Distributed CSE Support projects

Below is a summary of the Distributed CSE Support projects that were approved at the previous rounds of funding. Individual projects will be listed once they are under contract and/or underway.

Further details of the service can be found here.

Jan'10 deadline

5 proposals for a total of 60 person-months effort were received. 2 proposals for a total of 18 person-months effort were recommended for funding.

Sep'09 deadline

11 proposals for a total of 233 person-months effort were received. 8 proposals for a total of 90 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Prof C Richard Catlow (UCL) Optimising the performance of the VASP code on HECToR 12
Dr Jon Hill (Imperial) Improving load balancing and parallel partitioning in ICOM 12
Dr Andrew Horsfield (Imperial) Metal Conquest: efficient simulation of metals on petaflop computers 12
Dr Gernot Plank (Oxford) Scalability optimization for largescale in-silico simulations of cardiac bioelectric activity 8
Dr Ilian Todorov (Science and Technology Facilities Council - Daresbury Laboratory) Improvements for multi-core performance and domain choice within DL_POLY_3 10
Prof Wyn Williams (Edinburgh) Micromagnetic modelling of naturally occurring magnetic mineral systems 6

June'09 deadline

5 proposals for a total of 74 person-months effort were received. 2 proposals for a total of 12 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Dr Ben Slater (UCL) Improving the scalability of CP2K on multi-core systems 6
Mr Terry Sloan (Edinburgh Parallel Computing Centre) SPRINTing with HECToR 6

Mar'09 deadline

6 proposals for a total of 101 person-months effort were received. 5 proposals for a total of 62 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Prof Dario Alfè (UCL) Coupling molecular dynamics to CASINO 18
Prof M Merlyne De Souza (Sheffield) Improving the performance of GWW 16
Dr Graham Mann (Leeds) Global high resolution aerosol simulations for climate and air quality 4
Dr Colin Roach (UKAEA) Fast Fourier Transformations for gyrokinetic plasma simulations 6
Dr Ilian Todorov (Science and Technology Facilities Council - Daresbury Laboratory) Implementing dynamic load balancing and rigid body dynamics within DL_POLY_3 18

Dec'08 deadline

12 proposals for a total of 220 person-months effort were received. 8 proposals for a total of 118 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Dr Gary Coleman (Southampton) Scaling turbulence applications to thousands of cores 12
Mr Paul Graham (Edinburgh Parallel Computing Centre) Porting OpenFOAM to HECToR 6
Dr Sergey Karabasov (Cambridge) Parallelisation of CABARET for high fidelity aeroacoustic models 12
Dr Keith Refson (Science and Technology Facilities Council - Rutherford Appleton Laboratory) Implementation of excited-state force calculations for geometry optimisations and molecular dynamics in CASTEP 12
Prof Kenneth Taylor (Queen's University Belfast) Implementation of established algorithms to extend HELIUM 44
Dr Ilian Todorov (Science and Technology Facilities Council - Daresbury Laboratory) Optimisation of the Input and Output (I/O) in DL_POLY_3 6
Dr Martin Turner (Manchester) Massive Remote Batch Visualizer MRBV 12
Prof J. C. Vassilicos (Imperial) Direct Numerical Simulations (DNS) of turbulent fluid flows 16 2/3

Aug'08 deadline

5 proposals for a total of 90 person-months effort were received. 3 proposals for a total of 28.5 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Dr Graham Mann(Leeds) Performance enhancements for the GloMAP aerosol model 6
Dr Keith Refson (Science and Technology Facilities Council - Rutherford Appleton Laboratory) Hybrid time-dependent density functional theory in CASTEP 10.5
Dr Jeroen van Hunen (Durham) Support for multigrid improvements to Citcom 12

Apr'08 deadline

6 proposals for a total of 88 person-months effort were received. 5 proposals for a total of 58 person-months effort were recommended for funding. (One applicant subsequently declined the offer of funding for 12 person-months.)

Principal Investigator Project title Effort (months)
Dr Mike Ashworth (Science and Technology Facilities Council - Daresbury Laboratory) Fluidity-ICOM: High Performance Computing Driven Software Development for Next-Generation Modelling of the Worlds Oceans 12
Prof David Emerson (Science and Technology Facilities Council - Daresbury Laboratory) Porting and optimisation of Code_Saturne on HECToR and Black Widow 18
Dr Alan Gadian (Leeds) WRF code optimisation for Meso-scale Process Studies (WOMPS) 10
Dr Ben Slater (UCL) Improve scalability of domain decomposition within CP2K 6

Jan'08 deadline

8 proposals for a total of 132 person-months effort were received. 5 proposals for a total of 69 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Prof Dario Alfè (UCL) Improving the parallelisation and adding functionality to the quantum Monte Carlo code CASINO 12
Prof C Richard Catlow (UCL) Parallel Algorithms for the efficient massively-parallel tools for the study of catalytic chemistry 9
Dr Paul Connolly (Manchester) Cloud and Aerosol Research on Massively-parallel Architectures (CARMA) 12
Prof Nic Harrison (Imperial) Parallel algorithms for the materials modelling code CRYSTAL 24
Dr Martin Plummer (Science and Technology Facilities Council - Daresbury Laboratory) Future-proof parallelism for the electron-atom scattering codes PRMAT 12

Sep'07 deadline

4 proposals for a total of 54 person-months effort were received. 2 proposals for a total of 14 person-months effort were recommended for funding.

Principal Investigator Project title Effort (months)
Dr Andrew Coward (Southampton) OCEANS 2025 6
Dr Keith Refson (Science and Technology Facilities Council - Rutherford Appleton Laboratory) Enhanced parallel heirarchy for the materials modelling code CASTEP for the UKCP 8

Further information

The HECToR CSE support team can be contacted at hector-helpdesk@nag.co.uk, or via the HECToR Help Desk.