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Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K

Link to publisher's homepage at http://www.unimap.edu.my/ ; Open access only applicable for vol. 1; issue 1, 2008.

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Bibliographic Details
Main Authors: Berroukche, A., Soudini, B., Amara, K.
Format: Article
Language:English
Published: Universiti Malaysia Perlis 2008
Subjects:
MD simulation
Structural
Elastic and thermodynamic properties
Tin
Elasticity
Thermodynamics
Online Access:http://dspace.unimap.edu.my/xmlui/handle/123456789/2367
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spelling my.unimap-23672008-10-18T03:29:08Z Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K Berroukche, A. Soudini, B. Amara, K. MD simulation Structural Elastic and thermodynamic properties Tin Elasticity Thermodynamics Link to publisher's homepage at http://www.unimap.edu.my/ ; Open access only applicable for vol. 1; issue 1, 2008. Molecular-dynamics simulation has been used to investigate structural, elastic and thermodynamic properties of tin in the temperature range from 200K up to 286.36K. Calculations are carried out using the inter-atomic interactions model like a three-body potential of Tersoff. In the present work, a special interest has been made to the first form of tin (α-Sn), the reason why the temperature is below 286.36K. The calculated results of the lattice constant, the bulk modulus and its derivative, the total energy, and the pair distribution function are correctly described, in excellent agreement with other theoretical works as well as the experimental results. Our study enabled us to predict the thermodynamic properties like the specific heat and lattice thermal expansion. 2008-10-10T03:28:18Z 2008-10-10T03:28:18Z 2008 Article International Journal of Nanoelectronics and Materials, vol. 1 (1), 2008, pages 41-51. 1985-5761 (Printed) 1997-4434 (Online) http://www.unimap.edu.my http://hdl.handle.net/123456789/2367 en Universiti Malaysia Perlis
institution Universiti Malaysia Perlis
building UniMAP Library
collection Institutional Repository
continent Asia
country Malaysia
content_provider Universiti Malaysia Perlis
content_source UniMAP Library Digital Repository
url_provider http://dspace.unimap.edu.my/
language English
topic MD simulation
Structural
Elastic and thermodynamic properties
Tin
Elasticity
Thermodynamics
spellingShingle MD simulation
Structural
Elastic and thermodynamic properties
Tin
Elasticity
Thermodynamics
Berroukche, A.
Soudini, B.
Amara, K.
Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K
description Link to publisher's homepage at http://www.unimap.edu.my/ ; Open access only applicable for vol. 1; issue 1, 2008.
format Article
author Berroukche, A.
Soudini, B.
Amara, K.
author_facet Berroukche, A.
Soudini, B.
Amara, K.
author_sort Berroukche, A.
title Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K
title_short Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K
title_full Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K
title_fullStr Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K
title_full_unstemmed Molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 K
title_sort molecular dynamics simulation study of structural, elastic and thermodynamic properties of tin below 286 k
publisher Universiti Malaysia Perlis
publishDate 2008
url http://dspace.unimap.edu.my/xmlui/handle/123456789/2367
_version_ 1643787589627412480
score 13.214268

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