Mechanisms of the Wurtzite to Rock Salt Phase Transitions in Galium Nitride

Mechanisms of the Wurtzite to Rock Salt Phase Transitions in Galium Nitride

We studied the wurtzite to rock salt phase transition in gallium nitride ( GaN ). Using the mapping algorithm of COMSUBS we found 435 possible mechanisms for this transition. We then used FIREBALL to do density functional theory calculations and found enthalpy barrier heights for the transition path...

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Bibliographic Details
Main Author: Gunter, Jesse Z.
Format: Others
Published: BYU ScholarsArchive 2006
Subjects:
GaN
phase transition
wurtzite
FIREBALL
COMSUBS
rock salt
Astrophysics and Astronomy
Physics
Online Access:https://scholarsarchive.byu.edu/etd/880
https://scholarsarchive.byu.edu/cgi/viewcontent.cgi?article=1879&context=etd

Internet

https://scholarsarchive.byu.edu/etd/880
https://scholarsarchive.byu.edu/cgi/viewcontent.cgi?article=1879&context=etd

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