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Ab initio study of structural, electronic, elastic and high pressure properties of barium chalcogenides

✍ Scribed by A. Bouhemadou; R. Khenata; F. Zegrar; M. Sahnoun; H. Baltache; A.H. Reshak

Book ID
116374674
Publisher
Elsevier Science
Year
2006
Tongue
English
Weight
539 KB
Volume
38
Category
Article
ISSN
0927-0256

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Ab initio study of structural, elastic, electronic and optical properties of spinel SnMg2O4
✍ M. Reffas; A. Bouhemadou; R. Khenata; T. Ouahrani; S. Bin-Omran πŸ“‚ Article πŸ“… 2010 πŸ› Elsevier Science 🌐 English βš– 412 KB

Ab initio study of structural, elastic, electronic and optical properties of the cubic spinel oxide SnMg 2 O 4 has been reported using the pseudo-potential plane-wave method within the local density approximation and the gradient generalized approximation for the exchange and correlation potential.