Room-temperature diffusive phenomena in semiconductors: The case of AlGaN

Keith H. Warnick, Yevgeniy Puzyrev, Tania Roy, Daniel M. Fleetwood, Ronald D. Schrimpf, and Sokrates T. Pantelides
Phys. Rev. B 84, 214109 – Published 20 December 2011

Abstract

Diffusion mediated by native point defects does not generally occur in semiconductors at room temperature (RT) because of high activation energies. However, recently observed plastic deformation in AlGaN/GaN structures in the presence of strain and electric fields was attributed to diffusive processes. Here, we report first-principles calculations showing that strain has little effect, but RT mass transport is enabled by near-zero formation energy of triply negative cation vacancies and a concomitant electric-field-induced lowering of migration energy. Similar phenomena are predicted to occur in other large-gap materials.

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  • Received 16 May 2011

DOI:https://doi.org/10.1103/PhysRevB.84.214109

©2011 American Physical Society

Authors & Affiliations

Keith H. Warnick1,*, Yevgeniy Puzyrev1, Tania Roy2, Daniel M. Fleetwood1,2, Ronald D. Schrimpf2, and Sokrates T. Pantelides1,2,3

  • 1Department of Physics and Astronomy, Vanderbilt University, Nashville, Tennessee 37235, USA
  • 2Department of Electrical Engineering and Computer Science, Vanderbilt University, Nashville, Tennessee 37235, USA
  • 3Materials Science and Technology Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831, USA

  • *keith.h.warnick@vanderbilt.edu

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Vol. 84, Iss. 21 — 1 December 2011

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