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Simple Fully Nonlocal Density Functionals for Electronic Repulsion Energy
[Image: see text] From a simplified version of the mathematical structure of the strong coupling limit of the exact exchange-correlation functional, we construct an approximation for the electronic repulsion energy at physical coupling strength, which is fully nonlocal. This functional is self-inter...
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| Publicado no: | J Phys Chem Lett |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical
Society
2017
|
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5502414/ https://ncbi.nlm.nih.gov/pubmed/28581751 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpclett.7b01113 |
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