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Evaluation of multielectron molecular integrals over Slater-type orbitals using binomial coefficients

✍ Scribed by I.I. Guseinov


Book ID
114142553
Publisher
Elsevier Science
Year
1997
Tongue
English
Weight
375 KB
Volume
417
Category
Article
ISSN
0166-1280

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πŸ“œ SIMILAR VOLUMES


On the evaluation of overlap integrals w
✍ I. I. Guseinov; Aslan Δ°liΛ™k; S. I. Allahverdiyev πŸ“‚ Article πŸ“… 1996 πŸ› John Wiley and Sons 🌐 English βš– 196 KB πŸ‘ 2 views

A general formula has been established for the overlap integrals with the same screening parameters of Slater-type orbitals in terms of bionomial coefficients. The final results are especially useful for the calculation of these integrals for large quantum numbers, which occur in the multicenter int

On the calculation of arbitrary multiele
✍ I. I. Guseinov; B. A. Mamedov πŸ“‚ Article πŸ“… 2000 πŸ› John Wiley and Sons 🌐 English βš– 186 KB πŸ‘ 2 views

Using expansion formulas for the charge-density over Slater-type orbitals (STOs) obtained by the one of authors [I. I. Guseinov, J Mol Struct (Theochem) 1997, 417, 117] the multicenter molecular integrals with an arbitrary multielectron operator are expressed in terms of the overlap integrals with t