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A fast and robust algorithm for Bader decomposition of charge density

A fast and robust algorithm for Bader decomposition of charge density on resea.org. DOI 10.1016/j.commatsci.2005.04.010. Graeme Henkelman, Andri Arnaldsson, Hannes Jónsson.

Graeme Henkelman, Andri Arnaldsson, Hannes Jónsson

https://resea.org/10.1016/j.commatsci.2005.04.010

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