Kinetic Models Evaluation in Methanol Production for Improved Process Design

The work aimed to evaluate kinetic models of methanol synthesis for improved design of the process. Graaf’s and Kubota’s models were chosen based on their goodness of fit to the respective kinetic data. Polymath was used to fit published experimental data to these kinetic models and evaluate kinetic parameters. The statistical results from Polymath show that Graaf’s model fits to the data well when the partial pressure of CO 2 in the feed was low and to a reasonable extent when it was high with R 2 0.83 and 0.52 respectively, with scattered residuals. Kubota’s model fits to the data well only when the partial pressure of CO 2 was high with R 2 0.59 with scattered residuals but poorly fits when it was low with R 2 0.106 (far from unity). The combined model was the best fit model and it described methanol synthesis kinetics most appropriately with R 2 0.88 irrespective of CO 2 partial pressure range.

[1]  Melanie A. McNeil,et al.  Methanol synthesis from hydrogen, carbon monoxide and carbon dioxide over a CuO/ZnO/Al2O3 catalyst: II. Development of a phenomenological rate expression , 1989 .

[2]  Marko Šetinc,et al.  Dynamics of a mixed slurry reactor for the three-phase methanol synthesis , 2001 .

[3]  Melanie A. McNeil,et al.  Methanol synthesis from hydrogen, carbon monoxide, and carbon dioxide over a CuO/ZnO/Al2O3 catalyst: I. Steady-state kinetics experiments , 1989 .

[4]  G. Froment,et al.  Chemical Reactor Analysis and Design , 1979 .

[5]  G. I. Lin,et al.  Fundamentals of Methanol Synthesis and Decomposition , 2003 .

[6]  E. Stamhuis,et al.  Kinetics of low-pressure methanol synthesis , 1988 .

[7]  M. Takagawa,et al.  Study on reaction rates for methanol synthesis from carbon monoxide, carbon dioxide, and hydrogen , 1987 .

[8]  M. Saito,et al.  Kinetic study of methanol synthesis from carbon dioxide and hydrogen , 2001 .

[9]  Richard G. Herman,et al.  Catalytic synthesis of methanol from COH2: IV. The effects of carbon dioxide , 1982 .

[10]  Aacm Beenackers,et al.  Intra-particle diffusion limitations in low-pressure methanol synthesis , 1990 .

[11]  Jens K. Nørskov,et al.  A Kinetic Model of Methanol Synthesis , 1995 .

[12]  Suk-Hwan Kang,et al.  Modeling of the Kinetics for Methanol Synthesis using Cu/ZnO/Al2O3/ZrO2 Catalyst: Influence of Carbon Dioxide during Hydrogenation , 2009 .

[13]  Jerzy Skrzypek,et al.  Kinetics of methanol synthesis over commercial copper/zinc oxide/alumina catalysts , 1991 .