Influence of Size Effect on the Electronic and Elastic Properties of Graphane Nanoflakes: Quantum Chemical and Empirical Investigations
Joint Authors
Kolesnikova, A. S.
Slepchenkov, M. M.
Glukhova, O. E.
Lin, Ming-Fan
Source
Advances in Condensed Matter Physics
Issue
Vol. 2015, Issue 2015 (31 Dec. 2015), pp.1-5, 5 p.
Publisher
Hindawi Publishing Corporation
Publication Date
2015-05-04
Country of Publication
Egypt
No. of Pages
5
Main Subjects
Abstract EN
By application of empirical method it is found that graphene nanoflake (graphane) saturated by hydrogen is not elastic material.
In this case, the modulus of the elastic compression of graphane depends on its size, allowing us to identify the linear parameters of graphane with maximum Young’s modulus for this material.
The electronic structure of graphane nanoflakes was calculated by means of the semiempirical tight-binding method.
It is found that graphane nanoflakes can be characterized as dielectric.
The energy gap of these particles decreases with increasing of the length tending to a certain value.
At the same time, the ionization potential of graphane also decreases.
A comparative analysis of the calculated values with the same parameters of single-walled nanotubes is performed.
American Psychological Association (APA)
Kolesnikova, A. S.& Slepchenkov, M. M.& Lin, Ming-Fan& Glukhova, O. E.. 2015. Influence of Size Effect on the Electronic and Elastic Properties of Graphane Nanoflakes: Quantum Chemical and Empirical Investigations. Advances in Condensed Matter Physics،Vol. 2015, no. 2015, pp.1-5.
https://search.emarefa.net/detail/BIM-1052302
Modern Language Association (MLA)
Kolesnikova, A. S.…[et al.]. Influence of Size Effect on the Electronic and Elastic Properties of Graphane Nanoflakes: Quantum Chemical and Empirical Investigations. Advances in Condensed Matter Physics No. 2015 (2015), pp.1-5.
https://search.emarefa.net/detail/BIM-1052302
American Medical Association (AMA)
Kolesnikova, A. S.& Slepchenkov, M. M.& Lin, Ming-Fan& Glukhova, O. E.. Influence of Size Effect on the Electronic and Elastic Properties of Graphane Nanoflakes: Quantum Chemical and Empirical Investigations. Advances in Condensed Matter Physics. 2015. Vol. 2015, no. 2015, pp.1-5.
https://search.emarefa.net/detail/BIM-1052302
Data Type
Journal Articles
Language
English
Notes
Includes bibliographical references
Record ID
BIM-1052302