Abstract
The electronic density of states for AuMg and AuZn has been calculated by means of the linear-muffin-tin-orbitals method. A band narrowing for the d like states of Zn and Au as well as a shift to larger binding energies are found on going from pure metals to the compounds. The charge density has been calculated using the same Wigner–Seitz radius for the compound and pure metal when investigating charge transfer between the different atoms. A comparison has been made with ZnSe and ZnS.
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