Equation of State of Periclase Based on Planck–Einstein Functions

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Abstract

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.

About the authors

A. V. Perevoshchikov

Moscow State University

Email: ira@td.chem.msu.ru
119991, Moscow, Russia

A. I. Maksimov

Moscow State University

Email: ira@td.chem.msu.ru
119991, Moscow, Russia

I. I. Babayan

Moscow State University

Email: ira@td.chem.msu.ru
119991, Moscow, Russia

N. A. Kovalenko

Moscow State University

Email: ira@td.chem.msu.ru
119991, Moscow, Russia

I. A. Uspenskaya

Moscow State University

Author for correspondence.
Email: ira@td.chem.msu.ru
119991, Moscow, Russia

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Copyright (c) 2023 А.В. Перевощиков, А.И. Максимов, И.И. Бабаян, Н.А. Коваленко, И.А. Успенская