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Details of Grant 

EPSRC Reference: GR/R94978/01
Title: Determination by vibrational spectroscopy of the absorption sites of hydrogen on supported metal catalysts
Principal Investigator: Parker, Dr SF
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Department: ISIS Pulsed Neutron & Muon Source
Organisation: STFC Laboratories (Grouped)
Scheme: Standard Research (Pre-FEC)
Starts: 31 March 2003 Ends: 30 May 2006 Value (£): 69,643
EPSRC Research Topic Classifications:
Catalysis & Applied Catalysis Chemical Structure
EPSRC Industrial Sector Classifications:
Chemicals No relevance to Underpinning Sectors
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Summary on Grant Application Form
SummaryDescribe the proposed research in about 200 words.Hydrogen is a key reactant in many industrial processes. However, the adsorption sites occupied by hydrogen on supported metal catalysts are poorly characterised. This is important because there is evidence that the different sites have different reactivities. Proton NMR can detect the presence of hydrogen but can only indirectly distinguish between on-top and multiply-bonded hydrogen. Vibrational spectroscopy is sensitive to the local environment so potentially offers a solution to the problem. However, infrared and Raman spectroscopies have proven unable to deliver on this promise because of problems of spectral black-out by the support (except for the on-top species) and insensitivity and/or sample fluorescence respectively. Vibrational inelastic neutron scattering (INS) spectroscopy does not suffer from these problems and is particularly suited to detection of the low energy modes of multply-bonded hydrogen species. Very recent preliminary results show that this is feasible. It is proposed to exploit the complementarity of in-situ infrared spectroscopy and INS spectroscopy to characterise the high and low frequency modes respectively. Determination of the type of each site will be made by a combination of selective desorption and site poisoning. INS spectroscopy is intrinsically quantitative so it should be possible to determine the relative proportions of the different sites directly from the INS spectra. This proposal is particularly timely because the best INS spectrometer in the world
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