A fast and robust algorithm for Bader decomposition of charge density
Autor: | Henkelman, Graeme, Arnaldsson, Andri, Jónsson, Hannes |
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Zdroj: | In Computational Materials Science 2006 36(3):354-360 |
Databáze: | ScienceDirect |
Externí odkaz: |
Autor: | Henkelman, Graeme, Arnaldsson, Andri, Jónsson, Hannes |
---|---|
Zdroj: | In Computational Materials Science 2006 36(3):354-360 |
Databáze: | ScienceDirect |
Externí odkaz: |