NURBS-based non-periodic finite element framework for Kohn-Sham density functional theory calculations (Q777532)

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NURBS-based non-periodic finite element framework for Kohn-Sham density functional theory calculations
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    NURBS-based non-periodic finite element framework for Kohn-Sham density functional theory calculations (English)
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    7 July 2020
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    density functional theory
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    real space
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    finite elements
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    B-splines
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    all-electron
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    pseudopotential
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