The electronic structure of a CeO cluster, the soccer ball-shaped structure determined from the recent X-ray study by Hawkins et al., and of its endohedral complex KCGo were calculated using the self-consistent-field discrete variational (DV) method in the local density theoretical framework. The ca
Preparation and electronic structure of phase pure K3C60
β Scribed by M. Knupfer; J. Fink; J. F. Armbruster; H. A. Romberg
- Book ID
- 112515656
- Publisher
- Springer
- Year
- 1995
- Tongue
- English
- Weight
- 701 KB
- Volume
- 98
- Category
- Article
- ISSN
- 1434-6036
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Results of electronic structure calculations of C6o and M3C6o (M = K, Rb, Cs) fcc crystals carried out by the full-potentiallinear muffin-tin orbital (LMTO) method are reported. Undoped C6o is found to be semiconductir~g wtt:z a direct gap between the fully occupied valence band and empty conduction
The electronic states in metallic alkali fullerides, K,C,, and Rb,C,, are studied in detail by cw-and pulsed-ESR. The ESR linewidth associated with conduction electrons varies substantially, depending sensitively on the alkali metals used. It is clearly revealed that the linewidth is homogeneous and