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Ground-state energy, density profiles, and momentum distribution of attractively interacting 1D Fermi gases with hard-wall boundaries: a Monte Carlo study

Shill,, Drut,, Porter Porter, McKenney

Published Apr 18, 2020• 0 citations
Publisher

Abstract

Motivated by the realization of hard-wall boundary conditions in experiments with ultracold atoms, we investigate the ground-state properties of spin-1/2 fermions with attractive interactions in a one-dimensional box.We use lattice Monte Carlo methods to determine essential quantities like the energy, which we compute as a function of coupling strength and particle number in the regime from few to many particles.Many-fermion systems bound by hard walls display non-trivial density profiles characterized by so-called Friedel oscillations (which are similar to those observed in harmonic traps).In non-interacting systems, the characteristic length scale of the oscillations is set by (2k F ) -1 , where k F is the Fermi momentum, while repulsive interactions tend to generate Wignercrystal oscillations of period (4k F ) -1 .Based on the non-interacting result, we find a remarkably simple parametrization of the density profiles of the attractively interacting case, which we generalize to the one-body density matrix.While the total momentum is not a conserved quantity in the presence of hard walls, the magnitude of the momentum does provide a good quantum number.We are therefore able to provide a detailed characterization of the (quasi-)momentum distribution, which displays rather robust discontinuity at the Fermi surface.In addition, we determine the spatially varying on-site density-density correlation, which in turn yields Tan's contact density and, upon integration, Tan's contact.As is well known, the latter fully determines the short-range correlations and plays a crucial role in a multitude of equilibrium and non-equilibrium sum rules.

