Publikationsrepositorium - Helmholtz-Zentrum Dresden-Rossendorf
2 PublikationenHow To Analyze The Electronic Density - An Introduction To Some Useful Tools
Patzschke, M.
Abstract
Understanding a molecular system is not possible by only doing an electronic structure calculation. The results have to be analysed. In this presentation we will show some useful tools to do that.
Keywords: computational chemistry; ELF/ELI; AIM; NCI
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Eingeladener Vortrag (Konferenzbeitrag)
CSC Spring School 2016, 11.03.2016, Helsinki, Finnland -
Eingeladener Vortrag (Konferenzbeitrag)
CSC Spring School in Theoretical Chemistry, 17.03.2017, Helsinki, Finnland
Permalink: https://www.hzdr.de/publications/Publ-23988