Posted: 24 Jun 2014 | 14:10
Posted: 24 Feb 2014 | 12:10
Posted: 6 Feb 2014 | 09:50
Last week we held the first in a series of annual meetings for the CP2K user community at the University of London Garden Halls.
I blogged about it in the run-up to the meeting, but as with any first until you're there you don't know quite what to expect. I was very pleased to see over 50 attendees on the day, ranging from new PhD students to professors, and expert CP2K users to complete novices.
Posted: 29 Nov 2013 | 11:00
ARCHER (Advanced Research Computing High End Resource) is the next national HPC service for academic research. The service comprises a number of components: accommodation provided by the University of Edinburgh; hardware by Cray; systems support by EPCC and Daresbury Laboratory; and user and computational science and engineering support by EPCC.
Posted: 21 Nov 2013 | 09:31
Posted: 18 Nov 2013 | 10:20
For the last five years, I've been involved in the development of the CP2K materials science code, mostly in terms of improving its performance and scalability and porting to new systems. During that time a great deal of new functionality has been added, as well as additional input file options, libraries and autotuning capability to enable maximum performance on any given architecture. However, these improvements have come at the cost of increased complexity - and CP2K already has a fearsome reputation among researchers for being very hard to use!
Posted: 15 Oct 2013 | 12:18
Posted: 10 Oct 2013 | 10:27
Posted: 9 Oct 2013 | 11:47
The NAIS project (Numerical Algorithms and Intellegent Software), which EPCC is a member of, has recently purchased 8 NVidia K20 GPGPUs, and associated computer nodes to house them, for use by NAIS members and researchers.
Posted: 5 Oct 2013 | 12:01