Electronic structure of Pt-substituted clathrate silicides Ba8PtxSi46–x(x = 4–6)


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Abstract

The results of calculation of the electronic structure of Si-based Pt-substituted clathrates are reported. Calculation is carried out by the linearized-augmented-plane-wave method. The effect of the number of substitutions and their crystallographic position in the unit cell on the electron-energy spectrum and the electronic properties of Pt-substituted clathrates is analyzed.

About the authors

N. A. Borshch

Voronezh State Technical University

Author for correspondence.
Email: n.a.borshch@ya.ru
Russian Federation, Voronezh, 394026


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