ISSN:
1432-2234
Keywords:
Bonding energies and bond orders
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Abstract A transition state method has been proposed for the calculation of bonding energies and bond distances within the Hartree Fock Slater Method. Calculations on a number of diatomic molecules and a few transition metal complexes show better agreement with experiment than corresponding Hartree Fock results. The proposed transition state method gives a direct connection between bond orders and bonding energies.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF02401406
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