Energy bands and Fermi surfaces for and
- 15 February 1977
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 15 (4) , 1894-1905
- https://doi.org/10.1103/physrevb.15.1894
Abstract
The energy bands of ordered and have been calculated by the relativistic linear-muffintin-orbital method. We show how the gross features of the energy bands may be estimated from Wigner-Seitz rules. The densities of states are calculated and the heat capacities derived. The Fermi surfaces are found to be -like but there are narrow bands far below—and wide and bands far above—the Fermi levels. For the calculated angular variation of extremal cross sections of the Fermi surface agrees very well with de Haas-van Alphen data and thereby provide an interpretation of these measurements. The average mass enhancement is found to be 1.6.
Keywords
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