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S.C.F. calculations for Li2S : II. Analysis of wavefunction

✍ Scribed by Dobson, J.C.; Hinchliffe, A.


Book ID
115469373
Publisher
Taylor and Francis Group
Year
1975
Tongue
English
Weight
368 KB
Volume
29
Category
Article
ISSN
0026-8976

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Charge distribution analysis in terms of
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## 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 separa