Band structure of thin films by the linear augmented-plane-wave method

O. Jepsen, J. Madsen, Ole Krogh Andersen

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Abstract

We present a linear augmented-plane-wave method for solving the band-structure problem in thin crystalline films. The potential is separated into a muffin-tin potential inside the film, a potential depending exclusively on the normal coordinate outside the film, and corrections in both regions. The method is tested on (100) and (111) monolayers of Cu using a standard muffin-tin potential.
Original languageEnglish
JournalPhysical Review B
Volume18
Issue number2
Pages (from-to)605-615
ISSN2469-9950
DOIs
Publication statusPublished - 1978

Bibliographical note

Copyright (1978) by the American Physical Society.

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