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Theoretical Study of Hydrogen in Cubic Gan

Published online by Cambridge University Press:  15 February 2011

Stefan K. Estreicher  and
Djordje M. Maric
Stefan K. Estreicher
Affiliation:
Physics Department, Texas Tech University, Lubbock, TX 79409 - USA
Djordje M. Maric
Affiliation:
Swiss Center for Scientific Computing, 6928 Manno- Switzerland
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Abstract

Preliminary results of theoretical studies of hydrogen and hydrogen-related defects in cubic GaN are reported. Our calculations contrast with those of other authors in that the host crystal is represented by molecular clusters rather than periodic supercells, and that they are obtained using an all-electron methodology rather than the single effectiveparticle approach of density-functional theory. Our results confirm some predictions of other authors but conflict with others.

Type
Research Article
Information
MRS Online Proceedings Library (OPL) , Volume 423: Symposium E – III-Nitride, SiC, and Diamond Materials for Electronic , 1996 , 613
Copyright
Copyright © Materials Research Society 1996

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