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Ab initio study of phonons in wurtzite AlxGa1-xN alloys

Bungaro, C.
•
de Gironcoli, S.
2000
  • journal article

Periodico
APPLIED PHYSICS LETTERS
Abstract
We present a theoretical study of the zone-center optical phonons in wurtzite AlxGa1-xN alloys over the whole compositional range from pure GaN to pure AlN. The phonon modes are broadened upon alloying and their frequencies display a blue shift with increasing Al concentration. The E-2 and E-1(TO) modes display a two-mode like behavior and do not preserve a well-defined symmetry in the alloy but rather are mixed and have a large broadening. The LO modes, instead, display a one-mode behavior and have a well-defined symmetry, small broadening, and a pronounced dependence of the frequency upon alloy composition. Therefore, we propose them as the best candidates for the compositional characterization of these materials. (C) 2000 American Institute of Physics. [S0003-6951(00)04815-4].
DOI
10.1063/1.126268
WOS
WOS:000086296200045
Archivio
http://hdl.handle.net/20.500.11767/12449
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-0001266946
https://aip.scitation.org/doi/10.1063/1.126268
Diritti
open access
Soggetti
  • Phonon

  • Semiconductor materia...

  • Settore FIS/03 - Fisi...

Web of Science© citazioni
21
Data di acquisizione
Mar 9, 2024
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