\texttt{LIBERI}: Library for numerical evaluation of electron-repulsion integrals (Q547053): Difference between revisions

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Property / cites work: Electronic wave functions - I. A general method of calculation for the stationary states of any molecular system / rank
 
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Property / cites work: Numerical Fourier and Bessel transforms in logarithmic variables / rank
 
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Property / cites work: Fast spherical Bessel transform via fast Fourier transform and recurrence formula / rank
 
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Latest revision as of 21:06, 9 December 2024

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\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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