| Literature DB >> 18052302 |
Wei L Wang1, Sheng Meng, Efthimios Kaxiras.
Abstract
We investigate, using benzenoid graph theory and first-principles calculations, the magnetic properties of arbitrarily shaped finite graphene fragments to which we refer as graphene nanoflakes (GNFs). We demonstrate that the spin of a GNF depends on its shape due to topological frustration of the pi-bonds. For example, a zigzag-edged triangular GNF has a nonzero net spin, resembling an artificial ferrimagnetic atom, with the spin value scaling with its linear size. In general, the principle of topological frustration can be used to introduce large net spin and interesting spin distributions in graphene. These results suggest an avenue to nanoscale spintronics through the sculpting of graphene fragments.Entities:
Year: 2007 PMID: 18052302 DOI: 10.1021/nl072548a
Source DB: PubMed Journal: Nano Lett ISSN: 1530-6984 Impact factor: 11.189