ON HUCKEL-HUBBARD CORRELATION DIAGRAMS

Authors
Citation
Hy. Zhu et Ys. Jiang, ON HUCKEL-HUBBARD CORRELATION DIAGRAMS, Huaxue xuebao, 51(6), 1993, pp. 527-533
Citations number
17
Categorie Soggetti
Chemistry
Journal title
ISSN journal
05677351
Volume
51
Issue
6
Year of publication
1993
Pages
527 - 533
Database
ISI
SICI code
0567-7351(1993)51:6<527:OHCD>2.0.ZU;2-U
Abstract
In order to contrast the Huckel molecular orbital theory (HMO) with a simple valence bond theory (Heisenberg-Dirac model), which are two opp osite asymptotic limit cases of the Hubbard model, Hubbard problems ha ve been solved for four sites systems with four electrons. The Huckel- Hubbard correlation diagrams, where employs a parameter: U/t, have bee n obtained for these system. From correlation diagrams some interested results have been deduced in detail.