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Researcher Details
 
Name: Professor NL Allan
Organisation: University of Bristol
Department: Chemistry
Current EPSRC-Supported Research Topics:
Condensed Matter Physics

Current EPSRC Support
EP/P022308/1 Beyond Classical Molecular Dynamics: Developing DL_POLY(P)
EP/M022617/1 CCP5: The Computer Simulation of Condensed Phases(P)
Previous EPSRC Support
EP/L018616/1 PACIFIC - Providing a Nuclear Fuel Cycle in the UK for Implementing Carbon Reductions(C)
EP/K030302/1 Energy and the Physical Sciences:Beta-enhanced thermionic energy converters and nuclear batteries employing nanostructured diamond electrodes(C)
EP/H043292/1 Experiment and modelling of the growth of CVD diamond: towards a detailed understanding of growth chemistry and mechanisms(C)
EP/H012230/1 Understanding the chemistry of ceramic materials under irradiation(P)
EP/F000219/1 Development of a wavefunction-based electronic structure method for Monte-Carlo simulation of fluids(C)
EP/D504929/1 A National Service for Computational Chemistry Software(C)
GR/S84415/01 Simulation on the Edge(C)
GR/R55269/02 UK Computational Chemistry Facility UKCCF(C)
GR/R85952/01 Ultra-thin Film formation: New Theoretical Approaches and Application to Ceramics(P)
GR/R55269/01 UK Computational Chemistry Facility UKCCF(C)
GR/N35328/01 DEPOSITION AND CHARACTERISATION OF THIN FILMS OF CRYSTALLINE CARBON PHOSPHIDE(C)
GR/N29389/01 UNDERSTANDING THIN FILM GROWTH THROUGH SIMULATION - A HYBRID KINETIC MONTE CARLO/MOLECULAR DYNAMICS METHOD(P)
GR/M53899/01 POLAR SOLIDS AT HIGH TEMPERATURES: NEW APPROACHES TO MODELLING DISORDER(P)
GR/M34799/01 JREI: COMPUTATIONAL CHEMISTRY OF MOLECULES, MATERIALS AND ENZYMES(P)
GR/L04931/01 A CONSORTIUM FOR MPP SUPERCOMPUTING IN MATERIALS CHEMISTRY(C)
GR/L31340/01 ELECTRONIC STRUCTURE AND CHEMICAL PROCESSES IN MOLECULES AND SOLIDS(P)
GR/L11762/01 A FACILITY FOR COMPUTATIONAL CHEMISTRY IN THE UNITED KINGDOM(C)
GR/K95420/01 COMPUTATIONAL STUDY OF OXYFLUORIDE AND RELATED HIGH TEMPERATURE SUPERCONDUCTORS(C)
GR/K05979/01 POLAR SOLIDS AT HIGH TEMPERATURES AND PRESSURES - THERMODYNAMICS, KINETICS AND MECHANISMS(P)
GR/K48686/01 MOLECULAR MODELLING AND ELECTRONIC STRUCTURE OF MOLECULES COMPLEXES AND SOLIDS(C)
GR/K41625/01 A CONSORTIUM FOR MPP SUPERCOMPUTING IN MATERIALS CHEMISTRY(C)
GR/J31803/01 ELECTRONIC STRUCTURE AND PROCESSES IN MOLECULES, COMPLEXES AND SOLIDS(C)
GR/G38559/01 SURFACES STUDIES OF TERNARY AND MORE COMPLEX OXIDE CATALYST MATERIALS(C)
GR/H07160/01 MOLECULAR MODELLING AND ELECTRONIC STRUCTURE OF MOLECULES, CLUSTERS, COMPLEXES AND SOLIDS(C)
Key: (P)=Principal Investigator, (C)=Co-Investigator, (R)=Researcher Co-Investigator