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• W1970040244 abstract "We propose Cholesky decomposition (CD) of the atomic two-electron integral matrix as a robust and general technique for generating auxiliary basis sets for the density fitting approximation. The atomic CD (aCD) auxiliary basis set is calculated on the fly and is not biased toward a particular quantum chemical method. Moreover, the accuracy of the aCD basis set can be controlled with a single parameter." @default.
• W1970040244 created "2016-06-24" @default.
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• W1970040244 date "2007-09-19" @default.
• W1970040244 modified "2023-10-17" @default.
• W1970040244 title "Unbiased auxiliary basis sets for accurate two-electron integral approximations" @default.
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• W1970040244 doi "https://doi.org/10.1063/1.2777146" @default.
• W1970040244 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/17887828" @default.
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