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EFFECT OF EXTERNAL PRESSURE ON THE PHASE TRANSITION TEMPERATURE IN BIMETALLIC ARGENTIC NANOPARTICLES

Authors :
V.S. Myasnichenko
V.V. Kulagin
D.N. Sokolov
N.Yu. Sdobnyakov
L. Kirilov
Source :
Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов, Iss 8, Pp 259-265 (2016)
Publication Year :
2016
Publisher :
Tver State University, 2016.

Abstract

In this paper, a series of computer experiments on heating of clusters in the form of a truncated box is made by a molecular dynamics method ( NPT ensemble). Clusters of the stoichiometric compositions AB and A3B were investigated for Cu-Ag and Au-Ag bimetallic systems. We used a modified many-body tight-binding potential. It was found that the temperature range of the structural stability for bimetallic nanoparticles (nanoalloys) have combined influence of the following factors: nanoparticle size and initial geometric form, nanoparticle composition, type and degree of atomic ordering, external pressure.

Details

Language :
Russian
ISSN :
22264442 and 26584360
Issue :
8
Database :
Directory of Open Access Journals
Journal :
Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов
Publication Type :
Academic Journal
Accession number :
edsdoj.69182c2c495443383e2887800b33114
Document Type :
article