Ab initio study of the structural, elastic, electronic and optical properties of the antiperovskite SbNMg3

Computational Materials Science

Volumn 39, Issue 4, 2007, Pages 803-807

  Bouhemadou, A ^a   Khenata, R ^b  

^a FERHAT ABBAS UNIVERSITY   (Algeria)

^b UNIVERSITÉ DE MASCARA   (Algeria)

Author keywords

Elastic constants; Electronic properties; Optical properties; PP PW method; Pressure effect; SbNMg3

Indexed keywords

BAND STRUCTURE; ELASTIC CONSTANTS; ELECTRONIC PROPERTIES; GRADIENT METHODS; PRESSURE EFFECTS; REFRACTIVE INDEX; STRUCTURAL PROPERTIES;

EXTINCTION COEFFICIENTS; GENERALIZED GRADIENT APPROXIMATION (GGA); PRESSURE COEFFICIENTS;

TIN COMPOUNDS;

EID: 34248325600     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2006.10.003     Document Type: Article

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