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modelling Archives - Science and Engineering

Powering Up Research: The MMM Hub

By | Advanced materials, Events, Just Added, Popular | No Comments
The significance of High Performance Computing in materials research has recently been recognised by the Engineering and Physical Sciences Research Council (EPSRC) in the award of £4 million to a consortium of partners to create a new national supercomputing centre, the Materials and Molecular Modelling Hub. The HPC facility that the MMM Hub hosts is known as Thomas, a 17,000 core machine designed to support small to medium sized capacity computing focusing on materials and molecular modelling. The launch of this Tier 2 supercomputer on the 14 September was designed to raise awareness amongst the entire UK Materials and Molecular Modelling community...
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Guest Post: Inspiring New Science

By | Events, Just Added, MMM Hub event | No Comments
Lei Tan is a PhD student from Queen Mary University of London under the guidance of three supervisors: Prof. Martin Dove, Dr Andrei Sapelkin and Dr Alston Misquitta. She is currently studying the structure of metal chalcogenide nanoclusters, in particular a group called magic-size clusters that have an extremely small size (knowledge of their structures at an atomic level is critical for further understanding).  In her work, Tan combines experiment methods (xray total scattering, neutron scattering) and simulation (DFT and Reverse Mont-Carlo modelling), requiring large amounts of CPU time. She is one of the pilot users of the Thomas supercomputer. I...
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£12 Million Awarded to SES Institutions to Deliver University HPC

By | Just Added, News | 2 Comments
Researchers across the Science and Engineering South Consortium (SES) and the wider UK research community will soon benefit from an influx of funding to support scientific work on computational systems, crucial to the development of the UK economy and with high impact in areas such as the environment, technology, and health. The Engineering and Physical Sciences Research council (EPSRC) has awarded £12 million to SES institutions towards developing university Tier 2, High Performance Computing (HPC) facilities with a diversity of architectures that are designed to provide a boost to research and innovation and fill a gap where computational needs have...
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How HPC is Boosting Cutting-Edge Biology

By | Bioscience and medicine, Recommended, The Data Revolution | No Comments
High Performance Computing (HPC) is adding momentum to the evolution of biological science and a revolution in our understanding of how biological systems function – as pioneering research at UCL is clearly demonstrating. To drive their work forward, Dr Chris Barnes and his Computational Systems and Synthetic Biology Group make extensive use of large HPC systems, especially Emerald, the SES GPU-accelerated supercomputer, established using funding from the Engineering and Physical Sciences Research Council (EPSRC) . The group is at the leading edge of the fast-developing field of quantitative biology, a discipline that uses measurable data and mathematical modelling to reveal...
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