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arXiv:nucl-th/0602050 · Physical Review A

Density-functional theory for fermions close to the unitary regime

Anirban Bhattacharyya, T. Papenbrock

Published Oct 16, 2006• 29 citations
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Abstract

We consider interacting Fermi systems close to the unitary regime and compute the corrections to the energy density that are due to a large scattering length and a small effective range. Our approach exploits the universality of the density functional and determines the corrections from the analyical results for the harmonically trapped two-body system. The corrections due to the finite scattering length compare well with the result of Monte Carlo simulations. We also apply our results to symmetric neutron matter.

DOI
10.1103/physreva.74.041602

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We consider interacting Fermi systems close to the unitary regime and compute the corrections to the energy density that are due to a large scattering length and a small effective range. Our approach exploits the universality of the density functional and determines the corrections from the analyical results for the harmonically trapped two-body system. The corrections due to the finite scattering length compare well with the result of Monte Carlo simulations. We also apply our results to symmetric neutron matter.
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We extract the leading effective-range corrections to the equation of state of the unitary Fermi gas from ab initio fixed-node quantum Monte Carlo (QMC) calculations in a periodic box using a density functional theory (DFT), and show them to be universal by considering several two-body interactions. Furthermore, we find that the DFT is consistent with the best available unbiased QMC calculations, analytic results, and experimental measurements of the equation of state. We also discuss the asymptotic effective-range corrections for trapped systems and present QMC results with the correct asymptotic scaling.
We investigate a density-functional theory (DFT) approach for an unpolarized trapped dilute Fermi gas in the unitary limit. A reformulation of the recent work of T. Papenbrock [1] in the language of fractional exclusion statistics allows us to obtain an estimate of the universal factor, ξ3D, in three dimensions (3D), in addition to providing a systematic treatment of finite-N corrections. We show that in 3D, finite-N corrections lead to unphysical values for ξ3D, thereby suggesting that a simple DFT applied to a small number of particles may not be suitable in 3D. We then perform an analogous calculation for the two-dimensional (2D) system in the infinite-scattering length regime, and obtain a value of ξ2D=1. Owing to the unique properties of the Thomas-Fermi energy density-functional in 2D our result, in contrast to 3D, is exact and therefore requires no finite-N corrections.
In the unitary regime, fermions interact strongly via two-body potentials that exhibit a zero range and a (negative) infinite scattering length. The energy density is proportional to the energy density of the free Fermi gas with a proportionality constant $\ensuremath{\xi}$. The author uses a simple density functional parametrized by an effective mass and the universal constant $\ensuremath{\xi}$, and employs Kohn-Sham density-functional theory to obtain the parameters from fit to one exactly solvable two-body problem. This yields $\ensuremath{\xi}=0.42$ and a rather large effective mass. The form of the density functional is checked by similar Kohn-Sham calculations for the exactly solvable Calogero model.
Various quantities of an attractively interacting fermion system at the unitary limit are determined by extrapolating Monte Carlo results of low-density neutron matter. Smooth extrapolation in terms of 1/(kFa0)1/({k}_{F}{a}_{0})1/(kF​a0​) (kF{k}_{F}kF​ is the Fermi momentum, and a0{a}_{0}a0​ is the 1S0{}^{1}{S}_{0}1S0​ scattering length) is found with the quantities examined: the ground-state energy, the pairing gap at $T\ensuremath{\approx}0$, and the critical temperature of the normal-to-superfluid phase transition. We emphasize proximity of the physics of low-density neutron matter to that at the unitary limit. The extrapolated quantities are in a reasonable agreement with those in the literature.
A recent paper by T. Papenbrock [Phys. Rev. A 72, 041602(R) (2005)] suggests that a determination of the universal factor ${\ensuremath{\xi}}_{3\mathrm{D}}$ for a harmonically trapped, unpolarized dilute Fermi gas in the unitary regime may be obtained within the framework of a simple density-functional theory (DFT). One of the key results of that work is an estimate for the universal factor ${\ensuremath{\xi}}_{3\mathrm{D}}\ensuremath{\approx}0.54$, which is within 20% of the generally accepted quantum Monte Carlo simulation value of ${\ensuremath{\xi}}_{3\mathrm{D}}=0.44\ifmmode\pm\else\textpm\fi{}0.01$. Motivated by this result, this report investigates the determination of the universal factor ${\ensuremath{\xi}}_{2\mathrm{D}}$ for a two-dimensional trapped Fermi gas, and suggests that the simple DFT approach of Papenbrock provides an exact result of ${\ensuremath{\xi}}_{2\mathrm{D}}=1$ in two dimensions.