Journal article

Recent advances and perspectives in four-component Dirac-Kohn-Sham calculations

Leonardo Belpassi, Loriano Storchi, Harry M Quiney, Francesco Tarantelli

Physical Chemistry Chemical Physics | ROYAL SOC CHEMISTRY | Published : 2011

University of Melbourne Researchers


Awarded by MIUR

Awarded by Italian SuperComputer Resource Allocation (ISCRA-CINECA)

Funding Acknowledgements

This work has been supported by the MIUR PRIN grant no. 2008KJX4SN_003. The latest computational developments and applications have been carried out under an Extreme Computing Initiative grant of the Distributed European Infrastructure for Supercomputing Applications (DEISA) and project HP10BO0PYX (AuCat) of the Italian SuperComputer Resource Allocation (ISCRA-CINECA).