English

The two-body reduced density matrix of the high-density electron gas

Strongly Correlated Electrons 2012-03-28 v4

Abstract

For the first time, the cumulant 2-body reduced density matrix (= 2-matrix) of the spin-unpolarized homogeneous electron gas (HEG) is considered. This γc\gamma_{\rm c} proves to be the common source for both the momentum distribution n(k)n(k) and the static structure factor S(q)S(q). Within many-body perturbation theory, this γc\gamma_{\rm c} is given by only {\it linked} diagrams (with 2 open particle-hole lines as well as with closed loops and interaction lines). Here it is worked out in detail, how the 1-body quantity n(k)n(k) follows from the 2-body quantity γc\gamma_{\rm c} - through a certain contraction procedure, cf Eqs.(2.25)-(2.28). In particular, this γc\gamma_{\rm c} is developed for the high-density HEG. Its correctness is checked by deriving from it n(k)n(k) and S(q)S(q), known from the random-phase approximation (RPA). This study opens the way to a more sophisticated HEG description in terms of cumulant geminals or/and variational methods. Besides, the cumulant structure factor (CSF) of the exchange in lowest order is explicitly given and sum rules for the CSFs and their small- and large-qq behavior (beyond RPA) are systematically summarized within the plasmon sum rule, coalescing theorems, and the inflexion-point trajectory.

Keywords

Cite

@article{arxiv.1108.1912,
  title  = {The two-body reduced density matrix of the high-density electron gas},
  author = {P. Ziesche},
  journal= {arXiv preprint arXiv:1108.1912},
  year   = {2012}
}

Comments

40 pages, 6 figures, 2 tables