First-principles study on non-radiative carrier captures of point defects associated with proton generation in silica

The non-radiative carrier captures of point defects associated with proton generation in both crystalline (α-quartz) and amorphous silica (a-SiO2) have been investigated by using first-principles calculations based on the density functional theory. Major point defects related to proton generation ar...

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Bibliographic Details
Main Authors: Yunliang Yue, Haoran Zhu, Xiao Liu, Yu Song, Xu Zuo
Format: Article
Language:English
Published: AIP Publishing LLC 2021-01-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/5.0033421