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image/svg+xml Jakob Voss, based on art designer at PLoS, modified by Wikipedia users Nina and Beao Closed Access logo, derived from PLoS Open Access logo. This version with transparent background. http://commons.wikimedia.org/wiki/File:Closed_Access_logo_transparent.svg Jakob Voss, based on art designer at PLoS, modified by Wikipedia users Nina and Beao https://doi.org/10.1...arrow_drop_down
image/svg+xml Jakob Voss, based on art designer at PLoS, modified by Wikipedia users Nina and Beao Closed Access logo, derived from PLoS Open Access logo. This version with transparent background. http://commons.wikimedia.org/wiki/File:Closed_Access_logo_transparent.svg Jakob Voss, based on art designer at PLoS, modified by Wikipedia users Nina and Beao
https://doi.org/10.1103/physre...
Article . 1991 . Peer-reviewed
License: APS Licenses for Journal Article Re-use
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hcp-bcc transition and the free energies of the hcp and bcc structures of zirconium

Authors: , Salomons;

hcp-bcc transition and the free energies of the hcp and bcc structures of zirconium

Abstract

The absolute free energies of the hcp and bcc phases of zirconium have been calculated as a function of temperature by the Einstein-crystal method, using Monte Carlo simulations of a tight-binding model. The thermodynamic transition temperature of the hcp-bcc transition is found to be close to the transition temperature observed in constant-pressure molecular-dynamics simulations. The calculated value of the entropy difference of the hcp and bcc phases is in good agreement with the experimental value, taking into account the contribution of the electronic excitations. The temperature dependence of the enthalpy difference of the hcp and bcc phases is found to contribute considerably to the temperature dependence of the free-energy difference of the hcp and bcc phases.

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
10
Average
Average
Average
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