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| Name: |
Professor TW Keal |
| Organisation: |
STFC Laboratories (Grouped) |
| Department: |
Scientific Computing Department |
| Current EPSRC-Supported Research
Topics: |
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Catalysis & Applied Catalysis
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Chemical Structure
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Computer Sys. & Architecture
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Mathematical Analysis
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Parallel Computing
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Software Engineering
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| Current EPSRC Support |
| EP/X035859/1 | Materials Chemistry HEC Consortium (MCC) | (C) |
| EP/W014378/1 | Predictive multiscale free energy simulations of hybrid transition metal catalysts | (P) |
| EP/W026775/1 | Particles At eXascale on High Performance Computers (PAX-HPC) | (C) |
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| Previous EPSRC Support |
| EP/V001507/1 | Materials and Molecular Modelling Exascale Design and Development Working Group | (C) |
| EP/R001847/1 | Transition metal controlled nitrogen chemistry in zeolite and protein environments using a unified quantum embedding model | (P) |
| EP/P022235/1 | Surface and Interface Toolkit for the Materials Chemistry Community | (C) |
| EP/K038419/1 | Scalable Quantum Chemistry with Flexible Embedding Stage 2 | (C) |
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Key: (P)=Principal Investigator, (C)=Co-Investigator, (R)=Researcher Co-Investigator
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