| dc.contributor.author | Bethune, Iain | |
| dc.date.accessioned | 2012-12-18T09:44:06Z | |
| dc.date.available | 2012-12-18T09:44:06Z | |
| dc.date.issued | 2010-09-22 | |
| dc.identifier.citation | Bethune I, Improving the scalability of CP2K on multi-core systems, HECToR dCSE Report (2010) | en_US |
| dc.identifier.uri | http://hdl.handle.net/1842/6542 | |
| dc.description.abstract | Six months of HECToR dCSE funding was given to implement mixed-mode OpenMP parallelism in CP2K, building on the results of an earlier successful dCSE project. Improved scalability of up to 8 times as many cores was demonstrated for a small benchmark, and a larger, inhomogeneous benchmark was shown to scale up to 9000+ cores. An increase in peak performance of up to 60% was also realised on HECToR Phase 2b. In addition, the performance of the code was studied on three generations of Cray systems - XT4, XT5 and XT6 - and under four different compilers. | en_US |
| dc.contributor.sponsor | Engineering and Physical Sciences Research Council (EPSRC) | en_US |
| dc.language.iso | en | en_US |
| dc.subject | CP2K | en_US |
| dc.subject | HECToR dCSE | en_US |
| dc.title | Improving the scalability of CP2K on multi-core systems | en_US |
| dc.type | Technical Report | en_US |
