Oxford Centre for High Energy Density Science (OxCHEDS)

Abstract:

Modeling many-body quantum systems with strong interactions is one of the core challenges of modern physics. A range of methods has been developed to approach this task, each with its own idiosyncrasies, approximations, and realm of applicability. Perhaps the most successful and ubiquitous of these approaches is density functional theory (DFT). Its Kohn-Sham formulation has been the basis for many fundamental physical insights, and it has been successfully applied to fields as diverse as quantum chemistry, condensed matter and dense plasmas. Despite the progress made by DFT and related schemes, however, there remain many problems that are intractable for existing methods. In particular, many approaches face a huge computational barrier when modeling large numbers of coupled electrons and ions at finite temperature. Here, we address this shortfall with a new approach to modeling many-body quantum systems. Based on the Bohmian trajectories formalism, our new method treats the full particle dynamics with a considerable increase in computational speed. As a result, we are able to perform large-scale simulations of coupled electron-ion systems without employing the adiabatic Born-Oppenheimer approximation.

Abstract:

We present 50-fs, single-shot measurements of the x-ray thermal diffuse scattering (TDS) from copper foils that have been shocked via nanosecond laser-ablation up to pressures above ∼135 GPa. We hence deduce the x-ray Debye-Waller (DW) factor, providing a temperature measurement. The targets were laser-shocked with the DiPOLE 100-X laser at the High Energy Density (HED) endstation of the European X-ray Free-Electron Laser (EuXFEL). Single x-ray pulses, with a photon energy of 18 keV, were scattered from the samples and recorded on Varex detectors. Despite the targets being highly textured (as evinced by large variations in the elastic scattering), and with such texture changing upon compression, the absolute intensity of the azimuthally averaged inelastic TDS between the Bragg peaks is largely insensitive to these changes, and, allowing for both Compton scattering and the low-level scattering from a sacrificial ablator layer, provides a reliable measurement of T /Θ2 D, where ΘD is the Debye temperature. We compare our results with the predictions of the SESAME 3336 and LEOS 290 equations of state for copper, and find good agreement within experimental errors. We thus demonstrate that single-shot temperature measurements of dynamically compressed materials can be made via thermal diffuse scattering of XFEL radiation.

Abstract:

Hydrodynamic optically-field-ionized (HOFI) plasma channels up to 100mm long are investigated. Optical guiding is demonstrated of laser pulses with a peak input intensity of $6\times10^{17}$ W cm$^{-2}$ through 100mm long plasma channels with on-axis densities measured interferometrically to be as low as $n_{e0} = (1.0\pm0.3)\times10^{17}$cm$^{-3}$. Guiding is also observed at lower axial densities, which are inferred from magneto-hydrodynamic simulations to be approximately $7\times10^{16}$cm$^{-3}$. Measurements of the power attenuation lengths of the channels are shown to be in good agreement with those calculated from the measured transverse electron density profiles. To our knowledge, the plasma channels investigated in this work are the longest, and have the lowest on-axis density, of any free-standing waveguide demonstrated to guide laser pulses with intensities above $>10^{17}$ W cm$^{-2}$.

Abstract:

By performing an ensemble of molecular dynamics simulations, the model-dependent ionisation state is computed for strongly interacting systems self-consistently. This is accomplished through a free energy minimisation framework based on the technique of thermodynamic integration. To illustrate the method, two simple models applicable to partially ionised hydrogen plasma are presented in which pair potentials are employed between ions and neutral particles. Within the models, electrons are either bound in the hydrogen ground state or distributed in a uniform charge-neutralising background. Particular attention is given to the transition between atomic gas and ionised plasma, where the effect of neutral interactions is explored beyond commonly used models in the chemical picture. Furthermore, pressure ionisation is observed when short range repulsion effects are included between neutrals. The developed technique is general, and we discuss the applicability to a variety of molecular dynamics models for partially ionised warm dense matter.