Parallel empirical pseudopotential electronic structure calculations for million atom systems (Q1979124)

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scientific article; zbMATH DE number 1452587
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    Parallel empirical pseudopotential electronic structure calculations for million atom systems
    scientific article; zbMATH DE number 1452587

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      Parallel empirical pseudopotential electronic structure calculations for million atom systems (English)
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      26 November 2000
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      million atom systems
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      density functional theory
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      conjugate gradients
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      pseudopotential
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      quantum dots
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      parallel computation
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      folded spectrum method
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      electronic structure
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      algorithm
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      performance
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      large semiconductor nanostructure systems
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