Abstrakt
The spin-disorder resistivity (SDR) of a disordered fcc-(Ni1-x, Fe-x) alloy is determined from first principles. We identify the SDR at and above the critical temperature with the residual resistivity of the corresponding paramagnetic state evaluated in the framework of the disordered local moment (DLM) model.
The underlying electronic structure is determined by means of the tight-binding linear muffin-tin orbital method, which employs the coherent potential approximation (CPA) to describe both the DLM state and the chemical disorder in alloys. An extension of the DLM fixed-spin moment method for two independent magnetic moments is used and combined with the paramagnetic lattice gas entropy to determine local moments by minimizing the corresponding free energy.
The effect of phonon scattering is included through the mapping of static atomic displacements into a multicomponent random alloy which is then treated in the CPA. Finally, the Kubo-Greenwood-CPA approach is employed to estimate the SDR.
We also address the problem of the validity of the Matthiessen rule at the Curie point. Good agreement of calculated and measured SDR is obtained over the whole studied concentration range; the results point to the importance of nonzero Ni magnetic moments in the limit of pure nickel.