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DFT calculation results. Electronic band structure of a)... | Download ...
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FIG. S3. The DFT band structure along W (0.5, 0.25, 0.75) -L (0.5, 0.5 ...
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The theoretical band structures of ScF3:x D…
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DFT-calculated band structure (left) and densit…
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First-principles DFT band structure calculations a Slab geometry with ...
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9: Computed result of DFT band structure is plotted along with the ...
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14: DFT band structure of the different systems wit…
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