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Exchange–Correlation Functionals via Local Interpolation along the Adiabatic Connection
[Image: see text] The construction of density-functional approximations is explored by modeling the adiabatic connection locally, using energy densities defined in terms of the electrostatic potential of the exchange–correlation hole. These local models are more amenable to the construction of size-...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American
Chemical Society
2016
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4910137/ https://www.ncbi.nlm.nih.gov/pubmed/27116427 http://dx.doi.org/10.1021/acs.jctc.6b00177 |