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Thermal and mechanical properties of some fcc transition metals

Çağin, Tahir and Dereli, G. and Uludogan, M. and Tomak, M. (1999) Thermal and mechanical properties of some fcc transition metals. Physical Review B, 59 (5). pp. 3468-3473. ISSN 0163-1829. http://resolver.caltech.edu/CaltechAUTHORS:CAGprb99

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Abstract

The temperature dependence of thermodynamic and mechanical properties of six fcc transition metals (Ni, Cu, Ag, Au, Pt, Rh) are studied using molecular dynamics (MD) simulations. The structures are described at elevated temperatures by the force fields developed by Sutton and co-workers within the context of the tight binding approach. In these simulations the thermodynamic and mechanical properties are calculated in the temperature range between 0 to 1500 K using the statistical fluctuation expressions over the MD trajectories.


Item Type:Article
Additional Information:©1999 The American Physical Society Received 4 September 1997; revised 27 April 1998 This research was supported by the Scientific and Technical Research Council of Turkey (TUBITAK) through Project No. TBAG 1592 and by the Middle East Technical University Research Fund through Project No. AFP-96-01-05-03.
Record Number:CaltechAUTHORS:CAGprb99
Persistent URL:http://resolver.caltech.edu/CaltechAUTHORS:CAGprb99
Alternative URL:http://dx.doi.org/10.1103/PhysRevB.59.3468
Usage Policy:No commercial reproduction, distribution, display or performance rights in this work are provided.
ID Code:2156
Collection:CaltechAUTHORS
Deposited By: Archive Administrator
Deposited On:12 Mar 2006
Last Modified:26 Dec 2012 08:47

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