Investigation of the stability and charge states of vacancy in clusters Si_29 and Si_38

Stability and charge states of vacancy in Si_29 and Si_38 clusters have been calculated by non-conventional tight-binding method and molecular dynamics. Based on the theoretical calculations, it was shown that the vacancy in pure dimerized clusters is unstable, while in hydrogenated Si_29H_24 and Si...

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Bibliographic Details

Published in:	Condensed Matter Physics
Main Authors:	A. B. Normurodov, A. P. Mukhtarov, F. T. Umarova, M. Yu. Tashmetov, Sh. Makhkamov, N. T. Sulaymonov
Format:	Article
Language:	English
Published:	Yukhnovskii Institute for Condensed Matter Physics of the National Academy of Sciences of Ukraine 2022-03-01
Subjects:	silicon nanoclusters charge vacancy non-conventional tight-binding method molecular dynamics
Online Access:	https://doi.org/10.5488/CMP.25.13301