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Calculation of overlap integrals over Slater-type spinor orbitals of arbitrary half-integral spin using auxiliary functions

✍ Scribed by Guseinov, I.I.; Aydın, R.; Bağcı, A.


Book ID
120619576
Publisher
Taylor and Francis Group
Year
2012
Tongue
English
Weight
122 KB
Volume
92
Category
Article
ISSN
1478-6435

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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 indivi