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Article
Role of Embedded Clustering in Dilute Magnetic Semiconductors: Cr Doped GaN
Physical Review Letters
  • Julia E. Medvedeva, Missouri University of Science and Technology
  • B. Delley
  • N. Newman
  • C. Stampfl
  • X. Y. Cui
  • Arthur J. Freeman
Abstract

Results of extensive density-functional studies provide direct evidence that Cr atoms in Cr:GaN have a strong tendency to form embedded clusters, occupying Ga sites. Significantly, for larger than 2-Cr-atom clusters, states containing antiferromagnetic coupling with net spin in the range 0.06-1.47 µB/Cr are favored. We propose a picture where various configurations coexist and the statistical distribution and associated magnetism will depend sensitively on the growth details. Such a view may elucidate many puzzling observations related to the structural and magnetic properties of III-N and other dilute semiconductors.

Department(s)
Physics
Sponsor(s)
Australian Research Council
United States. Defense Advanced Research Projects Agency
Keywords and Phrases
  • III-V Semiconductors,
  • Density Functional Theory,
  • Semimagnetic Semiconductors,
  • Wide Band Gap Semiconductors,
  • Antiferromagnetism,
  • Chromium,
  • Gallium compounds
Document Type
Article - Journal
Document Version
Final Version
File Type
text
Language(s)
English
Rights
© 2005 American Physical Society (APS), All rights reserved.
Publication Date
1-1-2005
Publication Date
01 Jan 2005
Disciplines
Citation Information
Julia E. Medvedeva, B. Delley, N. Newman, C. Stampfl, et al.. "Role of Embedded Clustering in Dilute Magnetic Semiconductors: Cr Doped GaN" Physical Review Letters (2005) ISSN: 0031-9007
Available at: http://works.bepress.com/julia-medvedeva/26/