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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 . 1988 . Peer-reviewed
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Calculated thermal properties of metals

Authors: , Moruzzi; , Janak; , Schwarz;

Calculated thermal properties of metals

Abstract

The thermal properties of the 14 nonmagnetic cubic metals through the 4d transition series are derived from first-principles electronic-structure calculations coupled with a Debye treatment of the vibrating lattice. Debye temperatures and Gr\"uneisen constants are derived from an analysis of the compressional characteristics of rigid-lattice binding curves and are used to define the contribution of the lattice vibrations to the free energy. A minimization of the resulting free energy with respect to volume yields temperature-dependent lattice separations and coefficients of thermal expansion. Theoretical values of cohesive energies, equilibrium lattice separations, bulk moduli, Debye temperatures, Gr\"uneisen constants, and coefficients of thermal expansion are derived directly from computed electronic-structure results. Good agreement with experiment is found for all computed quantities.

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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!
758
Top 0.1%
Top 0.1%
Top 10%
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