Please use this identifier to cite or link to this item:
|Title:||Calculation of exchange interaction in exchange coupled dimers|
|Citation:||Journal of Molecular Structure: THEOCHEM, 361(1-3 SPEC. ISS), 161-173|
|Abstract:||In an effort to study the magnetostructural correlations in exchange coupled dimers, an attempt has been made to calculate the isotropic exchange using the molecular orbitals of unpaired electrons from extended Huckel theory methods. Calculation of the total isotropic exchange in a variety of Ni(III) dithiolene complexes is presented. Using the programs developed to obtain the antiferromagnetic and ferromagnetic contributions to the total exchange, various model systems have also been studied in order to get a good understanding of the variations of the two individual contributions with structural changes.|
|Appears in Collections:||Articles|
Files in This Item:
There are no files associated with this item.
Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.