J. Chihara et al., Nucleus-electron model for states changing from a liquid metal to a plasmaand the Saha equation, PHYS REV E, 60(3), 1999, pp. 3262-3272
We extend the quantal hypernetted-chain (QHNC) method, which has been prove
d to yield accurate results for liquid metals, to treat a partially ionized
plasma. In a plasma, the electrons change from a quantum to a classical fl
uid gradually with increasing temperature; the QHNC method applied to the e
lectron gas is in fact able to provide the electron-electron correlation at
an arbitrary temperature. As an illustrating example of this approach, we
investigate how Liquid rubidium becomes a plasma by increasing the temperat
ure from 0 to 30 eV at a fixed normal ion density 1.03 x 10(22)/cm(3). Th,
electron-ion radial distribution function (RDF) in liquid Rb has distinct i
nner-core and outer-core parts. Even at a temperature of 1 eV, this clear d
istinction remains as a characteristic of a liquid metal. At a temperature
of 3 eV, this distinction disappears, and rubidium becomes a plasma with th
e ionization 1.21. The temperature variations of bound levels in each ion a
nd the average ionization are calculated in Rb plasmas at the same time. Us
ing the density-functional theory, we also derive the Saha equation applica
ble even to a high-density plasma at low temperatures. The QHNC method prov
ides a procedure to solve this Saha equation with ease by using a recursive
formula; the charge population of differently ionized species are obtained
in Rb plasmas at several temperatures. In this way, it is shown that, with
the atomic number as the only input, the QHNC method produces the average
ionization, the electron-ion and ion-ion RDF's, and the charge population t
hat are consistent with the atomic structure of each ion for a partially io
nized plasma. [S1063-651X(99)04809-6].