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Arun Bansil

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AₓB₁₋ₓ

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Coherent-Potential And Average T-Matrix Approximations For Disordered Muffin-Tin Alloys: 1. Formalism, A. Bansil Apr 2012

Coherent-Potential And Average T-Matrix Approximations For Disordered Muffin-Tin Alloys: 1. Formalism, A. Bansil

Arun Bansil

The average density of states 〈ρ(E)〉 and the component charge density associated with an A(B) atom in the alloy, 〈ρA(B)(E)〉, are discussed for the disordered alloy AₓB₁₋ₓ within the framework of the muffintin Hamiltonian. A new version of the average t-matrix (ATA) is developed. The structure in the spectral density function, 〈ρ(k,E)〉, in the coherent-potential approximation (or the new ATA) is seen to result from not only the Bloch-type states in the medium of coherent-potential effective atoms tCP (or the average t-atoms 〈t〉) but also from non-Bloch-type impurity levels arising when a single A or B atom …