Effect of hydrogen on magnetic properties in MgO studied by first-principles calculations and experiments

Abstract We investigated the effects of both intrinsic defects and hydrogen atom impurities on the magnetic properties of MgO samples. MgO in its pure defect-free state is known to be a nonmagnetic semiconductor. We employed density-functional theory and the Heyd–Scuseria–Ernzerhof (HSE) density fun...

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Bibliographic Details
Main Authors: Ittipon Fongkaew, Benjaporn Yotburut, Wutthigrai Sailuam, Warakorn Jindata, Theerawee Thiwatwaranikul, Atchara Khamkongkaeo, Nattapong Chuewangkam, Nantawat Tanapongpisit, Wittawat Saenrang, Rapee Utke, Prasit Thongbai, Supree Pinitsoontorn, Sukit Limpijumnong, Worawat Meevasana
Format: Article
Language:English
Published: Nature Portfolio 2022-06-01
Series:Scientific Reports
Online Access:https://doi.org/10.1038/s41598-022-13949-w