Molecular dynamic simulation of heating of titanium nanoclusters

The melting of titanium nanoclusters Tin (n = 3599, 28725, 97045) with different heating rates (from 0,1 to and 10,0 TK/s) was studied by the molecular dynamics method. Molecular dynamics simulation was carried out using the LAMMPS program on a multiprocessor computer. A many-particle potential of i...

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Bibliographic Details

Published in:	Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов
Main Author:	N.A. Pan'kin
Format:	Article
Language:	Russian
Published:	Tver State University 2022-12-01
Subjects:	titanium nanocluster melting point heating rate structure islands molecular dynamics method
Online Access:	https://physchemaspects.ru/2022/doi-10-26456-pcascnn-2022-14-479/?lang=en