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HomeSolid State PhenomenaSolid State Phenomena Vol. 213Phase Transformation in Titanium Nanoparticles...

Phase Transformation in Titanium Nanoparticles from First Principles

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Abstract:

We have used molecular dynamics and first-principles calculations to investigate the structure and agglomeration of Ti nanoparticles. The results indicate that Ti nanoclusters undergo a phase transition with a change of point group symmetry. In addition, we found that titanium nanocluster growth occurred along the [0001] direction.

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Physics and Technology of Nanostructured Materials II

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Periodical:

Solid State Phenomena (Volume 213)

Pages:

42-46

DOI:

https://doi.org/10.4028/www.scientific.net/SSP.213.42

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Online since:

March 2014

Authors:

Andrey N. Chibisov*

Keywords:

Agglomeration, First-Principles Calculation, Nanocluster Growth, Phase Transition, Titanium

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© 2014 Trans Tech Publications Ltd. All Rights Reserved

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