First-principles study on magnetism and electronic structure of V-doped rutile TiO2

Physics Letters, Section A: General, Atomic and Solid State Physics

Volumn 359, Issue 5, 2006, Pages 523-527

  Gao, G Y ^a   Yao, K L ^a,b,c   Liu, Z L ^a  

^a HUAZHONG UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

^b INTERNATIONAL CENTRE FOR MATERIALS PHYSICS   (China)

^c CCAST WORLD LABORATORY   (China)

Author keywords

Diluted magnetic semiconductors; Electronic structure; FP LAPW

Indexed keywords

CALCULATIONS; DILUTED MAGNETIC SEMICONDUCTORS; ELECTRONIC STRUCTURE; GROUND STATE; LOCAL DENSITY APPROXIMATION; MAGNETIC MOMENTS; MAGNETIC SEMICONDUCTORS; OXIDE MINERALS;

FERROMAGNETIC GROUND STATE; FIRST PRINCIPLES; FIRST-PRINCIPLES STUDY; FP-LAPW; FULL POTENTIAL LINEARIZED AUGMENTED PLANE WAVE METHOD; HALF METALS; RUTILE TIO2; TOTAL ENERGY CALCULATION;

TITANIUM DIOXIDE;

EID: 33749554462     PISSN: 03759601     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physleta.2006.06.076     Document Type: Article

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