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Details of Grant 

EPSRC Reference: GR/L49079/01
Title: A COMPUTER FOR THEORETICAL CHEMISTRY
Principal Investigator: Handy, Professor N
Other Investigators:
Hansen, Professor JP Amos, Dr R Gill, Professor PM
Researcher Co-Investigators:
Project Partners:
Department: Chemistry
Organisation: University of Cambridge
Scheme: Standard Research (Pre-FEC)
Starts: 01 January 1998 Ends: 31 December 2000 Value (£): 245,651
EPSRC Research Topic Classifications:
EPSRC Industrial Sector Classifications:
No relevance to Underpinning Sectors
Related Grants:
Panel History:  
Summary on Grant Application Form
The research proposed will be in the areas1. J. -P. Hansen and ANO : Statistical mechanics2. N. C. Handy : Density Functional Theory (new functionals, slater type orbitals)3. P. M. W. Gill : Density Functional Theory (coulomb problem, gridless)4. R. D. Amos : Density Functional Theory (excited states and molecules properties).
Key Findings
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Potential use in non-academic contexts
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Impacts
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Summary
Date Materialised
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Project URL:  
Further Information:  
Organisation Website: http://www.cam.ac.uk