Self-consistent microphysics models for materials at high-energy-density
File(s)
Author(s)
Fraser, Adam
Type
Thesis
Abstract
In this thesis we develop a new model for the fast generation of equation of state (EoS) data
that is self-consistent with the underlying microphysics models. Following the successful implementation
and testing of the EoS derived from the screened hydrogenic model with ℓ-splitting
(SHM-ℓ), developed by Faussurier et al. [1], this work presents the further development of the
atomic physics code, SpK. The core model of SpK solves the Saha equation, modified to capture
non-ideal physics, to obtain distributions of ion charges and their bound electron configuration
populations. Configuration energies are obtained from the NIST database, or calculated using
the SHM-ℓ. Originally designed to calculate opacities from this information, the present work
extends the capabilities of the code to calculate EoS data self-consistently with the opacity and
underlying atomic physics model.
The Q-MHD model [2], an electron EoS that utilises a fit to the Hooper microfield distribution
function [3, 4] to truncate the internal partition functions in Saha-type methods, is implemented
for weakly coupled conditions. We interpolate into the Thomas-Fermi (TF) model [5] when
strongly coupled, because the TF model is more valid than Saha-type methods in this region of
parameter space. We also implement a model approximating the physics of diatomic molecular
dissociation in the Cowan model [6] for the ion EoS. The semi-empirical bonding corrections
used in the FEOS code [7] are implemented to approximate the attractive forces of chemical
bonding, with a Maxwell construction routine developed to model the liquid-vapour coexistence
region. The result is a code that can generate tabulated EoS and opacity data in minutes.
EoS data generated by SpK is utilised in shock Hugoniot calculations and sensitivity studies on
integrated simulations of indirect-drive implosions and the experiments of Setchell et al. [8].
Both studies demonstrate a sensitivity to the choice of EoS models utilised.
that is self-consistent with the underlying microphysics models. Following the successful implementation
and testing of the EoS derived from the screened hydrogenic model with ℓ-splitting
(SHM-ℓ), developed by Faussurier et al. [1], this work presents the further development of the
atomic physics code, SpK. The core model of SpK solves the Saha equation, modified to capture
non-ideal physics, to obtain distributions of ion charges and their bound electron configuration
populations. Configuration energies are obtained from the NIST database, or calculated using
the SHM-ℓ. Originally designed to calculate opacities from this information, the present work
extends the capabilities of the code to calculate EoS data self-consistently with the opacity and
underlying atomic physics model.
The Q-MHD model [2], an electron EoS that utilises a fit to the Hooper microfield distribution
function [3, 4] to truncate the internal partition functions in Saha-type methods, is implemented
for weakly coupled conditions. We interpolate into the Thomas-Fermi (TF) model [5] when
strongly coupled, because the TF model is more valid than Saha-type methods in this region of
parameter space. We also implement a model approximating the physics of diatomic molecular
dissociation in the Cowan model [6] for the ion EoS. The semi-empirical bonding corrections
used in the FEOS code [7] are implemented to approximate the attractive forces of chemical
bonding, with a Maxwell construction routine developed to model the liquid-vapour coexistence
region. The result is a code that can generate tabulated EoS and opacity data in minutes.
EoS data generated by SpK is utilised in shock Hugoniot calculations and sensitivity studies on
integrated simulations of indirect-drive implosions and the experiments of Setchell et al. [8].
Both studies demonstrate a sensitivity to the choice of EoS models utilised.
Version
Open Access
Date Issued
2024-07
Date Awarded
2024-03
Copyright Statement
Creative Commons Attribution NonCommercial Licence
License URL
Advisor
Chittenden, Jeremy
Crilly, Aidan
Chapman, Dave
Sponsor
First Light Fusion Limited
Publisher Department
Physics
Publisher Institution
Imperial College London
Qualification Level
Doctoral
Qualification Name
Doctor of Philosophy (PhD)