Optical properties of alkaline-earth metal oxides from first principles

Solid State Sciences

Volumn 11, Issue 12, 2009, Pages 2099-2105

  Dadsetani, M ^a   Beiranvand, R ^a  

^a LORESTAN UNIVERSITY   (Iran)

Author keywords

DFT; Dielectric function; FP LAPW; Metal oxides; Optical properties

Indexed keywords

AB INITIO; BAND STRUCTURE CALCULATION; DIELECTRIC CONSTANTS; DIELECTRIC FUNCTIONS; ENERGY LOSS FUNCTION; EXCHANGE-CORRELATION POTENTIAL; FINAL STATE; FIRST-PRINCIPLES; FP-LAPW; FULL POTENTIAL-LINEARIZED AUGMENTED PLANE WAVES; GENERALIZED GRADIENT APPROXIMATIONS; IMAGINARY PARTS; INTER-BAND TRANSITION; LOW ENERGY REGIONS; METAL OXIDES; NACL CRYSTAL; OPTICAL ABSORPTION COEFFICIENTS; RANDOM PHASE APPROXIMATIONS; SINGLE PARTICLE; SPIN-ORBIT COUPLINGS;

CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ELECTRON ENERGY LOSS SPECTROSCOPY; ENERGY DISSIPATION; LITHIUM BATTERIES; METALS; OXIDES; OXYGEN; PROBABILITY DENSITY FUNCTION; SODIUM CHLORIDE;

OPTICAL PROPERTIES;

EID: 70450254969     PISSN: 12932558     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.solidstatesciences.2009.08.018     Document Type: Article

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