info:eu-repo/semantics/article
Optical matrix elements in tight-binding approach of hydrogenated Si nanowires
Autor
JOSE ALEJANDRO DIAZ MENDEZ
MIGUEL CRUZ IRISSON
Resumen
The dependence of the imaginary part of the dielectric function on the quantum confinement within two different schemes: intra-atomic and interatomic optical matrix elements are applied and compared. The optical spectra of Si nanowires are studied by means of a semi-empirical sp3s* tight-binding supercell model. The surface dangling bonds are passivated by hydrogen atoms. The results show that although the intra-atomic matrix elements are small in magnitude, the interference between these terms and the interatomic matrix elements contributes with nearly 25% of the total absorption. Thus, a quantitative treatment of nanostructures may not be possible without the inclusion of intra-atomic matrix elements.
Materias
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