| Literature DB >> 24616205 |
Eugen Waldt1, Reinhart Ahlrichs, Manfred M Kappes, Detlef Schooss.
Abstract
We describe the first direct structural characterization of medium-sized ruthenium clusters (Ru19 (-) , Ru28 (-) , Ru38 (-) , and Ru44 (-) ) by using a combination of trapped ion electron diffraction and density functional theory. We find close-packed structures based on octahedral geometries: Ru19 (-) and Ru44 (-) are closed-shell octahedra whereas Ru28 (-) is a double octahedron. In the case of Ru38 (-) , instead of a truncated octahedron we obtain evidence for lower symmetry structures containing a reentrant surface.Entities:
Keywords: cluster structure; density functional theory; electron diffraction; octahedral geometries; ruthenium
Year: 2014 PMID: 24616205 DOI: 10.1002/cphc.201400011
Source DB: PubMed Journal: Chemphyschem ISSN: 1439-4235 Impact factor: 3.102