Density Functional Theory Perspective on the Nonlinear Response of Correlated Electrons across Temperature Regimes

[Image: see text] We explore a new formalism to study the nonlinear electronic density response based on Kohn–Sham density functional theory (KS-DFT) at partially and strongly quantum degenerate regimes. It is demonstrated that the KS-DFT calculations are able to accurately reproduce the available p...

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Detalles Bibliográficos
Autores principales: Moldabekov, Zhandos, Vorberger, Jan, Dornheim, Tobias
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9097288/
https://www.ncbi.nlm.nih.gov/pubmed/35484932
http://dx.doi.org/10.1021/acs.jctc.2c00012

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9097288/
https://www.ncbi.nlm.nih.gov/pubmed/35484932
http://dx.doi.org/10.1021/acs.jctc.2c00012

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