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A fast automated method for calculating the EOG Arden ratio

โœ Scribed by Sarossy, Marc G.; Lee, Matthew H. A.; Bach, Michael


Book ID
125358884
Publisher
Springer-Verlag
Year
2014
Tongue
English
Weight
968 KB
Volume
128
Category
Article
ISSN
0012-4486

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A simple empirical method for the calculation of static molecular polarizability is described. The method is based on Slater's rules for the calculation of effective atomic nuclear shielding constants. The calculated molecular polarizabilities of a series of organic molecules correlated well (r = 0.