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Semiempirical description of the diamagnetic susceptibilities of aromatic molecules

โœ Scribed by O'Sullivan, Patricia S.; Hameka, Hendrik F.


Book ID
127144703
Publisher
American Chemical Society
Year
1970
Tongue
English
Weight
477 KB
Volume
92
Category
Article
ISSN
0002-7863

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CNDO calculation of the diamagnetic susc
โœ A. Boucekkine ๐Ÿ“‚ Article ๐Ÿ“… 1980 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 229 KB

## Abstract We present the results obtained within the CNDO/2 method for the diamagnetic susceptibilities of a series of conjugated molecules including benzene, fulvene, pyridine, pyrrole, and furan. The calculations have been carried out, according to Bley's method, in the framework of coupled Har