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Number of results
2016 | 129 | 1a | A-138-A-141

Article title

Morphology and Stability of the C/BN Interfaces: Ab Initio Studies

Content

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Languages of publication

EN

Abstracts

EN
We investigate the morphology and charge distribution at the (001)-diamond/BN heteropolar junctions of the cubic materials. Our investigations are based on the first principles calculations in the framework of the density functional theory. These studies reveal that reconstruction of the interface leads to possible charge compensation at the interface and increases also the stability of the junction in comparison to the abrupt interfaces.

Keywords

EN

Contributors

author
  • Faculty of Mathematics and Natural Sciences, University of Rzeszów, S. Pigonia 1, 35-959 Rzeszów, Poland
author
  • Faculty of Mathematics and Natural Sciences, University of Rzeszów, S. Pigonia 1, 35-959 Rzeszów, Poland
author
  • Institute of Theoretical Physics, Faculty of Physics, University of Warsaw, L. Pasteura 5, 02-093 Warszawa, Poland

References

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Document Type

Publication order reference

YADDA identifier

bwmeta1.element.bwnjournal-article-appv129n1a35kz
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