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The project was made possible thanks to ongoing support from Dr. Ben Slater (University College London, CP2K User), Prof. Joost VandeVondele (ETH Zurich, CP2K Developer), and Prof. Jurg Hutter (University of Zurich, CP2K Developer).

This project was funded under the HECToR Distributed Computational Science and Engineering (CSE) Service operated by NAG Ltd. HECToR - A Research Councils UK High End Computing Service - is the UK's national supercomputing service, managed by EPSRC on behalf of the participating Research Councils. Its mission is to support capability science and engineering in UK academia. The HECToR supercomputers are managed by UoE HPCx Ltd and the CSE Support Service is provided by NAG Ltd.

Iain Bethune