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EPSRC Reference: EP/Z530657/1
Title: Goldilocks convergence tools and best practices for numerical approximations in Density Functional Theory calculations
Principal Investigator: Montanari, Dr B
Other Investigators:
Elena, Dr A Basak, Dr S
Researcher Co-Investigators:
Project Partners:
Durham, University of University of York
Department: Scientific Computing Department
Organisation: STFC Laboratories (Grouped)
Scheme: Standard Research TFS
Starts: 01 January 2024 Ends: 31 December 2026 Value (£): 378,233
EPSRC Research Topic Classifications:
Software Engineering
EPSRC Industrial Sector Classifications:
No relevance to Underpinning Sectors
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