paper

Uniform electron gases. I. Electrons on a ring

arXiv:1302.6661 · doi:10.1063/1.4802589

Abstract

We introduce a new paradigm for one-dimensional uniform electron gases (UEGs). In this model, electrons are confined to a ring and interact via a bare Coulomb operator. We use Rayleigh-Schrödinger perturbation theory to show that, in the high-density regime, the ground-state reduced (i.e. per electron) energy can be expanded as $\eps(r_s,n) = \eps_0(n) r_s^{-2} + \eps_1(n) r_s^{-1} + \eps_2(n) +\eps_3(n) r_s + \ldots$, where is the Seitz radius. We use strong-coupling perturbation theory and show that, in the low-density regime, the reduced energy can be expanded as $\eps(r_s,n) = η_0(n) r_s^{-1} + η_1(n) r_s^{-3/2} + η_2(n) r_s^{-2} + \ldots$. We report explicit expressions for $\eps_0(n)$, $\eps_1(n)$, $\eps_2(n)$, $\eps_3(n)$, and and derive the thermodynamic (large-) limits of each of these. Finally, we perform numerical studies of UEGs with , using Hylleraas-type and quantum Monte Carlo methods, and combine these with the perturbative results to obtain a picture of the behavior of the new model over the full range of and values.

13 pages, 6 tables and 1 figure, accepted for publication in J. Chem. Phys

References in corpus (20)

Cited by in corpus (22)