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Details of Grant 

EPSRC Reference: GR/M53974/01
Title: A MID-RANGE COMPUTER FOR SIMULATION STUDIES IN CHEMISTRY
Principal Investigator: Hillier, Professor I
Other Investigators:
Masters, Professor AJ Garner, Professor C D Burton, Dr NA
Connor, Professor JNL
Researcher Co-Investigators:
Project Partners:
Department: Chemistry
Organisation: Victoria University of Manchester, The
Scheme: Standard Research (Pre-FEC)
Starts: 01 September 1999 Ends: 31 August 2002 Value (£): 203,179
EPSRC Research Topic Classifications:
Biological & Medicinal Chem. Catalysis & Applied Catalysis
Complex fluids & soft solids
EPSRC Industrial Sector Classifications:
Aerospace, Defence and Marine Manufacturing
Chemicals Pharmaceuticals and Biotechnology
Transport Systems and Vehicles No relevance to Underpinning Sectors
Related Grants:
Panel History:  
Summary on Grant Application Form
The output from nine EPSRC supported research programmes will be enhanced by the mid-range computer hardware requested in this application. All are centred on the development and application of computational and theoretical chemistry techniques, but their support is spread across a broad area of EPSRC programmes: Chemistry, Biomolecular Sciences, Physics, Mathematics and Combustion. Chemical reactivity is a recurring theme and spans kinetics and dynamics of radical reactions, solid state catalysis, combustion chemistry and enzyme catalysis. The properties of liquid crystals are also studied. The interactions with experimentalists is central to these projects.
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