Quasiparticle electronic band structure of the alkali metal chalcogenides

The electronic energy band spectra of the alkali metal chalcogenides M<sub>2</sub>A (M: Li, Na, K, Rb; A: O, S, Se, Te) have been evaluated within the projector augmented waves (PAW) approach by means of the ABINIT code. The Kohn-Sham single-particle states have been found in the GGA fra...

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Bibliographic Details
Main Authors: S.V. Syrotyuk, V.M. Shved
Format: Article
Language:English
Published: Institute for Condensed Matter Physics 2015-09-01
Series:Condensed Matter Physics
Subjects:
GGA
GWA
Online Access:http://dx.doi.org/10.5488/CMP.18.33702