The pseudopotential method and the thermodynamics of alloys

V. E. Panin, M. F. Zhorovkov, D. L. Fuks

Research output: Contribution to journalArticle

Abstract

The authors review their work on the use of the pseudopotential method in the thermodynamics of alloys. Treatment of the theory of phase equilibria in alloys on the basis of the pseudopotential method makes it possible to use first principles in order to set up a thermodynamics of alloys in which the energy parameters are not presumed to be phenomenological but are calculated from the electronic characteristics of the pure components. The approach developed allows a priori calculation of the phase diagrams of alloys, the effect of cubic compression on phase diagrams, and the various thermodynamic functions of alloys. A classification of phases in alloys on the basis of analysis of their thermodynamic characteristics is proposed.

Original languageEnglish
Pages (from-to)988-1001
Number of pages14
JournalSoviet Physics Journal
Volume19
Issue number8
DOIs
Publication statusPublished - Aug 1976

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pseudopotentials
thermodynamics
phase diagrams
electronics
energy

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  • Physics and Astronomy(all)

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The pseudopotential method and the thermodynamics of alloys. / Panin, V. E.; Zhorovkov, M. F.; Fuks, D. L.

In: Soviet Physics Journal, Vol. 19, No. 8, 08.1976, p. 988-1001.

Research output: Contribution to journalArticle

Panin, V. E. ; Zhorovkov, M. F. ; Fuks, D. L. / The pseudopotential method and the thermodynamics of alloys. In: Soviet Physics Journal. 1976 ; Vol. 19, No. 8. pp. 988-1001.
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