Ab initio FP-LAPW study of the semiconductors SnO and SnO2

Structural and electronic properties of tin oxides, SnO and SnO2, were studied using the full-potential linearized-augmented-plane-waves method within the local density and the generalized gradient approximations. Internal positional parameters, density of states and the electric-field gradient tens...

Ausführliche Beschreibung

Gespeichert in:

Bibliographische Detailangaben
Veröffentlicht in:	Physica. B, Condensed matter Condensed matter, 2007-02, Vol.389 (1), p.140-144
1. Verfasser:	ERRICO, Leonardo A
Format:	Artikel
Sprache:	eng
Schlagworte:	Condensed matter: electronic structure, electrical, magnetic, and optical properties Electron density of states and band structure of crystalline solids Electron states Exact sciences and technology Physics Semiconductor compounds
Online-Zugang:	Volltext
Tags:	Tag hinzufügen Keine Tags, Fügen Sie den ersten Tag hinzu!

Beschreibung
Zusammenfassung:	Structural and electronic properties of tin oxides, SnO and SnO2, were studied using the full-potential linearized-augmented-plane-waves method within the local density and the generalized gradient approximations. Internal positional parameters, density of states and the electric-field gradient tensor at Sn sites were calculated. The results for the electronic and structural properties are compared to experimental measurements and with results obtained in different band-structure calculations.
ISSN:	0921-4526 1873-2135
DOI:	10.1016/j.physb.2006.07.041