A DFT based ligand field model for magnetic exchange coupling in transition metal dimer complexes:
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference23 articles.
1. Molecular Magnetism;Kahn,1993
2. New Approach to the Theory of Superexchange Interactions
3. Orbital interactions in metal dimer complexes
4. Ab initio direct calculation of the singlet-triplet separation in cupric acetate hydrate dimer
5. Ab initio study of the singlet—triplet splitting in simple models for dichloro- and difluoro-bridged Cu(II) dimers
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