Equation of State of Periclase Based on Planck–Einstein Functions
- Autores: Perevoshchikov A.1, Maksimov A.1, Babayan I.1, Kovalenko N.1, Uspenskaya I.1
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Afiliações:
- Moscow State University
- Edição: Volume 68, Nº 2 (2023)
- Páginas: 191-202
- Seção: ТЕОРЕТИЧЕСКАЯ НЕОРГАНИЧЕСКАЯ ХИМИЯ
- URL: https://journals.rcsi.science/0044-457X/article/view/136454
- DOI: https://doi.org/10.31857/S0044457X22601407
- EDN: https://elibrary.ru/LPBWCJ
- ID: 136454
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Resumo
The paper presents an extension of the Voronin–Kutsenok method for joint description of both thermochemical and bulk data with combination of Planck–Einstein functions and modified Tait equation. Two approaches based on the Gibbs and Helmholtz energy descriptions were proposed. Magnesium oxide (periclase) was chosen as the test system. The parameters of the equation of state were optimized using published data over a broad range of thermodynamic variables (up to 3000 K and 145 GPa). The predictive power of both approaches was estimated.
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Sobre autores
A. Perevoshchikov
Moscow State University
Email: ira@td.chem.msu.ru
119991, Moscow, Russia
A. Maksimov
Moscow State University
Email: ira@td.chem.msu.ru
119991, Moscow, Russia
I. Babayan
Moscow State University
Email: ira@td.chem.msu.ru
119991, Moscow, Russia
N. Kovalenko
Moscow State University
Email: ira@td.chem.msu.ru
119991, Moscow, Russia
I. Uspenskaya
Moscow State University
Autor responsável pela correspondência
Email: ira@td.chem.msu.ru
119991, Moscow, Russia
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