Strain-mediated bandgap and optical response tuning in Se-Doped GaS monolayers: a DFT study
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DOI: 10.1080/00268976.2025.2501280
Abstract: In this paper, the geometrical structure, structural stability, and optical properties of selenium-doped monolayer gallium sulfide (GaS) systems are investigated under biaxial strain conditions by first-principles calculations based on density functional theory (DFT). The introduction… read more here.
Keywords: strain mediated; mediated bandgap; structure; bandgap optical ... See more keywords