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Recurrence formulas for molecular integrals over Laguerre Gaussian-type functions

✍ Scribed by Fusanori Arakane; Osamu Matsuoka

Publisher: John Wiley and Sons
Year: 1998
Tongue: English
Weight: 152 KB
Volume: 66
Category: Article
ISSN: 0020-7608
DOI: 10.1002/(sici)1097-461x(1998)66:4<273::aid-qua2>3.0.co;2-s

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✦ Synopsis

Recurrence formulas for overlap, nuclear attraction, and electronrepulsion integrals over Laguerre Gaussian-type functions are presented. They have been derived using compact recurrence relations for homogeneous solid spherical harmonic operators but are rather lengthy as compared to those over Cartesian Gaussian-type functions.

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