Chlorine-impurity-related defects in ZnSe

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© 1998 American Physical Society (APS). This is the accepted version of the following article: Pöykkö, S. & Puska, M. J. & Nieminen, Risto M. 1998. Chlorine-impurity-related defects in ZnSe. Physical Review B. Volume 57, Issue 19. 12164-12168. ISSN 1550-235X (electronic). DOI: 10.1103/physrevb.57.12164, which has been published in final form at http://journals.aps.org/prb/abstract/10.1103/PhysRevB.57.12164.

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Journal Title

Journal ISSN

Volume Title

School of Science | A1 Alkuperäisartikkeli tieteellisessä aikakauslehdessä

Date

1998

Major/Subject

Mcode

Degree programme

Language

en

Pages

12164-12168

Series

Physical Review B, Volume 57, Issue 19

Abstract

Defect complexes formed by chlorine-impurity atoms and native defects in ZnSe are studied by first-principles electronic-structure calculations. The strong tendency for the formation of vacancy-impurity pairs is shown. The chlorine-impurity–zinc-vacancy complex is shown to be the most important source of donor compensation. The results presented are compared with recent experimental results.

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Keywords

ZnSe, defects, chlorine-impurity atoms

Other note

Citation

Pöykkö, S. & Puska, M. J. & Nieminen, Risto M. 1998. Chlorine-impurity-related defects in ZnSe. Physical Review B. Volume 57, Issue 19. 12164-12168. ISSN 1550-235X (electronic). DOI: 10.1103/physrevb.57.12164.