Thermodynamic study of binary phase diagram iron-selenium
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F68081723%3A_____%2F25%3A00602404" target="_blank" >RIV/68081723:_____/25:00602404 - isvavai.cz</a>
Alternative codes found
RIV/00216224:14310/25:00140463
Result on the web
<a href="https://www.sciencedirect.com/science/article/pii/S0364591624001160?via%3Dihub" target="_blank" >https://www.sciencedirect.com/science/article/pii/S0364591624001160?via%3Dihub</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1016/j.calphad.2024.102774" target="_blank" >10.1016/j.calphad.2024.102774</a>
Alternative languages
Result language
angličtina
Original language name
Thermodynamic study of binary phase diagram iron-selenium
Original language description
The binary phase diagram of the Fe-Se system was modeled by the thermodynamic CALPHAD approach for the first time. The thermodynamic description of this system was mainly based on the available experimental isobaric molar heat capacity of the Fe1.042Se (β) phase in the temperature range of 25–777 ◦C and on the pub lished proposed experimental phase diagrams. The formation enthalpies of Fe1.042Se (β), Fe7Se8, Fe3Se4, FeSe (δ) and FeSe2 phases at 25 ◦C were also implemented into the phase diagram modeling. Magnetic properties and formation energy of the Fe3Se4 (γ) phase were theoretically calculated by ab initio methods and implemented in the assessment.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
—
OECD FORD branch
20303 - Thermodynamics
Result continuities
Project
—
Continuities
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace
Others
Publication year
2025
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Calphad - Computer Coupling of Phase Diagrams and Thermochemistry
ISSN
0364-5916
e-ISSN
1873-2984
Volume of the periodical
88
Issue of the periodical within the volume
MAR
Country of publishing house
GB - UNITED KINGDOM
Number of pages
8
Pages from-to
102774
UT code for WoS article
001374148200001
EID of the result in the Scopus database
2-s2.0-85211025449