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Use of third generation data for the elements to model the thermodynamics of binary alloy systems: Part 1-The critical assessment of data for the Al-Zn system

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    SYSNO ASEP0531544
    Document TypeJ - Journal Article
    R&D Document TypeJournal Article
    Subsidiary JČlánek ve WOS
    TitleUse of third generation data for the elements to model the thermodynamics of binary alloy systems: Part 1-The critical assessment of data for the Al-Zn system
    Author(s) Dinsdale, A. (GB)
    Zobač, O. (AT)
    Kroupa, Aleš (UFM-A) RID, ORCID
    Khvan, A. (RU)
    Number of authors4
    Article numberUNSP 101723
    Source TitleCalphad - Computer Coupling of Phase Diagrams and Thermochemistry. - : Elsevier - ISSN 0364-5916
    Roč. 68, MAR (2020)
    Number of pages10 s.
    Languageeng - English
    CountryGB - United Kingdom
    KeywordsCALPHAD assessment ; Al-Zn system ; 3rd generation unary data ; Concentration dependence of the Einstein ; temperature
    Subject RIVBJ - Thermodynamics
    OECD categoryThermodynamics
    R&D ProjectsGC18-25660J GA ČR - Czech Science Foundation (CSF)
    Method of publishingOpen access
    Institutional supportUFM-A - RVO:68081723
    UT WOS000521509200043
    EID SCOPUS85077675548
    DOI10.1016/j.calphad.2019.101723
    AnnotationOver the last four years there has been a renewed interest in the development of new critically assessed data using physically based models. Nearly all work so far has been concerned with the critical assessment of data for the elements. This has involved the selection of Einstein or Debye temperatures for the stable crystalline phases and the liquid phase and associated parameters. However, until now, these data have not been extended in a comprehensive way to model the thermodynamic properties of binary, ternary and multicomponent systems. In this paper the way in which the parameters underlying these physical models vary with composition is explored. This includes a method to define the Einstein temperature for metastable phases of the elements and its relation to the so-called lattice stabilities used in the past, and the variation of the Einstein temperature with composition to account for the composition dependence of the excess entropy. This approach is demonstrated for the Al-Zn system which shows extensive regions of solid solution and complete miscibility in the liquid phase. Here Einstein temperatures are derived for Al in the HCPZN phase and Zn in the FCC_A1 phase together with parameters describing the variation of the Einstein temperature with composition for the HCP_ZN, FCC_A1 and liquid phases.
    WorkplaceInstitute of Physics of Materials
    ContactYvonna Šrámková, sramkova@ipm.cz, Tel.: 532 290 485
    Year of Publishing2021
    Electronic addresshttps://www.sciencedirect.com/science/article/pii/S0364591619302846?via%3Dihub
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