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A spin fluctuation theory of degenerate narrow bands-finite-temperature magnetism of iron

1983; IOP Publishing; Volume: 13; Issue: 9 Linguagem: Inglês

10.1088/0305-4608/13/9/016

1747-3918

Hideo Hasegawa,

Theoretical and Computational Physics

A previously developed theory of itinerant-electron magnetism at finite temperatures is generalised to include the effect of degenerate multi-bands with t2g and eg symmetry by adopting the static functional integral method and the coherent potential approximation (CPA). Numerical calculations of the Curie temperature, the magnetisation curve, the amplitude of local moments and the susceptibility are made for iron by using the detailed density of states generated by the recursion method for the tight-binding model. Calculated results are shown to account for finite-temperature properties of iron. In particular, the calculation explains the observed very weak temperature dependence in the spin-density asphericity, which cannot be explained by the Stoner theory. The authors' results are compared with those obtained by alternative approaches in which the five sub-bands are taken to be equivalent.