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On the `screened' Korringa-Kohn-Rostoker (KKR) method for calculating the electronic structure of solids

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Published under licence by IOP Publishing Ltd
, , Citation J Schwitalla and B L Györffy 1998 J. Phys.: Condens. Matter 10 10955 DOI 10.1088/0953-8984/10/48/016

0953-8984/10/48/10955

Abstract

We demonstrate how the screening procedure works in a one-dimensional application of the KKR method by constructing an explicit analytic expression for the full scattering path matrix for the reference system. As an example of where screening renders novel calculations possible, we discuss the Friedel oscillations in a one-dimensional chain of potential wells with broken crystal symmetry.

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10.1088/0953-8984/10/48/016