Helium, neon and argon diffraction from Ru(0001)

J Phys Condens Matter. 2012 Sep 5;24(35):354002. doi: 10.1088/0953-8984/24/35/354002. Epub 2012 Aug 16.

Abstract

We present an experimental and theoretical study of He, Ne and Ar diffraction from the Ru(0001) surface. Close-coupling calculations were performed to estimate the corrugation function and the potential well depth in the atom-surface interaction in all three cases. DFT (density functional theory) calculations, including van der Waals dispersion forces, were used to validate the close-coupling results and to further analyze the experimental results. Our DFT calculations indicate that, in the incident energy range 20-150 meV, anticorrugating effects are present in the case of He and Ar diffraction, whereas normal corrugation is observed with Ne beams.

Publication types

  • Research Support, Non-U.S. Gov't