A Kohn-Sham equation solver based on hexahedral finite elements (Q417846)

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scientific article; zbMATH DE number 6034742
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    A Kohn-Sham equation solver based on hexahedral finite elements
    scientific article; zbMATH DE number 6034742

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      A Kohn-Sham equation solver based on hexahedral finite elements (English)
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      14 May 2012
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      density functional theory
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      Kohn-Sham equation
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      hexahedral finite element
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      local refinement
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      modified mass-lumping
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      eigenpair recovery
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