Chem. J. Chinese Universities ›› 1993, Vol. 14 ›› Issue (12): 1705.

• Articles • Previous Articles     Next Articles

The Relationship Between the Centroids of the Localized Molecular Orbitals and Molecular Structure

LIANG Guo-Ming, TIAN An-Min, YAN Guo-Sen   

  1. Department of Chemistry, Sichuan University, Chengdu, 610064
  • Received:1993-01-12 Revised:1993-07-12 Online:1993-12-24 Published:1993-12-24

Abstract: The relationship between the centroids of the localized molecular orbitals (LMO) and the chemical bonds in molecules has been discussed.Amethod through LMO's centroids to determine the bonding behavior and various bond types is given.

Key words: Centroid of the localized molecular orbitals, Chemical bond, Molecular structure

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