by Leon Petit | Apr 4, 2023 | Uncategorised
CRYSTAL23 v1.0.1, a powerful and scalable computational tool for solid state chemistry and physics was released on 19 December 2022. The code is described in a special issue of Journal of Theory and Computation, https://doi.org/10.1021/acs.jctc.2c00958. Details how to...
by Leon Petit | Sep 4, 2022 | Uncategorised
Manuel Dos Santos Dias has recently joined the Daresbury CCP9 group. He was previously stationed at Forschungszentrum Juelich with expertise among others in magnetism and magnetic...
by Eamonn | May 27, 2020 | Uncategorised
TOSCAM (Toolbox for Strongly Correlated Approaches to Molecules), a DMFT implementation for the linear scaling UK software ONETEP has recently been released. This is both an integration within ONETEP, but with an external open source engine available at toscam.org....
by Eamonn | Jan 29, 2020 | Uncategorised
This symposium celebrating the life and work of Professor Mike Payne (ex-Chair of CCP9) on the occasion of his 60th birthday was held at Pembroke College, Cambridge, on the 11th of January 2020. There were 18 invited talks from people who have worked closely with Mike...
by Eamonn | Jan 8, 2020 | Uncategorised
The results of the recent EPSRC CCP grant call have been announced – the CCP9 proposal has been funded and with the full requested CoSeC allocation.
by Eamonn | Oct 17, 2019 | Uncategorised
The ONETEP Masterclass 2019 took place at the Arden Conference Centre, University of Warwick, from 27th-30th August, organized by James Womack, Joly Aarons, Joseph Prentice, and Nicholas Hine. – Meeting Report
