Numerical analysis of augmented plane wave methods for full-potential electronic structure calculations (Q5254429): Difference between revisions

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Revision as of 22:24, 19 March 2024

scientific article; zbMATH DE number 6444079
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Numerical analysis of augmented plane wave methods for full-potential electronic structure calculations
scientific article; zbMATH DE number 6444079

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    Numerical analysis of augmented plane wave methods for full-potential electronic structure calculations (English)
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    9 June 2015
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    Kohn-Sham density functional theory
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    linearized augmented plane wave
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    error estimates
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    electronic structure
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    linear eigenvalue problem
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    ground state solution
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    Kohn-Sham equations
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    numerical examples
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