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Density functional theory for collisionless plasmas – equivalence of fluid and kinetic approaches

Published online by Cambridge University Press:  13 April 2020

Giovanni Manfredi*
Affiliation:
Université de Strasbourg, CNRS, Institut de Physique et Chimie des Matériaux de Strasbourg, UMR 7504, F-67000Strasbourg, France
*
†Email address for correspondence: giovanni.manfredi@ipcms.unistra.fr
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Abstract

Density functional theory (DFT) is a powerful theoretical tool widely used in such diverse fields as computational condensed-matter physics, atomic physics and quantum chemistry. DFT establishes that a system of $N$ interacting electrons can be described uniquely by its single-particle density $n(\boldsymbol{r})$, instead of the $N$-body wave function, yielding an enormous gain in terms of computational speed and memory storage space. Here, we use time-dependent DFT to show that a classical collisionless plasma can always, in principle, be described by a set of fluid equations for the single-particle density and current. The results of DFT guarantee that an exact closure relation, fully reproducing the Vlasov dynamics, necessarily exists, although it may be complicated (non-local in space and time, for instance) and difficult to obtain in practice. This goes against the common wisdom in plasma physics that the Vlasov and fluid descriptions are mutually incompatible, with the latter inevitably missing some ‘purely kinetic’ effects.

Information

Type
Research Article
Copyright
© Cambridge University Press 2020
Figure 0

Figure 1. Schematics of the TD-DFT approach. The RG theorem proves the equivalence between $n$ and $V$. But $V$ determines $f$ through the Vlasov–Poisson equations and $n$ is obtained from $f$ by velocity–space integration. Thus, the counterclockwise arrows show that $n\leftrightarrow f$, i.e. the full Vlasov dynamics can be encoded in the evolution of the density.

Figure 1

Figure 2. There is a one-to-one correspondence between the density $n(x,t)$ and the external potentials $V$ and $V^{\prime }$, for different interactions $\unicode[STIX]{x1D719}$ and $\unicode[STIX]{x1D719}^{\prime }$.