Abstract
The energy bands of ordered βMgHg and βMgTl 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 sp-like but there are narrow 5d bands far below—and wide 3d and 6d bands far above—the Fermi levels. For βMgHg 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.