Computational Modelling Group

GPU

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Projects

A Fast Multipole Method for the Bessel potential

Marc Molinari, Simon Cox (Investigators), Neil O'Brien

The fast multipole method (FMM) proposed by Greengard and Rokhlin provides a method by which the O(N-squared) many-body problem can be reduced to O(N) complexity. In this project, a multipole method is developed to calculate the energy of a system of vortices in a high temperature superconductor, where the many-body interactions give rise to rich and complex physics. The method developed here is suitable for systems where the interactions are governed by a Bessel potential rather than the usual logarithmic potentials occurring in gravitational and electrostatic problems. We derive and apply vectorised forms of the Gegenbauer addition formulae in order to achieve the O(N) scaling associated with fast multipole methods.

Meshless Methods for Photonic Crystal Modelling

Kamal Djidjeli, Marc Molinari, Simon Cox (Investigators), Neil O'Brien, Elizabeth Hart

We apply meshless methods to the problems of simulating photonic crystals. The meshless methods utilise compactly-supported radial basis functions (CSRBFs) and offer a promising alternative to the conventional plane-wave expansion method for calculating the band structure of photonic crystals.

MXL Project

Mark Taylor, Junfen Shi (Investigators)

‘MXL’ is short for “Enhanced patient safety by computational Modelling from clinically available X-rays to minimise the risk of overload and instability for optimised function and Longevity”. This is an international EU-funded project which the Bioengineering Sciences Research Group at Southampton is involved in. For more information, visit http://www.m-x-l.eu

Soft x-ray science on a tabletop

Peter Horak, Jeremy Frey, Bill Brocklesby (Investigators), Patrick Anderson

Complex numerical simulations are being performed to aid experimentalists at Southampton realize the next generation of high brightness tabletop sources of coherent soft x-rays.


Sustainable domain-specific software generation tools for extremely parallel particle-based simulations

Chris-Kriton Skylaris (Investigator)

A range of particle based methods (PBM) are currently used to simulate materials in chemistry, engineering, physics and biophysics. The 4 types of PBM considered directly in the proposed are molecular dynamics (MD), the ONETEP quantum mechanics-based program, discrete element modelling (DEM), and smoothed particle hydrodynamics (SPH).
The overall research objective is to develop a sustainable tool that will deliver, in the future, cutting edge research applicable to applications ranging from dam engineering to atomistic drug design.

µ-VIS Computed Tomography Centre

Ian Sinclair, Richard Boardman, Dmitry Grinev, Philipp Thurner, Simon Cox, Jeremy Frey, Mark Spearing, Kenji Takeda (Investigators)

A dedicated centre for computed tomography (CT) at Southampton, providing complete support for 3D imaging science, serving Engineering, Biomedical, Environmental and Archaeological Sciences. The centre encompasses five complementary scanning systems supporting resolutions down to 200nm and imaging volumes in excess of one metre: from a matchstick to a tree trunk, from an ant's wing to a gas turbine blade.

People

Simon Cox
Professor, Engineering Sciences (FEE)
Jeremy Frey
Professor, Chemistry (FNES)
Ian Sinclair
Professor, Engineering Sciences (FEE)
Mark Spearing
Professor, Engineering Sciences (FEE)
Mark Taylor
Professor, Engineering Sciences (FEE)
Bill Brocklesby
Reader, Optoelectronics Research Centre
Peter Horak
Reader, Optoelectronics Research Centre
Kenji Takeda
Senior Lecturer, Engineering Sciences (FEE)
Kamal Djidjeli
Lecturer, Engineering Sciences (FEE)
Gwenael Gabard
Lecturer, Institute of Sound & Vibration Research (FEE)
Ivan Markovsky
Lecturer, Electronics and Computer Science (FPAS)
Marc Molinari
Lecturer, Engineering Sciences (FEE)
Richard Sandberg
Lecturer, Engineering Sciences (FEE)
Chris-Kriton Skylaris
Lecturer, Chemistry (FNES)
Philipp Thurner
Lecturer, Engineering Sciences (FEE)
Philip Williamson
Senior Research Fellow, Biological Sciences (FNES)
Richard Boardman
Research Fellow, Engineering Sciences (FEE)
Dmitry Grinev
Research Fellow, Engineering Sciences (FEE)
Elizabeth Hart
Research Fellow, Engineering Sciences (FEE)
Andrew Penner
Research Fellow, Mathematics (FSHS)
Patrick Anderson
Postgraduate Research Student, Optoelectronics Research Centre
Jordi Arranz
Postgraduate Research Student, Electronics and Computer Science (FPAS)
Dmitri Chernyshenko
Postgraduate Research Student, Engineering Sciences (FEE)
Tom Hebbron
Postgraduate Research Student, Electronics and Computer Science (FPAS)
Neil O'Brien
Postgraduate Research Student, Engineering Sciences (FEE)
Alvaro Ruiz-Serrano
Postgraduate Research Student, Chemistry (FNES)
Robin Wilson
Postgraduate Research Student, Geography (FSHS)
Matthew Higgins
Undergraduate Research Student, Biological Sciences (FNES)
Paul Skipp
Technical Staff, Biological Sciences (FNES)
Elena Vataga
Technical Staff, iSolutions
Petrina Butler
Administrative Staff, Research and Innovation Services
Junfen Shi
None, None