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author:

Weng, Zhenzhen (Weng, Zhenzhen.) [1] (Scholars:翁臻臻) | Huang, Zhigao (Huang, Zhigao.) [2] | Lin, Wenxiong (Lin, Wenxiong.) [3]

Indexed by:

EI Scopus SCIE

Abstract:

Using first-principles density functional calculations, we have investigated the electronic structures of Ti-doped ZnO (Ti is in 4+ oxidation state) with and without oxygen vacancy. The ferromagnetic property is identified in the presence of oxygen vacancy despite Ti being nonmagnetic in its natural phase. The ferromagnetism originates from the charge transferring from donor derived-defect band to unoccupied Ti-3d states and the hybridization between Ti-3d and O-2p band near the Fermi level. On increasing the oxygen vacancy concentration, a transition from a long-ranged magnetic order to a short-ranged interaction is found and the oxygen vacancies prefer to distribute non-uniformly in Ti-doped ZnO. Crown Copyright (C) 2011 Published by Elsevier B.V. All rights reserved.

Keyword:

Ferromagnetism First-principle Oxygen vacancy Ti-doped ZnO

Community:

  • [ 1 ] [Huang, Zhigao]Fujian Normal Univ, Dept Phys, Fuzhou 350007, Peoples R China
  • [ 2 ] [Weng, Zhenzhen]Chinese Acad Sci, Fujian Inst Res Struct Matter, Fuzhou 350002, Peoples R China
  • [ 3 ] [Lin, Wenxiong]Chinese Acad Sci, Fujian Inst Res Struct Matter, Fuzhou 350002, Peoples R China
  • [ 4 ] [Weng, Zhenzhen]Fuzhou Univ, Coll Phys & Informat Engn, Fuzhou 350108, Peoples R China

Reprint 's Address:

  • [Huang, Zhigao]Fujian Normal Univ, Dept Phys, Fuzhou 350007, Peoples R China

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Source :

PHYSICA B-CONDENSED MATTER

ISSN: 0921-4526

Year: 2012

Issue: 4

Volume: 407

Page: 743-747

1 . 3 2 7

JCR@2012

2 . 8 0 0

JCR@2023

ESI Discipline: PHYSICS;

JCR Journal Grade:3

CAS Journal Grade:4

Cited Count:

WoS CC Cited Count: 8

SCOPUS Cited Count: 9

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 3

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