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Application of Racah algebra for point groups to the calculation of the energy spectra of complexes

✍ Scribed by A. A. Shchetkov; V. I. Cherepanov


Book ID
112417794
Publisher
Springer
Year
1971
Tongue
English
Weight
218 KB
Volume
14
Category
Article
ISSN
1573-9228

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## Abstract We have developed a method for calculating the association energy of quaternary complexes starting from their atomic coordinates. The association energy is described as the sum of two solvation terms and an energy term to account for the loss of translational and rotational entropy. The