Band Structures of Wurtzite InN and Ga1-xInxN by All-Electron GW Calculation

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  • Band Structures of Wurtzite InN and Ga<sub>1-<i>x</i></sub>In<sub><i>x</i></sub>N by All-Electron<i>G</i><i>W</i>Calculation

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Abstract

The experimentally reported bandgap of wurtzite-type InN dramatically decreased from 1.9 eV to 0.7–0.8 eV very recently. In this paper we report first-principles electronic band-structure calculations of InN by using the all-electron full-potential linearized augmented-plane-wave (FLAPW) method in both local-density approximation (LDA) and GW approximation (GWA), and provide the reliable theoretical bandgap of InN. Our calculation suggests that InN is a narrow-gap semiconductor and strongly supports the recently reported smaller bandgaps. Moreover, we reproduce the bandgap change of Ga1−xInxN ternary alloys as a function of In content x. The present work supports the possibility of bandgap control in the entire range of visible light, using nitrides alone.

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