Efficient all-electron hybrid density functionals for atomistic simulations beyond 10 000 atoms

Sebastian Kokott*, Florian Merz, Yi Yao, Christian Carbogno, Mariana Rossi, Ville Havu, Markus Rampp, Matthias Scheffler, Volker Blum

*Corresponding author for this work

Research output: Contribution to journalArticleScientificpeer-review

1 Citation (Scopus)
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  • Finished

    NOMAD CoE: Novel Materials Discovery

    Rinke, P. (Principal investigator)

    01/10/202030/09/2023

    Project: EU: Framework programmes funding