Defects and strain enhancements of second-harmonic generation in Si/Ge superlattices

J Chem Phys. 2014 Jun 7;140(21):214705. doi: 10.1063/1.4880756.

Abstract

Starting from experimental findings and interface growth problems in Si/Ge superlattices, we have investigated through ab initio methods the concurrent and competitive behavior of strain and defects in the second-harmonic generation process. Interpreting the second-harmonic intensities as a function of the different nature and percentage of defects together with the strain induced at the interface between Si and Ge, we found a way to tune and enhance the second-harmonic generation response of these systems.