Ab-initio studies on Li doping, Li-pairs, and complexes between Li and intrinsic defects in ZnO

Journal of Applied Physics

Volumn 111, Issue 12, 2012, Pages

  Vidya, R ^a   Ravindran, P ^a,b   Fjellvg, H ^a  

^a UNIVERSITY OF OSLO   (Norway)

^b CENTRAL UNIVERSITY OF TAMIL NADU   (India)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; ANTIBONDING; AUGMENTED PLANE-WAVE METHOD; FIRST-PRINCIPLES DENSITY FUNCTIONAL CALCULATIONS; FORMATION ENERGIES; HYBRID DENSITY FUNCTIONAL CALCULATIONS; INTERSTITIAL SITES; INTRINSIC DEFECTS; LI-DOPANTS; OXYGEN SITE; SYNTHESIS CONDITIONS; SYNTHETIC CONDITIONS; VALENCE-BAND MAXIMUMS; ZNO; ZNO MATRIX;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; ELECTRONIC PROPERTIES; ZINC;

ZINC OXIDE;

EID: 84863522320     PISSN: 00218979     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4729774     Document Type: Article

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