Influence of intrinsic defects on the properties of zinc oxide

Journal of Computational Chemistry

Volumn 29, Issue 13, 2008, Pages 2250-2254

  Jug, Karl ^a   Tikhomirov, Viatcheslav A ^a  

^a LEIBNIZ UNIVERSITY HANNOVER   (Germany)

Author keywords

Band gap; Defect formation energy; Oxygen vacancies; Zinc interstitials; Zinc oxide, intrinsic defects

Indexed keywords

CHLORINE COMPOUNDS; DEFECTS; ENERGY GAP; GALLIUM ALLOYS; NONMETALS; OXIDES; OXYGEN; SEMICONDUCTING ZINC COMPOUNDS; VACANCIES; WEAR RESISTANCE; ZINC; ZINC OXIDE;

BAND GAP; BAND GAPS; CYCLIC CLUSTERING; DEFECT FORMATION ENERGIES; DEFECT FORMATION ENERGY; DEFECT LEVEL; INTRINSIC DEFECTS; M-O METHOD; MODEL SYSTEMS; OXYGEN ATOMS; RICH CONDITIONS; SEMI-EMPIRICAL; ZINC INTERSTITIALS; ZINC OXIDE, INTRINSIC DEFECTS;

OXYGEN VACANCIES;

EID: 50149111550     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20978     Document Type: Article

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