Influence of exchange-correlation functionals on dielectric properties of rutile TiO2

Current Applied Physics

Volumn 11, Issue 1 SUPPL., 2011, Pages

  Lee, Bora ^a   Lee, Choong Ki ^b   Hwang, Cheol Seong ^a   Han, Seungwu ^a  

^a Seoul National University   (South Korea)

^b Korea Institute for Advanced Study   (South Korea)

Author keywords

Dielectric constant; Hybrid functional; LDA + U; Phonon mode; TiO2

Indexed keywords

DIELECTRIC CONSTANTS; HYBRID FUNCTIONAL; LDA + U; PHONON MODE; TIO;

OXIDE MINERALS; PHONONS; STRONTIUM ALLOYS;

DIELECTRIC PROPERTIES;

EID: 79953228838     PISSN: 15671739     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cap.2010.11.104     Document Type: Conference Paper

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