New structural model for the si(331)-(12x1) surface reconstruction

Phys Rev Lett. 2009 Feb 13;102(6):066102. doi: 10.1103/PhysRevLett.102.066102. Epub 2009 Feb 9.

Abstract

A new structural model for the Si(331)-(12x1) surface reconstruction is proposed. Based on scanning tunneling microscopy images of unprecedented resolution, low-energy electron diffraction data, and first-principles total-energy calculations, we demonstrate that the reconstructed Si(331) surface shares the same elementary building blocks as the Si(110)-(16x2) surface, establishing the pentamer as a universal building block for complex silicon surface reconstructions.