## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a βFull Textβ option. The original article is trackable v
ChemInform Abstract: ELF: The Electron Localization Function
β Scribed by A. SAVIN; R. NESPER; S. WENGERT; T. F. FAESSLER
- Publisher
- John Wiley and Sons
- Year
- 2010
- Weight
- 23 KB
- Volume
- 28
- Category
- Article
- ISSN
- 0931-7597
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π SIMILAR VOLUMES
Using some relationships derived from the density functional version of the virial theorem, an approximated kinetic energy density is constructed. This is used to Ε½ . implement a modified version of the electron localization function ELF . Its principal differences with the original ELF are that it
## Abstract The topological analysis of grids of data is used for determination of surfaces or volumes around maxima. The volumes are then related to chemical information such as atoms or bonds, and can be used for integration of local properties such as electronic population. The problem of global