part I: Model description and method of solution , 1985 .

[10]  Robert S. Huss,et al.  Multiple steady states in reactive distillation: kinetic effects , 2002 .

[11]  Milan Kubicek,et al.  Algorithm 502: Dependence of Solution of Nonlinear Systems on a Parameter [C5] , 1976, TOMS.

[12]  Kazuhiko Suzuki,et al.  Computer-aided operability study , 1996 .

[13]  Günter Wozny,et al.  Simulation and experimental analysis of operational failures in a distillation column , 2002 .

[14]  H. Kooijman,et al.  The ChemSep book. , 2001 .

[15]  Ross Taylor,et al.  A nonequilibrium stage model of multicomponent separation processes. Part II: Comparison with experiment , 1985 .

[16]  Norman N. Li Separation and Purification Technology , 1992 .

[17]  Eugeny Y. Kenig,et al.  Modelling of reactive separation processes: reactive absorption and reactive distillation , 2003 .

[18]  R. Hughes,et al.  The chemical engineering journal , 1979 .

[19]  Ross Taylor,et al.  Multicomponent mass transfer , 1993 .

[20]  山田 道夫 M. Kubicek and M. Marek: Computational Methods in Bifurcation Theory and Dissipative Structures, Springer-Verlag, New York and Berlin, 1983, xii+244ページ, 24.5×16cm, DM108 (12,960円) (Springer Series in Computational Physics). , 1985 .

[21]  E. Gilles,et al.  Multiple Steady States in a Reactive Distillation Column for the Production of the Fuel Ether TAME I. Theoretical Analysis , 1998 .

[22]  E. Gilles,et al.  Steady-state multiplicities in reactive distillation columns for the production of fuel ethers MTBE and TAME: theoretical analysis and experimental verification , 1999 .

[23]  J. Dugdale The Electrical Properties of Disordered Metals: Comparison with experiment , 1995 .

[24]  Frank Pearson Lees,et al.  Loss prevention in the process industries : hazard identification, assessment, and control , 1980 .

[25]  城塚 正,et al.  Chemical Engineering Scienceについて , 1962 .

[26]  Ian T. Cameron,et al.  A prototype expert system for hazard and operability studies , 1989 .

[27]  Igor Schreiber,et al.  Chaotic Behaviour of Deterministic Dissipative Systems , 1991 .

[28]  Kai Sundmacher,et al.  Multiple Steady States in a Reactive Distillation Column for the Production of the Fuel Ether TAME Part II: Experimental Validation , 1998 .

[29]  A. Molnár,et al.  SOME CONSIDERATIONS FOR SAFETY ANALYSIS OF CHEMICAL REACTORS , 2005 .

[30]  J. Markoš,et al.  Safety analysis and risk identification for a tubular reactor using the HAZOP methodology , 2006 .