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arXiv:cond-mat/0404513 · Physical Review A

Time-dependent density-functional theory for trapped strongly interacting fermionic atoms

Yeong E. Kim, Alexander L. Zubarev

Published Sep 27, 2004• 141 citations
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Abstract

The dynamics of strongly interacting trapped dilute two-component Fermi gases (dilute in the sense that the range of interatomic potential is small compared with interparticle spacing) is investigated in a single-equation approach to the time-dependent density-functional theory. For the ground-state energy per particle of the system in the homogeneous phase, we have constructed an Pad\'e parametrization based on Monte Carlo data and asymptotic behavior. Our numerical results for collective frequencies in the BCS-BEC crossover regime are in good agreement with recent experimental data obtained by the Duke University group. In addition, we show that the calculated corrections to the hydrodynamic approximation may be important, even for systems with a rather large number of atoms.

DOI
10.1103/physreva.70.033612

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The dynamics of strongly interacting trapped dilute two-component Fermi gases (dilute in the sense that the range of interatomic potential is small compared with interparticle spacing) is investigated in a single-equation approach to the time-dependent density-functional theory. For the ground-state energy per particle of the system in the homogeneous phase, we have constructed an Pad'e parametrization based on Monte Carlo data and asymptotic behavior. Our numerical results for collective frequencies in the BCS-BEC crossover regime are in good agreement with recent experimental data obtained by the Duke University group. In addition, we show that the calculated corrections to the hydrodynamic approximation may be important, even for systems with a rather large number of atoms.
Dynamics of strongly interacting Fermi gases, consisting of a 50-50 mixture of two different fermionic species, is investigated. For the equation of state we consider a Padé [2/2] approximations, which gives the weak-coupling perturbative formula (up to 4th order) in the low density regime, the unitary-limit Monte Carlo result in the high density regime, and reproduces the 4-fermion prediction for dimer-dimer scattering length in the BEC region. We use a time-dependent LDA to derive various properties of the Fermi gas under a harmonic confinement and compare them with the data of very recent experiments of 6Li atoms across a Feshbach resonance.
We investigate the zero-temperature properties of a dilute two-component Fermi gas with attractive interspecies interaction in the BCS-BEC crossover. We build an efficient parametrization of the energy per particle based on Monte Carlo data and asymptotic behavior. This parametrization provides, in turn, analytical expressions for several bulk properties of the system such as the chemical potential, the pressure, and the sound velocity. In addition, by using a time-dependent density functional approach, we determine the collective modes of the Fermi gas under harmonic confinement. The calculated collective frequencies are compared to experimental data on confined vapors of 6Li^{6}\mathrm{Li}6Li atoms and with other theoretical predictions.
Ultracold atomic Fermi gases have been a popular topic of research, with attention being paid recently to two-dimensional (2D) gases. In this work, we perform T=0T=0T=0 ab initio diffusion Monte Carlo calculations for a strongly interacting two-component Fermi gas confined to two dimensions. We first go over finite-size systems and the connection to the thermodynamic limit. After that, we illustrate pertinent 2D scattering physics and properties of the wave function. We then show energy results for the strong-coupling crossover, in between the Bose-Einstein condensation (BEC) and Bardeen-Cooper-Schrieffer (BCS) regimes. Our energy results for the BEC-BCS crossover are parametrized to produce an equation of state, which is used to determine Tan's contact. We carry out a detailed comparison with other microscopic results. Finally, we calculate the pairing gap for a range of interaction strengths in the strong coupling regime, following from variationally optimized many-body wave functions.
We determine the energetically lowest-lying states in the BEC-BCS crossover regime of sss-wave interacting two-component Fermi gases under harmonic confinement by solving the many-body Schr\"odinger equation using two distinct approaches. Essentially exact basis set expansion techniques are applied to determine the energy spectrum of systems with N=4N=4N=4 fermions. Fixed-node diffusion Monte Carlo methods are applied to systems with up to N=20N=20N=20 fermions, and a discussion of different guiding functions used in the Monte Carlo approach to impose the proper symmetry of the fermionic system is presented. The energies are calculated as a function of the sss-wave scattering length as{a}_{s}as​ for N=2−−20N=2--20N=2−−20 fermions and different mass ratios $\ensuremath{\kappa}$ of the two species. On the Bose-Einstein condensate (BEC) and BCS sides, our energies agree with analytically determined first-order correction terms. We extract the scattering length and the effective range of the dimer-dimer system up to $\ensuremath{\kappa}=20$. Our energies for the strongly interacting trapped system in the unitarity regime show essentially no shell structure, and are well described by a simple expression whose functional form can be derived using the local density approximation, with one or two parameters. The universal parameter $\ensuremath{\xi}$ for the trapped system for various $\ensuremath{\kappa}$ is determined, and comparisons with results for the homogeneous system are presented.
We investigate the ground-state properties of two-component Bose gases confined in one-dimensional harmonic traps in the scheme of density-functional theory. The density-functional calculations employ a Bethe-ansatz-based local-density approximation for the correlation energy, which accounts for the correlation effect properly from the weakly interacting regime to the strongly interacting regime. For the binary Bose mixture with spin-independent interaction, the homogeneous reference system is exactly solvable by the Bethe-ansatz method. Within the local-density approximation, we determine the density distribution of each component and study its evolution from Bose distributions to Fermi-like distribution with the increase in interaction. For the binary mixture of Tonks-Girardeau gases with a tunable interspecies repulsion, with a generalized Bose-Fermi transformation we show that the Bose mixture can be mapped into a two-component Fermi gas, which corresponds to exact soluble Yang-Gaudin model for the homogeneous system. Based on the ground-state energy function of the Yang-Gaudin model, the ground-state density distributions are calculated for various interspecies interactions. It is shown that with the increase in interspecies interaction, the system exhibits composite-fermionization crossover.
Trapped two-component Fermi gases allow the investigation of the so-called BCS-BEC crossover by tuning the interspecies atom-atom sss-wave scattering length a(aa){a}^{(\mathit{aa})}a(aa) from attractive to repulsive, including vanishing and infinitely large values. Here, we numerically determine the energy spectrum of the equal-mass spin-balanced four-fermion system---the smallest few-particle system that exhibits BCS-BEC crossoverlike behavior---as a function of a(aa){a}^{(\mathit{aa})}a(aa) using the stochastic variational approach. For comparative purposes, we also treat the two- and three-particle systems. States with vanishing and finite total angular momenta as well as with natural and unnatural parities are considered. In addition, the energy spectrum of weakly attractive and weakly repulsive gases is characterized by employing a perturbative framework that utilizes hyperspherical coordinates. The hyperspherical coordinate approach allows the straightforward assignment of quantum numbers and furthermore provides great insight into the strongly interacting unitary regime.