Ab initio study of the structural, electronic and optical properties of NaTaO3

Philosophical Magazine

Volumn 90, Issue 21, 2010, Pages 2965-2976

  Ece Eyi, E ^a   Cabuk, Suleyman ^a  

^a UNIVERSIDAD NACIONAL AUTÓNOMA DE MÉXICO   (Mexico)

Author keywords

Ab initio calculation; Electronic band structure; NaTaO3; Optical properties; Perovskite

Indexed keywords

A-PLANE; AB INITIO CALCULATIONS; AB INITIO STUDY; ABSORPTION COEFFICIENTS; DENSITY OF STATE; DIELECTRIC FUNCTIONS; DIRECT BAND GAP; ELECTRON ENERGY-LOSS SPECTRA; ELECTRONIC BAND STRUCTURE; FREQUENCY-DEPENDENT; IMAGINARY PARTS; INDIRECT BAND GAP; LINEAR OPTICAL RESPONSE; NATAO3; ORTHORHOMBIC PHASE; REAL PART; THEORETICAL PREDICTION;

ABSORPTION; ABSORPTION SPECTROSCOPY; CALCULATIONS; DENSITY FUNCTIONAL THEORY; ELECTRON ENERGY LOSS SPECTROSCOPY; ENERGY GAP; OPTICAL CONSTANTS; OXIDE MINERALS; PEROVSKITE; STRUCTURAL PROPERTIES;

OPTICAL PROPERTIES;

EID: 77953090533     PISSN: 14786435     EISSN: 14786443     Source Type: Journal    
DOI: 10.1080/14786431003752159     Document Type: Article

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