Electronic structures of wurtzite ZnO, BeO, MgO and p-type doping in Zn1-xYxO (Y = Mg, Be)

Computational Materials Science

Volumn 44, Issue 1, 2008, Pages 72-78

  Xu, Qiang ^a,b   Zhang, Xiu Wen ^a,b   Fan, Wei Jun ^b   Li, Shu Shen ^a   Xia, Jian Bai ^a  

^a INSTITUTE OF SEMICONDUCTORS   (China)

^b NANYANG TECHNOLOGICAL UNIVERSITY   (Singapore)

Author keywords

Alloy; Density functional theory; Doping; Electronic structure

Indexed keywords

ELECTRONIC STRUCTURE; FUNCTIONS; HARMONIC ANALYSIS; ORBITS; PARAMETER ESTIMATION; SEMICONDUCTING ZINC COMPOUNDS; SPIN DYNAMICS; ZINC; ZINC ALLOYS; ZINC OXIDE; ZINC SULFIDE;

ALLOY; DENSITY FUNCTION THEORY; DENSITY FUNCTIONAL THEORY; DOPING; DRESSELHAUS; EIGENVALUES; GENERALIZED GRADIENT APPROXIMATION; HIGH SYMMETRY; MASS PARAMETERS; P-TYPE DOPING; SPHERICAL HARMONICS; SPIN ORBITS; SPIN-ORBIT COUPLING; WURTZITE;

WAVE FUNCTIONS;

EID: 53849136988     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2008.01.030     Document Type: Article

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