mBJ-DFT and VFF-plus-tight-binding models reproduce hybrid-DFT structural and band-edge results for Ge1-xSnx alloys, providing a validated, scalable modeling platform.
Saito , author A
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Comparison of first principles and semi-empirical models of the structural and electronic properties of Ge$_{1-x}$Sn$_{x}$ alloys
mBJ-DFT and VFF-plus-tight-binding models reproduce hybrid-DFT structural and band-edge results for Ge1-xSnx alloys, providing a validated, scalable modeling platform.