Studies of magnetic interactions in Ni-doped ZnO from first-principles calculations

Computational Materials Science

Volumn 43, Issue 3, 2008, Pages 489-494

  Pei, Guangqing ^a,b   Xia, Changtai ^a   Wu, Bo ^c   Wang, Tao ^d   Zhang, Lili ^c   Dong, Yongjun ^a   Xu, Jun ^a  

^a SHANGHAI INSTITUTE OF OPTICS AND FINE MECHANICS   (China)

^b UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

^c FUZHOU UNIVERSITY   (China)

^d Shanghai Supercomputer Center   (China)

Author keywords

Density functional; First principle electron theory; Magnetic semiconductors

Indexed keywords

DENSITY FUNCTIONAL THEORY; FERROMAGNETIC MATERIALS; FERROMAGNETISM; FLOW INTERACTIONS; LITHIUM; MAGNETIC MATERIALS; NICKEL; PROBABILITY DENSITY FUNCTION; SEMICONDUCTING ZINC COMPOUNDS; SYNTHETIC METALS; ZINC ALLOYS; ZINC OXIDE;

CO-DOPED; DENSITY FUNCTIONAL; FERROMAGNETIC ORDERING; FERROMAGNETIC STATES; FIRST-PRINCIPLE ELECTRON THEORY; FIRST-PRINCIPLES CALCULATIONS; GGA METHOD; MAGNETIC INTERACTIONS; MAGNETIC SEMICONDUCTORS; NI IONS;

NICKEL ALLOYS;

EID: 49549094703     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2007.12.012     Document Type: Article

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