On Stabilizing and Accelerating SCF Using ITP in Solving Kohn–Sham Equation (Q5162325)
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scientific article; zbMATH DE number 7419122
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | On Stabilizing and Accelerating SCF Using ITP in Solving Kohn–Sham Equation |
scientific article; zbMATH DE number 7419122 |
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On Stabilizing and Accelerating SCF Using ITP in Solving Kohn–Sham Equation (English)
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2 November 2021
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self-consistent field iteration
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imaginary time propagation
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finite element method
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all-electron calculation
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