Ionization of carbon at 10-100 times the diamond density and in the 10^{6}K temperature range.

Abstract

The behavior of partially ionized hot compressed matter is critical to the study of planetary interiors as well as nuclear fusion studies. A recent quantum study of carbon in the 10-70 Gbar range and at a temperature of 100eV used N-atom density functional theory (DFT) with N∼32-64 and molecular dynamics (MD). This involves band-structure-type electronic calculations and averaging over many MD-generated ion configurations. The calculated average number of free electrons per ion, viz., Z[over ¯], was systematically higher than from a standard average-atom quantum calculation. To clarify this offset, we examine the effect of the self-interaction error in such estimates and the possibility of carbon being in a granular plasma state containing Coulomb crystals with a magic number. The electrical conductivity, pressure, and compressibility of the carbon system are examined. The very low conductivity and the high-Z[over ¯] results of DFT MD point to the existence of carbon in a complex, nonuniform, low-conducting dispersed phase, possibly containing magic-number Coulomb crystals. The neutral pseudoatom estimate of Z[over ¯], conductivity, compressibility, and pressure reported here pertain to the uniform liquid.