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- W2060115485 abstract "Symbolic calculation is applied to the evaluation of molecular integrals over Slater orbitals (STOs). A recurrence scheme is developed for some new auxiliary functions that facilitate this work. Closed expressions are developed independently for use in spot checks. A table of formulas for the individual functions has been constructed and made available on-line. Applications are discussed. The derivations and tabulations were performed mechanically in runs that produced both the original typeset account of this study and more detailed documentation without manual transcription. © 2000 John Wiley & Sons, Inc. Int J Quant Chem 76: 464–472, 2000" @default.
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- W2060115485 date "2000-01-01" @default.
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- W2060115485 title "Symbolic calculation of auxiliary functions for molecular integrals over slater orbitals" @default.
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- W2060115485 doi "https://doi.org/10.1002/(sici)1097-461x(2000)76:3<464::aid-qua15>3.0.co;2-e" @default.
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