University of Oulu

R Kh Khisamov et al 2020 IOP Conf. Ser.: Mater. Sci. Eng. 1008, 012032

Work function of chemical compounds of aluminum-magnesium system

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Author: Khisamov, R. Kh.1; Kistanov, A. A.2; Nazarov, K. S.1;
Organizations: 1Institute for Metals Superplasticity Problems of Russian Academy of Sciences, 39 Stepan Khalturin st., Ufa, 450001, Russia
2Nano and Molecular Systems Research Unit, University of Oulu, Oulu, 90014, Finland
3Bashkir State University, 32 Zaki Validi st., Ufa, 450076, Russia
4Ufa State Petroleum Technological University, 1 Kosmonavtov st., Ufa, 450064, Russia
Format: article
Version: published version
Access: open
Online Access: PDF Full Text (PDF, 1.1 MB)
Persistent link: http://urn.fi/urn:nbn:fi-fe202101121572
Language: English
Published: IOP Publishing, 2020
Publish Date: 2021-01-12
Description:

Abstract

For pure metals aluminum and magnesium and for chemical compounds Al₃Mg, Al₂Mg, AlMg and AlMg₃ with crystallographic orientations (100), (110) and (111) the work function is calculated from the first principles in the framework of the density functional theory. It is shown that the dependence of the work function on the magnesium concentration in aluminium is nonlinear. The reasons for the work function differences of chemical compounds depending on the crystallographic orientation are analysed.

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Series: IOP conference series. Materials science and engineering
ISSN: 1757-8981
ISSN-E: 1757-899X
ISSN-L: 1757-8981
Article number: 012032
DOI: 10.1088/1757-899X/1008/1/012032
OADOI: https://oadoi.org/10.1088/1757-899X/1008/1/012032
Host publication: Open School-Conference of NIS Countries «Ultrafine Grained and Nanostructured Materials - 2020 (UFGNM- 2020) 5-9 October 2020, Ufa, Russian Federation
Type of Publication: A4 Article in conference proceedings
Field of Science: 114 Physical sciences
Subjects:
Funding: The work was supported by the RSF grant No 18-12-00440 and partially supported by the state assignment of the IMSP RAS. A.A. Kistanov acknowledges the financial support provided by the Academy of Finland (grant No 311934).
Copyright information: Content from this work may be used under the terms of the Creative Commons Attribution 3.0 licence. Any further distribution of this work must maintain attribution to the author(s) and the title of the work, journal citation and DOI. Published under licence by IOP Publishing Ltd.
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