Semilocal Meta-GGA Exchange–Correlation Approximation from Adiabatic Connection Formalism: Extent and Limitations

[Image: see text] The incorporation of a strong-interaction regime within the approximate semilocal exchange–correlation functionals still remains a very challenging task for density functional theory. One of the promising attempts in this direction is the recently proposed adiabatic connection semi...

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Detalles Bibliográficos
Autores principales: Jana, Subrata, Śmiga, Szymon, Constantin, Lucian A., Samal, Prasanjit
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10591512/
https://www.ncbi.nlm.nih.gov/pubmed/37811903
http://dx.doi.org/10.1021/acs.jpca.3c03976

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10591512/
https://www.ncbi.nlm.nih.gov/pubmed/37811903
http://dx.doi.org/10.1021/acs.jpca.3c03976

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