Radial and three-dimensional nonlocal pseudopotential calculations in gradient-corrected Kohn-Sham density functional theory based on higher-order finite element methods (Q2246291): Difference between revisions
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Revision as of 18:26, 14 February 2024
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Radial and three-dimensional nonlocal pseudopotential calculations in gradient-corrected Kohn-Sham density functional theory based on higher-order finite element methods |
scientific article |
Statements
Radial and three-dimensional nonlocal pseudopotential calculations in gradient-corrected Kohn-Sham density functional theory based on higher-order finite element methods (English)
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16 November 2021
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Kohn-Sham density functional theory
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nonlocal pseudopotentials
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higher-order finite element methods
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isogeometric analysis
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generalized eigenvalue problems
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