Treecode-accelerated Green iteration for Kohn-Sham density functional theory (Q2124890)

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Treecode-accelerated Green iteration for Kohn-Sham density functional theory
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    Treecode-accelerated Green iteration for Kohn-Sham density functional theory (English)
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    11 April 2022
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    all-electron Kohn-Sham density functional theory
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    real-space integral equation
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    Green iteration
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    \textit{a-priori} adaptive mesh refinement
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    barycentric Lagrange treecode
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    GPU acceleration
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