Ionic structure, Liquid-liquid phase transitions, X-Ray diffraction, and X-Ray Thomson scattering in shock compressed liquid Silicon in the 100-200 GPa regime
Abstract
Recent cutting-edge experiments have provided {\it in situ} structure characterization and measurements of the pressure (), density () and temperature () of shock compressed silicon in the 100 GPa range of pressures and upto 10,000K. We present first-principles calculations in this regime to reveal a plethora of novel liquid-liquid phase transitions (LPTs) identifiable via discontinuities in the pressure and the compressibility. Evidence for the presence of a highly-correlated liquid (CL) phase, as well as a normal-liquid (NL) phase at the LPTs is presented by a detailed study of one LPT. The LPTs make the interpretation of these experiments more challenging. The LPTs preserve the short-ranged ionic structure of the fluid by collective adjustments of many distant atoms when subject to compression and heating, with minimal change in the ion-ion pair-distribution functions, and in transport properties such as the electrical and thermal conductivities and . We match the experimental X-Ray Thomson scattering and X-ray diffraction data theoretically, and provide pressure isotherms, ionization data and compressibilities that support the above picture of liquid silicon as a highly complex LPT-driven ``glassy'' metallic liquid. These novel results are relevant to materials research, studies of planetary interiors, high-energy-density physics, and in laser-fusion studies.
Keywords
Cite
@article{arxiv.2408.04173,
title = {Ionic structure, Liquid-liquid phase transitions, X-Ray diffraction, and X-Ray Thomson scattering in shock compressed liquid Silicon in the 100-200 GPa regime},
author = {M. W. C. Dharma-wardana and Dennis D. Klug and Hannah Poole and G. Gregori},
journal= {arXiv preprint arXiv:2408.04173},
year = {2024}
}
Comments
8 pages, six figures