Preconditioning Orbital Minimization Method for Planewave Discretization (Q5737751)
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scientific article; zbMATH DE number 6724167
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English | Preconditioning Orbital Minimization Method for Planewave Discretization |
scientific article; zbMATH DE number 6724167 |
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Preconditioning Orbital Minimization Method for Planewave Discretization (English)
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30 May 2017
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Kohn-Sham density functional theory
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orbital minimization method
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preconditioning
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Fermi operator projection
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pole expansion
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sparsifying preconditioner
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pseudospectral method
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Hamiltonian operators
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numerical results
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