Electronic and optical properties of alkali metal selenides in anti-CaF2 crystal structure from first-principles

Journal of Alloys and Compounds

Volumn 503, Issue 1, 2010, Pages 10-18

  Alay E Abbas, S M ^a   Sabir, N ^a   Saeed, Y ^b   Shaukat, A ^c  

^a GC UNIVERSITY   (Pakistan)

^b UNIVERSITY OF SOUTH BOHEMIA   (Czech Republic)

^c UNIVERSITY OF SARGODHA   (Pakistan)

Author keywords

Alkali metal selenides; Electronic and optical properties; First principles calculations; FP LAPW; Generalized gradient approximation

Indexed keywords

ELECTRONIC AND OPTICAL PROPERTIES; FIRST-PRINCIPLES CALCULATION; FP-LAPW; GENERALIZED GRADIENT APPROXIMATIONS; SELENIDES;

DENSITY FUNCTIONAL THEORY; ELECTRONIC DENSITY OF STATES; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; LITHIUM BATTERIES; METALS; NEGATIVE IONS; POSITIVE IONS; REFRACTIVE INDEX; SELENIUM COMPOUNDS;

CRYSTAL STRUCTURE;

EID: 77955306770     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jallcom.2010.05.014     Document Type: Article

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