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Details of Grant 

EPSRC Reference: GR/M78069/01
Title: RENEWAL PROPOSAL FOR THE SUPPORT OF CCP5: THE COMPUTER SIMULATION OF CONDENSED PHASES (1999 - 2002)
Principal Investigator: Durham, Dr P
Other Investigators:
Heyes, Professor DM
Researcher Co-Investigators:
Project Partners:
Department: Computational Science & Engineering
Organisation: STFC Laboratories (Grouped)
Scheme: Standard Research (Pre-FEC)
Starts: 01 October 1999 Ends: 30 September 2002 Value (£): 60,284
EPSRC Research Topic Classifications:
EPSRC Industrial Sector Classifications:
Manufacturing Chemicals
Pharmaceuticals and Biotechnology No relevance to Underpinning Sectors
Related Grants:
Panel History:  
Summary on Grant Application Form
In this project our activity will be to provide technical support and training for the UK atomistic simulation community, and in addition to focus on three emerging areas of particle simulation application. Namely,a) The inclusion of 'on-the-fly' quantum mechanical effects in atomistic simulations.b) The application of atomistic simulation to mesoscale systems.c) The development of particle-based coarse-grained mesoscale simulation techniques to model, for example, colloids up to powders.These will be achieved by:i) Organising technical workshops, larger conferences, sponsoring collaborations and academic visitors from abroad.ii) Sponsoring the 'Simulation Spring School' held each year.iii) At Daresbury, develop and support the MD package DL-POLY and solid state codes.iv) Production of the CCP5 Newsletter and provide other electronic services.
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