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Gradient Expansions for the Large-Coupling Strength Limit of the Møller–Plesset Adiabatic Connection

[Image: see text] The adiabatic connection that has, as weak-interaction expansion, the Møller–Plesset perturbation series has been recently shown to have a large coupling-strength expansion, in terms of functionals of the Hartree–Fock density with a clear physical meaning. In this work, we accurate...

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Detalles Bibliográficos
Autores principales: Daas, Timothy J., Kooi, Derk P., Grooteman, Arthur J. A. F., Seidl, Michael, Gori-Giorgi, Paola
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8908763/
https://www.ncbi.nlm.nih.gov/pubmed/35179386
http://dx.doi.org/10.1021/acs.jctc.1c01206