Phonon dispersion relations and infrared and Raman spectra of crystalline Sb2Te3 were computed within density functional perturbation theory. Overall good agreement with experiments is obtained, which allows us to assign the Raman and IR peaks to specific phonons.

Sosso, G., Caravati, S., & Bernasconi, M. (2009). Vibrational properties of crystalline Sb2Te3 from first principles. JOURNAL OF PHYSICS. CONDENSED MATTER, 21(9), 095410 [10.1088/0953-8984/21/9/095410].

Vibrational properties of crystalline Sb2Te3 from first principles

BERNASCONI, MARCO
2009

Abstract

Phonon dispersion relations and infrared and Raman spectra of crystalline Sb2Te3 were computed within density functional perturbation theory. Overall good agreement with experiments is obtained, which allows us to assign the Raman and IR peaks to specific phonons.
Articolo in rivista - Articolo scientifico
First principles calculations, Raman and IR spectra
English
095410
Sosso, G., Caravati, S., & Bernasconi, M. (2009). Vibrational properties of crystalline Sb2Te3 from first principles. JOURNAL OF PHYSICS. CONDENSED MATTER, 21(9), 095410 [10.1088/0953-8984/21/9/095410].
Sosso, G; Caravati, S; Bernasconi, M
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/10281/6147
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