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Appl. Phys. Lett. 82, 559 (2003); http://dx.doi.org/10.1063/1.1539543 (3 pages)

Failure of nitrogen cluster states to emerge into the bandgap of GaAsN with application of pressure

P. R. C. Kent and Alex Zunger

National Renewable Energy Laboratory, Golden, Colorado 80401

(Received 6 September 2002; accepted 25 November 2002)

The electronic structure of GaAsN alloys was previously described in terms of nitrogen “cluster states” (CS) that exist in the dilute alloy in the bandgap, and “perturbed host states” (PHS) inside the conduction band. As the nitrogen concentration increases, the PHS plunge down in energy overtaking the CS. We show theoretically that the CS respond to the application of pressure in two different ways: the highly localized deep CS emerge (or remain) in the gap, because their pressure coefficient is lower than that of the conduction band minimum. In contrast, the shallow CS (first to be overtaken) hybridize so strongly with the conduction band that their pressure coefficient becomes comparable to that of the conduction states. These states fail to emerge into the gap upon application of pressure because they move, with application of pressure, at a similar rate with conduction states. © 2003 American Institute of Physics.

© 2003 American Institute of Physics

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KEYWORDS and PACS

PACS

  • 71.20.Nr

    Semiconductor compounds

  • 81.05.Ea

    III-V semiconductors

  • 71.55.Eq

    III-V semiconductors

  • 71.15.Dx

    Computational methodology (Brillouin zone sampling, iterative diagonalization, pseudopotential construction)

  • 62.50.-p

    High-pressure effects in solids and liquids

ARTICLE DATA

PUBLICATION DATA

ISSN

0003-6951 (print)  
1077-3118 (online)

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