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The modified Becke-Johnson potential analyzed
Recently in the Wien2k code, the modified Becke-Johnson potential (mBJLDA) was implemented. As the authors [Phys.Rev.Lett. 102, 226401 (2009)] point, this potential reproduces the band gap of semiconductors with improved accuracy. In this paper we present our analysis of this potential in two direct...
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| Publicado no: | Superficies y vacío |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Sociedad Mexicana de Ciencia y Tecnología de Superficies y Materiales A.C.
2013
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| Assuntos: | |
| Acesso em linha: | https://www.redalyc.org/articulo.oa?id=94228981005 |
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