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