Transport coefficients of warm dense matter from Kohn-Sham density functional theory

We present a comprehensive study of transport coefficients including DC electrical conductivity and related optical properties, electrical contribution to the thermal conductivity, and the shear viscosity via ab initio molecular dynamics and density functional theory calculations on the “priority 1”...

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Veröffentlicht in:	Physics of plasmas 2024-04, Vol.31 (4)
Hauptverfasser:	Melton, Cody A., Clay, Raymond C., Cochrane, Kyle R., Dumi, Amanda, Gardiner, Thomas A., Lentz, Meghan K., Townsend, Joshua P.
Format:	Artikel
Sprache:	eng
Schlagworte:	Algorithms Density functional theory Electrical resistivity Molecular dynamics Optical properties PHYSICS OF ELEMENTARY PARTICLES AND FIELDS Shear viscosity Thermal conductivity Transport properties Workflow
Online-Zugang:	Volltext
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