Title :
Quasiparticle electronic band structure of the cubic LiBeF3 crystal
Author :
Syrotyuk, S. ; Shved, V.
Author_Institution :
Lviv Polytech. Nat. Univ., Lviv, Ukraine
Abstract :
The electron energy bands have been calculated within the LDA and GW formalism. The LDA approach gives the underestimation of the band gap. The account of the GW corrections has been carried out for the first time. It substantially improves the results for direct and indirect interband gaps.
Keywords :
energy gap; lithium compounds; quasiparticles; GW formalism; LDA approach; LiBeF3; electron energy bands; indirect interband gaps; quasiparticle electronic band structure; Electron optics; Vacuum technology; GW approach; LDA approach; electronic energy bands;
Conference_Titel :
Oxide Materials for Electronic Engineering (OMEE), 2014 IEEE International Conference on
Conference_Location :
Lviv
Print_ISBN :
978-1-4799-5960-0
DOI :
10.1109/OMEE.2014.6912336
