Solution of the large matrix equations which occur in response theory (Q1098233)
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| English | Solution of the large matrix equations which occur in response theory |
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Solution of the large matrix equations which occur in response theory (English)
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1988
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Algorithms are described for specially structured large generalized eigenvalue problems arising in linear response theory for real wave functions. The algorithms are similar to the Lanczos and conjugate gradient methods generalized to generalized eigenvalue problems. Only few eigenvalues are required and obtained by exploiting the structure of the pencil. Numerical examples are given.
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Lanczos method
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large generalized eigenvalue problems
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linear response theory
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wave functions
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conjugate gradient methods
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pencil
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Numerical examples
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