\texttt{LIBERI}: Library for numerical evaluation of electron-repulsion integrals (Q547053): Difference between revisions
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ab initio calculations | |||
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exchange interactions | |||
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exchange-correlation functionals | |||
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numerical examples | |||
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\texttt{C library} | |||
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four-center electron repulsion integrals | |||
Property / zbMATH Keywords: four-center electron repulsion integrals / rank | |||
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Fourier transforms | |||
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atomic nuclear positions | |||
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Coulomb interaction | |||
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Revision as of 11:40, 1 July 2023
scientific article
Language | Label | Description | Also known as |
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English | \texttt{LIBERI}: Library for numerical evaluation of electron-repulsion integrals |
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\texttt{LIBERI}: Library for numerical evaluation of electron-repulsion integrals (English)
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30 June 2011
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ab initio calculations
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exchange interactions
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exchange-correlation functionals
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numerical examples
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\texttt{C library}
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four-center electron repulsion integrals
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Fourier transforms
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atomic nuclear positions
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Coulomb interaction
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