| EPSRC Reference: |
GR/R06137/01 |
| Title: |
Computer Modelling of Liquid Crystals, Biological Systems, Electrochemical Processes, and Gas-Phase Clusters |
| Principal Investigator: |
Luckhurst, Professor GR |
| Other Investigators: |
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| Researcher Co-Investigators: |
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| Project Partners: |
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| Department: |
Sch of Chemistry |
| Organisation: |
University of Southampton |
| Scheme: |
JREI |
| Starts: |
23 November 2001 |
Ends: |
22 November 2004 |
Value (£): |
144,016
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| EPSRC Research Topic Classifications: |
| Gas & Solution Phase Reactions |
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| EPSRC Industrial Sector Classifications: |
| Chemicals |
Electronics |
| Creative Industries |
Pharmaceuticals and Biotechnology |
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| Related Grants: |
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| Panel History: |
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Summary on Grant Application Form |
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This proposal seeks to obtain a high-performance computational facility that will be used by seven research groups with overlapping scientific interests in computational chemistry. It will be utilised in the study of a range of new chemical problems in the areas of liquid crystals, solid-state NMR, and biological systems, as well as gas-phase electronic spectroscopy of small reactive molecules and complexes, and the study of electrode processes and solution chemistry. In all cases, the results will be compared with, and guide, experimental measurements. The proposed research requires significant computing resources: fast processing, large amounts of fast memory and disk space. This is no longer available with existing local resources and this is restricting the nature of our work. Indeed, the quality and range of what can be achieved by the applicants would be very much improved if a local dedicated facility were available.
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Key Findings |
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This information can now be found on Gateway to Research (GtR) http://gtr.rcuk.ac.uk
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Potential use in non-academic contexts |
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This information can now be found on Gateway to Research (GtR) http://gtr.rcuk.ac.uk
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Impacts |
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| Description |
This information can now be found on Gateway to Research (GtR) http://gtr.rcuk.ac.uk |
| Summary |
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| Date Materialised |
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Sectors submitted by the Researcher |
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This information can now be found on Gateway to Research (GtR) http://gtr.rcuk.ac.uk
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| Project URL: |
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| Further Information: |
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| Organisation Website: |
http://www.soton.ac.uk |