New method to evaluate atomic electron-repulsion integrals (Q2638719)
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| Language | Label | Description | Also known as |
|---|---|---|---|
| English | New method to evaluate atomic electron-repulsion integrals |
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New method to evaluate atomic electron-repulsion integrals (English)
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1990
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Some special improper integrals of the first kind are solved numerically by use of 20-point Gauss-Laguerre quadrature. These integrals appear in atomic electronic structure calculations by orbital methods.
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improper integrals
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Gauss-Laguerre quadrature
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atomic electronic structure calculations
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orbital methods
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