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- W2029809905 abstract "Band structure of the Ge-doped anatase TiO <sub xmlns:mml=http://www.w3.org/1998/Math/MathML xmlns:xlink=http://www.w3.org/1999/xlink>2</sub> has been analyzed using the full potential-linearized augmented plane wave method (FP-LAPW). We investigated the band structure of the Ge-doped anatase TiO <sub xmlns:mml=http://www.w3.org/1998/Math/MathML xmlns:xlink=http://www.w3.org/1999/xlink>2</sub> using generalized gradient approximation (GGA) and local density approximation (LDA). Compared our calculated optimized structure of the Ge doped with the pure anatase TiO <sub xmlns:mml=http://www.w3.org/1998/Math/MathML xmlns:xlink=http://www.w3.org/1999/xlink>2</sub> , it can be concluded that the volume of the Ge-doped anatase become reduced. The calculated band structure prefers an indirect transition between valence and conduction band of the Ge-doped anatase TiO <sub xmlns:mml=http://www.w3.org/1998/Math/MathML xmlns:xlink=http://www.w3.org/1999/xlink>2</sub> . The calculated results are in good agreement with the other calculated results." @default.
- W2029809905 created "2016-06-24" @default.
- W2029809905 creator A5052897084 @default.
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- W2029809905 date "2011-07-01" @default.
- W2029809905 modified "2023-09-27" @default.
- W2029809905 title "First-principle calculation of Ge-doped anatase TiO<inf>2</inf>" @default.
- W2029809905 cites W1977180338 @default.
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- W2029809905 doi "https://doi.org/10.1109/mace.2011.5987900" @default.
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