Dynamical Ionic Clusters with Flowing Electron Bubbles from Warm to Hot Dense Iron along the Hugoniot Curve

Abstract

The complex structures of warm and hot dense matter are essential to understand the behaviors of materials in high energy density physics processes and provide new features of matter constitutions. Here, along a new unified first-principle determined Hugoniot curve of iron from normal condensed condition up to 1 Gbar, the novel structures characterized by the ionic clusters and separated "electron bubbles" are revolutionarily unraveled using newly developed quantum Langevin molecular dynamics (QLMD). Subsistence of complex clusters, with bonds formed by inner shell electrons of neighbor ions, can persist in the time length of 50 femto-seconds dynamically with quantum flowing bubbles, which are produced by the interplay of Fermi electron degeneracy, the ionic coupling and the dynamical nature. With the inclusion of those complicated features in QLMD, the present data could serve as a first-principle benchmark in a wide range of temperatures and densities.

5 pages, 4 figures

References in corpus (5)

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• Interstitial Electronic Localization
• Persistence of Covalent Bonding in Liquid Silicon Probed by Inelastic X-ray Scattering
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Cited by in corpus (5)

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• Revealing the Complex Transport Behaviors in Warm Dense Hydrogen by Including Nuclear Quantum Effects
• Full-scale ab initio simulations of laser-driven atomistic dynamics
• Reduced Ionic Diffusion by the Dynamic Electron-Ion Collisions in Warm Dense Hydrogen
• Electrical and optical properties of fluid iron from compressed to expanded regime