Details of Grant 

EPSRC Reference:	GR/R55269/02
Title:	UK Computational Chemistry Facility UKCCF
Principal Investigator:	Dyke, Professor J
Other Investigators:	Balint-Kurti, Professor G Heyes, Professor DM Robb, Professor M A Allan, Professor NL Williams, Professor I
Researcher Co-Investigators:
Project Partners:
Department:	Chemistry
Organisation:	Imperial College London
Scheme:	Standard Research (Pre-FEC)
Starts:	01 January 2004	Ends:	30 November 2005	Value (£):	1,002,573
EPSRC Research Topic Classifications:	Gas & Solution Phase Reactions
EPSRC Industrial Sector Classifications:	Chemicals Environment Pharmaceuticals and Biotechnology No relevance to Underpinning Sectors
Related Grants:
Panel History:
Summary on Grant Application Form
The research activity covered by our project covers a broad range computational chemistry, involving at least sixty UK users groups. Application areas include Molecular Spectroscopy, Atmospheric Chemistry, Molecular Dynamics and Potential Energy Surfaces, Inorganic and Organic Structure and Reactivity, and finally in Materials, Condensed Phases and Interfaces. The UK Computational Chemistry Facility (UKCCF) supplies a very broad range of computational chemistry software with the types of user identified above. The details of the science programme are included in the Case for Support. The software portfolio will be updated as required to provide a range of state-of-the art codes for users.
Key Findings
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Potential use in non-academic contexts
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Impacts
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Sectors submitted by the Researcher
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Project URL:
Further Information:
Organisation Website:	http://www.imperial.ac.uk