Construction of meta-GGA functionals through restoration of exact constraint adherence to regularized SCAN functionals.

Furness, James W; Kaplan, Aaron D; Ning, Jinliang; Perdew, John P; Sun, Jianwei

Furness, James W; Kaplan, Aaron D; Ning, Jinliang; Perdew, John P; Sun, Jianwei.

Afiliación

Furness JW; Department of Physics and Engineering Physics, Tulane University, New Orleans, Louisiana 70118, USA.
Kaplan AD; Department of Physics, Temple University, Philadelphia, Pennsylvania 19122, USA.
Ning J; Department of Physics and Engineering Physics, Tulane University, New Orleans, Louisiana 70118, USA.
Perdew JP; Department of Physics, Temple University, Philadelphia, Pennsylvania 19122, USA.
Sun J; Department of Physics and Engineering Physics, Tulane University, New Orleans, Louisiana 70118, USA.

J Chem Phys ; 156(3): 034109, 2022 Jan 21.

Article en En | MEDLINE | ID: mdl-35065548

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Chem Phys Año: 2022 Tipo del documento: Article País de afiliación: Estados Unidos

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