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Adaptive Anderson mixing for electronic structure calculations
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SYSNO 0576991 Title Adaptive Anderson mixing for electronic structure calculations Author(s) Novák, Matyáš (FZU-D) ORCID
Vackář, Jiří (FZU-D) RID, ORCID
Cimrman, R. (CZ)
Šipr, Ondřej (FZU-D) RID, ORCIDSource Title Computer Physics Communications. Roč. 292, Nov (2023). - : Elsevier Article number 108865 Document Type Článek v odborném periodiku Grant GA23-04746S GA ČR - Czech Science Foundation (CSF), CZ - Czech Republic Institutional support FZU-D - RVO:68378271 Language eng Country NL Keywords nonlinear solver * adapted mixing coefficient * Anderson mixing * electronic structure calculations * self-consistent cycle URL https://doi.org/10.1016/j.cpc.2023.108865 Permanent Link https://hdl.handle.net/11104/0346769
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