An Atomic Scale Study of Structural and Electronic Properties for α-Zirconium with Single Vacancies and Vacancy Clusters

We study structural, electronic, and energy properties of pure zirconium with isolated vacancies and their clusters. We discuss the lattice constant change in pure zirconium with different concentrations of isolated vacancy and different configurations of di- and trivacancy. We analyse the stability...

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Veröffentlicht in:Металлофизика и новейшие технологии
Datum:2016
Hauptverfasser: Kharchenko, V.O., Kharchenko, D.O., Wu, X., Wen, B., Wu, L., Zhang, W.
Format: Artikel
Sprache:English
Veröffentlicht: Інститут металофізики ім. Г.В. Курдюмова НАН України 2016
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Online Zugang:https://nasplib.isofts.kiev.ua/handle/123456789/112606
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Zitieren:An Atomic Scale Study of Structural and Electronic Properties for α-Zirconium with Single Vacancies and Vacancy Clusters / V. O. Kharchenko, D. O. Kharchenko, X. Wu, B. Wen, L. Wu, and W. Zhang // Металлофизика и новейшие технологии. — 2016. — Т. 38, № 9. — С. 1195-1212. — Бібліогр.: 39 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine