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Towards an adequate molecular orbital interpretation of the ultraviolet spectrum of the permanganate ion

✍ Scribed by R.D. Brown; B.H. James; M.F. O'Dwyer; K.R. Roby

Publisher
Elsevier Science
Year
1967
Tongue
English
Weight
503 KB
Volume
1
Category
Article
ISSN
0009-2614

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✦ Synopsis

VESCFCICNDO calculation of the excited states of the permanganate

anion has been carried out. The necessity of including electron interaction in a way that is rotationally invariant is stressed and the significance of configuration interaction is illustrated.

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