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Canadian Journal of Physics

Wave-number dependence of the static screening function of an interacting electron gas. I. Lowest-order Hartree–Fock corrections

D. J. W. Geldart, Roger Taylor

Published Jan 15, 1970• 183 citations
Publisher

Abstract

The lowest-order Hartree–Fock contributions to the zero frequency screening function are examined for an interacting electron gas in its ground state. Computational methods are developed to treat singularities associated with the bare coulomb interaction and vanishing energy denominators of the many-body perturbation expansion. Numerical results are given. The wave-number dependence in the intermediate (k ~ kF) range differs considerably from that of previous estimates.

DOI
10.1139/p70-022

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The lowest-order Hartree–Fock contributions to the zero frequency screening function are examined for an interacting electron gas in its ground state. Computational methods are developed to treat singularities associated with the bare coulomb interaction and vanishing energy denominators of the many-body perturbation expansion. Numerical results are given. The wave-number dependence in the intermediate (k ~ kF) range differs considerably from that of previous estimates.
The condition that the plane wave state is the lowest Hartree-Fock state of a large fermion system with repulsive interactions, is generally investigated and applied to the systems with $\ensuremath{\delta}$-type interactions, finite-range interactions, and long-range Coulomb interactions. It is found that for finite-range interactions the plane wave state is stable in both the high-density and low-density regions, but may become unstable in the intermediate-density region. The high-density stable region disappears for $\ensuremath{\delta}$-type interactions, while the low-density stable region vanishes for long-range Coulomb interactions. Especially for an electron gas, the critical value rs{r}_{s}rs​ is smaller than 4.5. A speculation concerning the transition of the true ground state is discussed.
Following previous work in which a variational method for the many-body problem was proposed wherein an effective potential $\stackrel{\ifmmode \tilde{}\else \~{}\fi{}}{V}$ was introduced as a variational parameter to construct a trial wave function, we apply the method to the two-dimensional electron gas. In the method, every physical quantity is expanded in powers of $\stackrel{\ifmmode \tilde{}\else \~{}\fi{}}{V}$ instead of the bare potential as in the usual perturbation-theoretic approach. Because of this choice of expansion parameter, the expansion series converges rapidly even in the strong-coupling region. The result for the correlation energy in the two-dimensional electron gas agrees very well with that given by the variational Monte Carlo method even in the lowest-order calculation (i.e., to second order in $\stackrel{\ifmmode \tilde{}\else \~{}\fi{}}{V}$). The difference is within several percent for 1<rs<1001<{r}_{s}<1001<rs​<100.
In this paper,due to the effect of positively-charged screening holes,the Coulomb potential energy 1/r is modified to be 1/rp.Using many-body quantum perturbation theory,we obtain a simple analytic representation of the ground state energy for a two-dimensional electron gas.It is found that the ground-state energy E and equilibrium radius reps are dependent on the interaction parameter p.Our results agree with those obtained by the numerical simulations and semi-analytic methods at low density limit.
There exists a widely believed opinion, that the many-body ground state of a two-dimensional electron system at a completely filled lowest Landau level (the filling factor ν=1ν=1ν=1) is described by the so-called Hartree-Fock wave function, and that this solution is the unique, exact eigenstate of the system at ν=1ν=1ν=1. I show that this opinion is erroneous, construct an infinite number of other variational many-body wave functions, and discuss the properties of a few states which have the energy substantially lower than the energy of the Hartree-Fock state.
In this lecture we present many-body perturbation theory as a method to determine quasiparticle excitations in solids, especially electronic band structures, accurately from first principles.The main ingredient is the electronic self-energy that, in principle, contains all many-body exchange and correlation effects beyond the Hartree potential.As its exact mathematical expression is unknown, approximations must be used in practical calculations.The approximation is obtained using a systematic algebraic approach on the basis of Green function techniques.It constitutes an expansion of the self-energy up to linear order in the screened Coulomb potential, which describes the interaction between the quasiparticles and includes dynamic screening through the creation of exchange-correlation holes around the bare particles.The implementation of the approximation relies on a perturbative treatment starting from density functional theory.Besides a detailed mathematical discussion we focus on the underlying physical concepts and show some illustrative applications.