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SCF Calculations on excited states

✍ Scribed by James W. Caldwell; Mark S. Gordon

Publisher: Elsevier Science
Year: 1976
Tongue: English
Weight: 471 KB
Volume: 43
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(76)80608-2

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✦ Synopsis

The form&m recently developed by Poplc and co-workers for restricted Ilartree-Fock calculattons on high spin ogcn sliells is extended to ;1 general trcatmcnt of singly cxclted states. The limrtations of the method and possible alternativr approachcs are briefly discussed.

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