Nonempirical approximation for the ionic thermal contribution to the equations of state based on average-atom models
A simple nonempirical approximation is proposed to calculate the ionic thermal contribution to the average-atom equations of state. The approximation represents the main regularities of temperature and mass-density dependences of the ionic thermodynamic-function components revealed from the pseudoatom molecular dynamics calculations. It is shown that the employment of our approximation instead of commonly used ideal-gas or one-component-plasma approximations significantly improves the accuracy of the equations-of-state calculations done with the Liberman average-atom model.
Authors
- F.A. Sapozhnikov (ORCID: https://orcid.org/0000-0001-9884-9915)
- P. A. Loboda (ORCID: https://orcid.org/0000-0002-2741-0304)
- A. A. Ovechkin (ORCID: https://orcid.org/0000-0002-6863-4654)
Institutions
- All-Russian Scientific Research Institute of Technical Physics (RU)
- National Research Nuclear University MEPhI (RU)
Publication Details
- Journal
- Physical review. E
- Published
- 2025-04-09
- DOI
- https://doi.org/10.1103/physreve.111.045204
- Primary Topic
- High-pressure geophysics and materials
- Type
- article
- Field-Weighted Citation Impact
- 0.00