Evaluating Hellmann-Feynman forces within non-local pseudopotentials (Q2698863)
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scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Evaluating Hellmann-Feynman forces within non-local pseudopotentials |
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Evaluating Hellmann-Feynman forces within non-local pseudopotentials (English)
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25 April 2023
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Hellmann-Feynman forces
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separable pseudopotentials
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density functional theory
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convergence
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real-space
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finite element method
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