Boron as a passivating dopant of oxygen-vacancy-induced hole traps at GaN/SiO2 interface

Recent experiments followed by our first-principles calculations have shown that heavily Mg-doped GaN epitaxial layers suppress hole traps due to oxygen vacancy V _O in the GaO _x interfacial layer at the GaN/SiO _2 interfaces, but leave a serious issue of controlling hole-concentration profiles. In...

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Bibliographic Details
Main Authors: Yuansheng Zhao, Atsushi Oshiyama, Kenji Shiraishi
Format: Article
Language:English
Published: IOP Publishing 2025-01-01
Series:Applied Physics Express
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Online Access:https://doi.org/10.35848/1882-0786/adece5
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Summary:Recent experiments followed by our first-principles calculations have shown that heavily Mg-doped GaN epitaxial layers suppress hole traps due to oxygen vacancy V _O in the GaO _x interfacial layer at the GaN/SiO _2 interfaces, but leave a serious issue of controlling hole-concentration profiles. In this Letter, we demonstrate from first-principles calculations that B at the Ga site forms complexes with V _O at the interface and consequently annihilates the hole traps, opening a possibility of passivating these traps without degrading the controllability of the hole-density profiles. The microscopic reason behind the passivation phenomenon is clarified to be the formation of π bonding.
ISSN:1882-0786