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Calculation of two-center integrals using quadrature with the highest degree of algebraic accuracy

✍ Scribed by Yu. A. Borisov; N. N. Bulgakov; L. I. Chernyavskii

Book ID
104921912
Publisher
SP MAIK Nauka/Interperiodica
Year
1972
Tongue
English
Weight
96 KB
Volume
12
Category
Article
ISSN
0022-4766

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πŸ“œ SIMILAR VOLUMES

Improved algorithm for the calculation o
Improved algorithm for the calculation of one-electron two-center integrals with STOs
✍ J. FernΓ‘ndez Rico; R. LΓ³pez; G. RamΓ­rez πŸ“‚ Article πŸ“… 1989 πŸ› John Wiley and Sons 🌐 English βš– 467 KB πŸ‘ 1 views

In a previous article (J. Fernandez Rico, R. Upez and G. Ramirez, J. Comp. Chem., 9, 790 (1988)) we have proposed the calculation of molecular integrals involving STOs by means of some recurrence relations which use two sets (h and H) of overlap integrals (basic matrices). In the present paper, we d