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Nanoscale magnetic material is becoming an important topic in nanoscience and magnetism. Especially, gold nanoparticles chemisorbed by alkanethiols have drawn much attention due to the size effect on their electronic structure. However, magnetic interaction of gold nanoparticles derivatized by magnetically active ligands has not been investigated in detail. In order to elucidate the magnetic interaction...
Donor-radical model systems for chemical or photo-induced magnets are proposed, and their electronic states and intramolecular magnetic interactions are investigated by Kohn-Sham hybrid density functional theory (KS-HDFT). 5,10-dihydrophenazine is employed as a donor and nitronyl- or imino-nitroxide radicals as stable radical substituents. The models mostly provide ferromagnetic intramolecular spin...
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