Dimeric nature of N-coordinated Mg and Ca ions in metaloorganic compounds. The topological analysis of ELF functions for Mg–Mg and Ca–Ca bonds
Polyhedron(2017)
Abstract
The local electronic structure of the Mg–Mg and Ca–Ca bonds have been investigated in the model dimeric magnesium(I) and calcium(I) molecules using the topological analysis of Electron Localisation Function (ELF). The paper focuses on two main areas: (1) The nature of the Mg–Mg and Ca–Ca bonds and (2) The differences in description of their electronic structure if the study is performed using topological analysis of electron density and ELF function.
MoreTranslated text
Key words
Magnesium(I) and Calcium(I) compounds,(ELF) Electron Localisation Function,Topological analysis,(AIM) Atoms in Molecules,Attractor and Chemical bond
AI Read Science
Must-Reading Tree
Example
![](https://originalfileserver.aminer.cn/sys/aminer/pubs/mrt_preview.jpeg)
Generate MRT to find the research sequence of this paper
Chat Paper
Summary is being generated by the instructions you defined