安心地散步 发表于 2025-3-25 06:12:39

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Odyssey 发表于 2025-3-25 09:53:12

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molest 发表于 2025-3-25 13:37:13

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亲密 发表于 2025-3-25 16:35:34

The Philosophy and Strategy for STO Integral Evaluation Using the C-Matrix Algebraic Single-Center as into appropriate Taylor series. The policy of carrying out all algebraic manipulations by computer and using different formulas for different ranges of parameters re-establishes the use of formulas for integral evaluation after the abandonment of this approach many years ago.

Limited 发表于 2025-3-25 20:23:14

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DUST 发表于 2025-3-26 03:08:17

Slater.. These functions may then properly be called orthonormal Slaters (ONSs). The radial parts may be constructed, as Slater points out, by an analytical Gram-Schmidt process from the minimum n-quantum number, normalized radial Slaters.

类型 发表于 2025-3-26 06:42:25

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后退 发表于 2025-3-26 12:08:24

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Perennial长期的 发表于 2025-3-26 16:00:31

lude the power series expansions for small arguments, and continued-fraction or asymptotic expansions for large arguments.. None of these methods are fast for a large intermediate argument range, and the integrals are often evaluated by finite numerically fitted Chebyshev. or rational-fraction. expansions.

地名表 发表于 2025-3-26 20:42:45

integration variables are to be defined with respect to one common center. Therefore, it is necessary to express all those exponential-type functions (ETF’s) and operators, which occur in the integrand, with respect to the chosen fixed reference system of integration. This causes serious problems b
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查看完整版本: Titlebook: ETO Multicenter Molecular Integrals; Proceedings of the F Charles A. Weatherford,Herbert W. Jones Conference proceedings 1982 D. Reidel Pub