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EPSRC Reference: GR/R39566/01
Title: Supercritical CO2: Heterogeneous Adsorption and Reaction.
Principal Investigator: Anderson, Professor J
Other Investigators:
Researcher Co-Investigators:
Project Partners:
Department: College of Life Sciences
Organisation: University of Dundee
Scheme: Standard Research (Pre-FEC)
Starts: 01 October 2001 Ends: 30 September 2004 Value (£): 59,276
EPSRC Research Topic Classifications:
Catalysis & Applied Catalysis Chemical Synthetic Methodology
EPSRC Industrial Sector Classifications:
Chemicals No relevance to Underpinning Sectors
Related Grants:
GR/R41637/01
Panel History:  
Summary on Grant Application Form
The use of supercritical C02 (scC02) as a benign solvent and in homogeneous catalysis has received a great deal of attention in academic and industrial laboratories world-wide. In contrast, there has been little published work on the use of scC02 as a reactant and in heterogeneous catalysis. The aim of this work is to gain a fundamental understanding of the mechanism of scC02 activation on supported metal catalysts. The foundations for this new subject lie In study of the thermodynamics and kinetics of sc;C02 adsorption and in the nature of the molecular interaction between scC02 and the catalyst surface. Additionally, remarkable effects of scC02 on the co-adsorption of H20IH2 have recently been observed, e.g. the action of scC02 as a desiccant. These phenomena will be investigated by (1) measuring mufticomponent adsorption isotherms varying pressure from sub- to super-critical, (2) in-situ high pressure IR spectroscopy to identify surface species and probe the interactions, and (3) molecular dynamics / Monte Carlo simulations of surface adsorption and activation. Further, the microkinetics of scC02 activation will be studied with the aid of a model reaction where adsorption phenomena and surface interaction are known to play a major role in the reaction mechanism. Hence, methanol synthesis from C02/H2 is severely inhibited by competitive adsorption of the byproduct H20.
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Organisation Website: http://www.dundee.ac.uk