Open-shell jellium aromaticity in metal clusters.

Open-shell jellium aromaticity in metal clusters.
Chem Commun (Camb). 2019 Apr 18;:
Authors: Poater J, Solà M
Abstract
The 2N2 + 2N + 1 with S = N + 1/2 rule represented the extension to open-shell spherical compounds of the 2(N + 1)2 Hirsch rule for spherical aromatic species. In this work, we provide evidence that the jellium model with its magic numbers can also be extended to open-shell half-filled systems.
PMID: 30997449 [PubMed - as supplied by publisher]

Source: Chemical Communications - April 17, 2019 Category: Chemistry Authors: Poater J, Solà M Tags: Chem Commun (Camb) Source Type: research