Gold in graphene: in-plane adsorption and diffusion

Autor: Malola, S., Häkkinen, H., Koskinen, P.
Rok vydání: 2008
Předmět:
Zdroj: Appl. Phys. Lett. 94, 043106 (2009)
Druh dokumentu: Working Paper
DOI: 10.1063/1.3075216
Popis: We study the bonding and diffusion of Au in graphene vacancies using density-functional theory. Energetics show that Au adsorbs preferably to double vacancies, steadily in-plane with graphene. All diffusion barriers for the complex of Au in double vacancy are above 4 eV, whereas the barriers for larger vacancies are below 2 eV. Our results support the main results of a recent experiment [Gan et al., Small 4, 587 (2008)], but suggest that the observed diffusion mechanism is not thermally activated, but radiation-enhanced.
Comment: 3 pages, 3 figures
Databáze: arXiv