| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 10578406 | Polyhedron | 2011 | 5 Pages |
Abstract
⺠Spin-orbit affects aromaticity in metallic rings. ⺠Phenyl groups switches off aromaticity. ⺠Spin-orbit affect also the electron localization function (ELF).
Related Topics
Physical Sciences and Engineering
Chemistry
Inorganic Chemistry
![Relativistic scalar and spin-orbit density functional calculations of the electronic structure, NICS index and ELF function of the [Re2(CO)8(μ-BiPh)2] and [Re2(CO)8(μ-BiPh2)2] clusters](/preview/png/10578406.png "First Page Preview: Relativistic scalar and spin-orbit density functional calculations of the electronic structure, NICS index and ELF function of the [Re2(CO)8(μ-BiPh)2] and [Re2(CO)8(μ-BiPh2)2] clusters")
Authors
Eduardo Schott, Ximena Zárate, Ramiro Arratia-Pérez,