We discuss the electronic properties of diamagnetic azafullerenes. Our calculations are based on density-functional theory and use gradient-corrected exchange-correlation functionals. The results are compared with experimental data obtained with electron-energy-loss, photoemission and nuclear-magnetic-resonance spectroscopies.
By: A. Curioni and W. Andreoni
Published in: Molecular Nanostructures ed. by H. Kuzmany, J. Fink, M. Mehring, S. Roth. , Singapore, World Scientific, p.81-5 in 1998
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