Chemical equilibrium calculations for bulk silicate earth material at high temperatures

B Fegley Jr, K Lodders, NS Jacobson - Geochemistry, 2023 - Elsevier
The chemical equilibrium distribution of 69 elements between gas and melt is modeled for
bulk silicate Earth (BSE) material over a wide P–T range (1000–4500 K, 10− 6–10 2 bar) …

Thermophysical properties of liquid molybdenum in the near-critical region using quantum molecular dynamics

DV Minakov, MA Paramonov, PR Levashov - Physical Review B, 2021 - APS
We present a comprehensive first-principles study of the thermophysical properties of liquid
molybdenum in the near-critical region. The ab initio estimate of the molybdenum critical …

[HTML][HTML] Measurement on the electrical conductivity of copper along the binodal curve in warm dense regime

S Park, H Lee, J Ryu, KJ Chung, YS Hwang… - Applied Physics …, 2021 - pubs.aip.org
This paper presents the electrical conductivity data of copper along the gas branch of the
binodal curve in the warm dense matter (WDM) regime as a function of mass density and …

[HTML][HTML] Liquid–vapor phase transition process during underwater electrical wire explosion

S Park, H Lee, KJ Chung - AIP Advances, 2023 - pubs.aip.org
The liquid–vapor two-phase region has attracted the attention of various fundamental
studies and applications. To explore the liquid–vapor two-phase region, underwater …

The Zeno Line for Al, Cu, and U

EM Apfelbaum, VS Vorob'ev - The Journal of Physical Chemistry …, 2016 - ACS Publications
We show that the property of linearity for a line of unit compressibility factor (Zeno line) can
be confirmed for metals (Al, Cu, and U) in liquid phase. The embedded atom potentials …

Systematization of the Critical Parameters of Substances Due to Their Connection with Heat of Evaporation and Boyle Temperature

EM Apfelbaum, VS Vorob'ev - International Journal of Thermophysics, 2020 - Springer
We show that a variety of the critical parameters of substances can be systematized by
relating them to the corresponding Boyle values and heat of vaporization under normal …

Scaling Laws and Critical Properties for fcc and hcp Metals

C Desgranges, L Widhalm… - The Journal of Physical …, 2016 - ACS Publications
The determination of the critical parameters of metals has remained particularly challenging
both experimentally, because of the very large temperatures involved, and theoretically …

Ab initio calculations of transport and optical properties of dense Zr plasma near melting

V Fokin, D Minakov, P Levashov - Symmetry, 2023 - mdpi.com
The dynamic electrical conductivity of dense Zr plasma near melting is calculated using ab
initio molecular dynamics and the Kubo–Greenwood formula. The antisymmetrization of the …

The Line of the Unit Compressibility Factor (Zeno-Line) for Crystal States

EM Apfelbaum, VS Vorob'ev - The Journal of Physical Chemistry …, 2020 - ACS Publications
We study the behavior of the line of the unit compressibility factor (Zeno-line) in crystalline
states. We used the Lennard-Jones system, experimental P–V–T data for a number of …

The thermodynamics and transport properties of transition metals in critical point

AL Khomkin, AS Shumikhin - arxiv preprint arxiv:1606.09609, 2016 - arxiv.org
A new method for calculating the critical point parameters (density, temperature, pressure
and electrical conductivity) and binodal of vapor-liquid (dielectric-metal) phase transition is …