Rapid filtration algorithm to construct a minimal basis on the fly from a primitive Gaussian basis (Q536914)

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Rapid filtration algorithm to construct a minimal basis on the fly from a primitive Gaussian basis
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    Rapid filtration algorithm to construct a minimal basis on the fly from a primitive Gaussian basis (English)
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    31 May 2011
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    Gaussian orbitals
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    filtration
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    diagonalisation
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    rational approximation
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