Degeneracy and quantum effects in the Hubbard model
- 1 September 1986
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 34 (5) , 3243-3253
- https://doi.org/10.1103/physrevb.34.3243
Abstract
The thermodynamics of the degenerate-band Hubbard model is investigated using the two-field static approximation to the functional-integral method. It is shown that the previous calculation scheme based on the results for the single-band model includes the effects of orbital degeneracy and Hund’s-rule coupling. Emphasis is put on the role of the degeneracy and the quantum effects involved in the two-field method. A new expression for the amplitude of the local moment (〈〉 is derived from the free energy. The quantum effects on the amplitude (〈〉 are examined in detail as a function of the degeneracy and the Coulomb and exchange parameters. Theoretical values for (〈〉 are 3.3 for Fe, 1.4–1.7 for Ni, and 2.8 for Cr at . The results raise an objection to the experimental values obtained by means of neutron scattering: 1.5 for Fe, 0.9 for Ni, and 0.28 for Cr.
Keywords
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