ON THE RELATIONSHIP BETWEEN STRUCTURE AND THERMAL STABILITY PROPERTIES OF COPPER CLUSTERS SIZE UP TO 100 ATOMS IN MOLECULAR-DYNAMICS SIMULATION

ON THE RELATIONSHIP BETWEEN STRUCTURE AND THERMAL STABILITY PROPERTIES OF COPPER CLUSTERS SIZE UP TO 100 ATOMS IN MOLECULAR-DYNAMICS SIMULATION

In this paper a molecular-dynamics simulation of the structure and thermal stability of the copper clusters size up to 100 atoms has been carried out using many-body tight-binding potential. On the basis of the calculation of a local minimum energy for copper clusters it the «magic» nanoclusters can...

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Bibliographic Details
Main Authors: V.S. Myasnichenko, P.M. Ershov, N.Yu. Sdobnyakov, D.N. Sokolov
Format: Article
Language:Russian
Published: Tver State University 2015-11-01
Series:Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов
Subjects:
molecular dynamics
tight-binding potential
copper nanoclusters
melting temperature
magic clusters
Online Access:http://physchemaspects.ru/archives/2015/%D0%A4%D0%A5-2015%20%D0%9C%D1%8F%D1%81%D0%BD%D0%B8%D1%87%D0%B5%D0%BD%D0%BA%D0%BE%20%D0%92%D0%A1.pdf

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