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The specific heat of Al-based compounds, evaluation of the Neumann-Kopp rule and proposal for a modified Neumann-Kopp rule
Univ Paris Est Creteil, CNRS, ICMPE, UMR 7182, 2 rue Henri Dunant, F-94320 Thiais, France..
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering. Thermo Calc Software AB, Solna, Sweden..ORCID iD: 0000-0002-3283-0549
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering, Structures.ORCID iD: 0000-0001-5031-919X
2023 (English)In: Calphad, ISSN 0364-5916, E-ISSN 1873-2984, Vol. 81, article id 102562Article in journal (Refereed) Published
Abstract [en]

Application of the Neumann-Kopp rule to aluminum containing compounds produces a kink in the specific heat caused by the description of pure aluminum in the SGTE Unary database. Two ways to get rid of this problem are investigated. In a first step, we tried to redefine the description of aluminum above its melting point using a reverse Neumann-Kopp approach. After a systematic review of the experimental Cp data for all the aluminum based compounds, we could evaluate the accuracy of the Neumann-Kopp rule. We could find a nearly systematic overestimation of the Cp of the order of 15%. This makes the use of the reverse Neumann-Kopp approach inapplicable. In a second step, based on this analysis of the available data, we propose another approach consisting in defining the Cp of a compound by a composition average of the Cp of the pure elements, not at the same temperature as in the Neumann-Kopp rule, but rather at a temperature normalized to the melting point of each pure element and the compound. Not only are the results in much better agreement with the experimental data than the conventional Neumann-Kopp rule, but also, there is no longer a need to define the Cp of aluminum above its melting point.

Place, publisher, year, edition, pages
Elsevier BV , 2023. Vol. 81, article id 102562
Keywords [en]
Specific heat, Heat capacity, Neumann -Kopp, Aluminum
National Category
Materials Engineering
Identifiers
URN: urn:nbn:se:kth:diva-330494DOI: 10.1016/j.calphad.2023.102562ISI: 001006549900001Scopus ID: 2-s2.0-85159218805OAI: oai:DiVA.org:kth-330494DiVA, id: diva2:1778007
Note

QC 20230630

Available from: 2023-06-30 Created: 2023-06-30 Last updated: 2023-06-30Bibliographically approved

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Kaplan, BartekSelleby, Malin

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