Repository logo

Infoscience

  • English
  • French
Log In
Logo EPFL, École polytechnique fédérale de Lausanne

Infoscience

  • English
  • French
Log In
  1. Home
  2. Academic and Research Output
  3. Journal articles
  4. Migration of Mg and other interstitial metal dopants in GaN
 
research article

Migration of Mg and other interstitial metal dopants in GaN

Miceli, Giacomo  
•
Pasquarello, Alfredo  orcid-logo
2017
Physica Status Solidi-Rapid Research Letters

The minimumenergy paths for the migration of interstitialMgin wurtziteGaNare studiedthroughdensityfunctional calculations. The study also comprises Li, Na, and Be dopants to examine the dependence on size and charge of the dopant species. In all cases considered, the impurities diffuse like ions without any tendency of localizing charge. Li, Mg, and to some extent Na, diffuse almost isotropically in GaN, with average diffusion barriers of 1.1, 2.1, and 2.5 eV, respectively. Instead Be shows a marked anisotropy with energy barriers of 0.76 and 1.88 eVfor diffusion paths perpendicular and parallel to the c-axis. The diffusion barrier generally increases with ionic charge and ionic radius, but their interplay is not trivial. The calculated migration barrier for Mg is consistent with the values estimated in a recent beta(-) emission channeling experiment. (C) 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim

  • Files
  • Details
  • Versions
  • Metrics
Loading...
Thumbnail Image
Name

diffusion.pdf

Type

Main Document

Version

Accepted version

Access type

openaccess

License Condition

N/A

Size

535.22 KB

Format

Adobe PDF

Checksum (MD5)

9b6c2f31ea9fe3abc8d1da51665b9eb9

Logo EPFL, École polytechnique fédérale de Lausanne
  • Contact
  • infoscience@epfl.ch

  • Follow us on Facebook
  • Follow us on Instagram
  • Follow us on LinkedIn
  • Follow us on X
  • Follow us on Youtube
AccessibilityLegal noticePrivacy policyCookie settingsEnd User AgreementGet helpFeedback

Infoscience is a service managed and provided by the Library and IT Services of EPFL. © EPFL, tous droits réservés