Excitation Energy Dedicated Molecular Orbitals. Method and Applications to Magnetic Systems
Author:
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp0024975
Reference33 articles.
1. Comparison of the superexchange interaction in NiO and in a NiO[100] surface
2. Ab initio theoretical comparative study of magnetic coupling inKNiF3sandK2NiF4s
3. Accurate Prediction of Large Antiferromagnetic Interactions in High-TcHgBa2Can−1CunO2n+2+δ(n=2,3) Superconductor Parent Compounds
4. Ab initiostudy of the magnetic interactions in the spin-ladder compoundSrCu2O3
5. Ab initioevaluation of local effective interactions inα′−NaV2O5
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