$\mathit{Abinitio}$ search for the precise location of an Fe atom in a $1{T}^{′}{\text{-WTe}}_{2}$ monolayer
Aps.org·October 5, 2026
In this study, using density functional theory, we investigate the structural, electronic, and magnetic properties of Fe adatom, interstitial, and substitutional configurations in monolayer ${1T}^{\ensuremath{'}}{\text{-WTe}}_{2}$. We find that under Te-poor …
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