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Charge distribution analysis in terms of Berlin's binding and antibinding regions for Li2 and F2

✍ Scribed by Marilena Zuvia; Eduardo V. Ludeña


Book ID
104579334
Publisher
John Wiley and Sons
Year
1978
Tongue
English
Weight
589 KB
Volume
14
Category
Article
ISSN
0020-7608

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✦ Synopsis


Abstract

The MCSCF wave functions of Das for Li~2~, and Das and Wahl for F~2~, have been analyzed in terms of Berlin's binding and antibinding regions. The effect of electronic correlation on the charge distributions in these regions is studied. The process of bond formation in going from separated atoms to the correlated molecule is also discussed with reference to Berlin's regions.


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