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Calculation of phonon spectra to predict the high-pressure metastable phase in an equilibrium immiscible Cu–Ta system
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10.1063/1.1786659
/content/aip/journal/apl/85/9/10.1063/1.1786659
http://aip.metastore.ingenta.com/content/aip/journal/apl/85/9/10.1063/1.1786659

Figures

Image of FIG. 1.
FIG. 1.

The phonon spectra of the ideal lattice of the equilibrium immiscible compound at zero pressure.

Image of FIG. 2.
FIG. 2.

(Color) The phonon density of states of the three ideal (a) , (b) , and (c) lattices of the equilibrium immiscible compound under different pressures.

Tables

Generic image for table
Table I.

The calculated results of lattice constants, cohesive energies, and elastic constants of the ideal , , and lattices of the equilibrium immiscible compound at zero pressure.

Generic image for table
Table II.

The symbols used in Fig. 2, the corresponding volume ratio , and the pressures (GPa), respectively.

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/content/aip/journal/apl/85/9/10.1063/1.1786659
2004-08-27
2014-04-17
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Calculation of phonon spectra to predict the high-pressure metastable phase in an equilibrium immiscible Cu–Ta system
http://aip.metastore.ingenta.com/content/aip/journal/apl/85/9/10.1063/1.1786659
10.1063/1.1786659
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