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A new thermodynamic description of stable Cr-carbides for the third generation of thermodynamic database
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.ORCID iD: 0000-0002-8493-9802
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.ORCID iD: 0000-0001-5031-919X
2017 (English)In: Calphad, ISSN 0364-5916, E-ISSN 1873-2984, Vol. 59, p. 107-111Article in journal (Refereed) Published
Abstract [en]

An updated thermodynamic description of the stable Cr-carbides was obtained by applying the same models as used for the elements within the 3rd generation of thermodynamic databases. The Einstein model was used and a scaling factor was introduced to take into account the coupling effect between the stoichiometry (C to Cr ratio) and the structure of the compound. Using this model we could accurately describe the thermodynamic properties of these stoichiometric compounds using available experimental heat capacity data. The new description is now more physically sound and results in a better agreement with the experimental heat capacity data.

Place, publisher, year, edition, pages
Elsevier Ltd , 2017. Vol. 59, p. 107-111
Keywords [en]
Carbides, Specific heat, Thermodynamic properties, Coupling effect, Einstein models, Heat-capacity data, Scaling factors, Stoichiometric compound, Thermodynamic database, Thermodynamic description, Third generation, Thermodynamics
National Category
Condensed Matter Physics
Identifiers
URN: urn:nbn:se:kth:diva-218614DOI: 10.1016/j.calphad.2017.09.002ISI: 000417659900011Scopus ID: 2-s2.0-85030326802OAI: oai:DiVA.org:kth-218614DiVA, id: diva2:1161456
Note

QC 20171130

Available from: 2017-11-30 Created: 2017-11-30 Last updated: 2018-03-12Bibliographically approved

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Li, ZhouMao, HuahaiSelleby, Malin

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