RIANE, Rabah; ZAOUI, A.; MATAR, Samir F.; ABDICHE, A.

doi:10.1016/j.physb.2009.10.038

Metadatos

Mostrar el registro completo del ítem

Licencia de uso del documento

RIANE, Rabah
Modelling and Simulation in Materials Science Laboratory

ZAOUI, A.
Modelling and Simulation in Materials Science Laboratory

MATAR, Samir F.
Institut de Chimie de la Matière Condensée de Bordeaux [ICMCB]

Idioma

Article de revue

Este ítem está publicado en

Physica B: Condensed Matter. 2010, vol. 405, n° 3, p. 985-989

Elsevier

Resumen en inglés

First principles calculations are used to investigate the effect of hydrostatic pressure on the electronic and optical properties of zinc blende GaN, BN compounds and their B<sub>0.25</sub>Ga<sub>0.75</sub>N alloy. We have applied the augmented plane-wave method with the local density approximation to the density functional theory. The refractive index and its variation with hydrostatic pressure are well described. Index of refraction and its pressure derivative and both imaginary and real parts of the dielectric function are identified in the photon energy range up to 40 eV. Resulting pressure coefficients of the main gap and of the refractive index are found in good agreement with experimental data.< Leer menos

Palabras clave en inglés

DFT

FP-LAPW

Wide gap semiconductors

Dielectric function

Refractive index

Hydrostatic pressure

Metadatos

Licencia de uso del documento

Pressure dependence of electronic and optical properties of Zinc-blende GaN, BN and their B<sub>0.25</sub>Ga<sub>0.75</sub>N alloy

Idioma

Este ítem está publicado en

Resumen en inglés

Palabras clave en inglés

DOI

Orígen

Centros de investigación