Pole Expansion for Solving a Type of Parametrized Linear Systems in Electronic Structure Calculations (Q5176057)

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scientific article; zbMATH DE number 6409874
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Pole Expansion for Solving a Type of Parametrized Linear Systems in Electronic Structure Calculations
scientific article; zbMATH DE number 6409874

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    Pole Expansion for Solving a Type of Parametrized Linear Systems in Electronic Structure Calculations (English)
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    2 March 2015
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    pole expansion
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    parametrized linear systems
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    electronic structure calculation
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    parallel computation
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    numerical examples
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    direct solver
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    iterative solver
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    benzene molecule
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    DNA molecule
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