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

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A Kohn-Sham equation solver based on hexahedral finite elements
scientific article

    Statements

    title
    A Kohn-Sham equation solver based on hexahedral finite elements (English)
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    author
    Jun Fang
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    Xingyu Gao
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    Aihui Zhou
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    publication date
    14 May 2012
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    zbMATH Keywords
    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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    describes a project that uses
    deal.ii
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    PARSEC
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    Identifiers

    Mathematics Subject Classification ID
    82B10
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    35Q55
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    82-08
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    65N30
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    65N50
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    zbMATH DE Number
    6034742
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    OpenAlex ID
    W2039113872
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