DOI
10.17615/7ms8-mj91

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Motivated by the realization of hard-wall boundary conditions in experiments with ultracold atoms, we investigate the ground-state properties of spin-1/2 fermions with attractive interactions in a one-dimensional box.We use lattice Monte Carlo methods to determine essential quantities like the energy, which we compute as a function of coupling strength and particle number in the regime from few to many particles.Many-fermion systems bound by hard walls display non-trivial density profiles characterized by so-called Friedel oscillations (which are similar to those observed in harmonic traps).In non-interacting systems, the characteristic length scale of the oscillations is set by (2k F ) -1 , where k F is the Fermi momentum, while repulsive interactions tend to generate Wignercrystal oscillations of period (4k F ) -1 .Based on the non-interacting result, we find a remarkably simple parametrization of the density profiles of the attractively interacting case, which we generalize to the one-body density matrix.While the total momentum is not a conserved quantity in the presence of hard walls, the magnitude of the momentum does provide a good quantum number.We are therefore able to provide a detailed characterization of the (quasi-)momentum distribution, which displays rather robust discontinuity at the Fermi surface.In addition, we determine the spatially varying on-site density-density correlation, which in turn yields Tan's contact density and, upon integration, Tan's contact.As is well known, the latter fully determines the short-range correlations and plays a crucial role in a multitude of equilibrium and non-equilibrium sum rules.
Abstract Motivated by the realization of hard-wall boundary conditions in experiments with ultracold atoms, we investigate the ground-state properties of spin-1/2 fermions with attractive interactions in a one-dimensional box. We use lattice Monte Carlo methods to determine essential quantities like the energy, which we compute as a function of coupling strength and particle number in the regime from few to many particles. Many-fermion systems bound by hard walls display non-trivial density profiles characterized by so-called Friedel oscillations (which are similar to those observed in harmonic traps). In non-interacting systems, the characteristic length scale of the oscillations is set by ( 2 k F ) − 1 , where k F is the Fermi momentum, while repulsive interactions tend to generate Wigner-crystal oscillations of period ( 4 k F ) − 1 . Based on the non-interacting result, we find a remarkably simple parametrization of the density profiles of the attractively interacting case, which we generalize to the one-body density matrix. While the total momentum is not a conserved quantity in the presence of hard walls, the magnitude of the momentum does provide a good quantum number. We are therefore able to provide a detailed characterization of the (quasi-)momentum distribution, which displays rather robust discontinuity at the Fermi surface. In addition, we determine the spatially varying on-site density–density correlation, which in turn yields Tan’s contact density and, upon integration, Tan’s contact. As is well known, the latter fully determines the short-range correlations and plays a crucial role in a multitude of equilibrium and non-equilibrium sum rules.
Many-fermion systems bound by hard walls display non-trivial density profiles characterized by so-called Friedel oscillations. In non-interacting systems, the characteristic scale of the oscillations is 2kF2 k^{}_F2kF​, where kFk^{}_FkF​ is the Fermi momentum, while repulsive interactions tend to generate Wigner-crystal oscillations at 4kF4 k^{}_F4kF​. We take a closer look at interacting systems in the presence of strong pairing correlations, such as those realized experimentally with ultracold atoms. We use ab initio lattice Monte Carlo methods to study the density profiles of few- to many-fermion systems in 1D, in the presence of hard-wall boundary conditions and attractive interactions. Additionally, we compute the ground-state energy and the momentum distribution.
We calculate the ground-state properties of unpolarized two-dimensional attractive fermions in the range from few to many particles. Using first-principles lattice Monte Carlo methods, we determine the ground-state energy, Tan's contact, momentum distribution, and single-particle correlation function. We investigate those properties for systems of $N=4,8,\ensuremath{\cdots},40$ particles and for a wide range of attractive couplings. As the attractive coupling is increased, the thermodynamic limit is reached at progressively lower NNN due to the dominance of the two-body sector. At large momenta kkk, the momentum distribution displays the expected ${k}^{\ensuremath{-}4}$ behavior, but its onset shifts from $k\ensuremath{\simeq}1.8{k}_{F}^{}$ at weak coupling towards higher kkk at strong coupling.
We determine the ground-state energy and Tan's contact of attractively interacting few-fermion systems in a one-dimensional harmonic trap, for a range of couplings and particle numbers. Complementing those results, we show the corresponding density profiles. The calculations were performed with a lattice Monte Carlo approach based on a nonuniform discretization of space, defined via Gauss-Hermite quadrature points and weights. This particular coordinate basis is natural for systems in harmonic traps, and can be generalized to traps of other shapes. In all cases, it yields a position-dependent coupling and a corresponding nonuniform Hubbard-Stratonovich transformation. The resulting path integral is performed with hybrid Monte Carlo as a proof of principle for calculations at finite temperature and in higher dimensions. We present results for N=4,...,20N=4,...,20N=4,...,20 particles (although the method can be extended beyond that) to cover the range from few- to many-particle systems. This method is exact up to statistical and systematic uncertainties, which we account for---and thus also represents an ab initio calculation of this system, providing a benchmark for other methods and a prediction for ultracold-atom experiments.
Using exact continuous quantum Monte Carlo techniques, we study the zero- and finite-temperature properties of a system of harmonically trapped one-dimensional spin-12\frac{1}{2}21​ fermions with short-range interactions. Motivated by experimental searches for modulated Fulde-Ferrel-Larkin-Ovchinikov states, we systematically examine the impact of a spin imbalance on the density profiles. We quantify the accuracy of the Thomas-Fermi approximation, finding that for sufficiently large particle numbers $(N\ensuremath{\gtrsim}100)$ it quantitatively reproduces most features of the exact density profile. The Thomas-Fermi approximation fails to capture small Friedel-like spin and density oscillations and overestimates the size of the fully paired region in the outer shell of the trap. Based on our results, we suggest a range of experimentally tunable parameters to maximize the visibility of the double-shell structure of the system and the Fulde-Ferrel-Larkin-Ovchinikov state in the one-dimensional harmonic trap. Furthermore, we analyze the fingerprints of the attractive contact interactions in the features of the momentum and pair momentum distributions.
The system of interacting, trapped fermions in one dimension has been of interest in both the theoretical and experimental communities. This system is realizable experimentally using ultracold atoms in traps, where the interactions can be tuned to simulate a number of important situations in nuclear theory, condensed matter, quantum information, and QCD. Theoretically, however, this system remains a challenge to treat, and no known benchmarks exist for the ground state energy, Tan's contact, or density profiles for the few- to many-body regime. This project implements a lattice Monte Carlo (LMC) method to solve for these quantities. The method blends hybrid Monte Carlo (HMC) - a pillar of lattice quantum chromodynamics (lattice QCD) - with a non-uniform lattice defined using Gauss-Hermite quadrature points and weights. This coordinate basis is the natural one for the harmonic oscillator trapping potential, and can be generalized to traps of other shapes. Using this method, we determine the ground-state energy and Tan's contact of attractively interacting few-fermion systems in a one-dimensional harmonic trap, for a range of couplings and particle numbers. Complementing those results, we show the corresponding density profiles. We present results for N=4,...,20N = 4,...,20N=4,...,20 particles - and the method is capable of extending beyond that. The method is the first lattice calculation of its kind, and is exact up to statistical and systematic uncertainties, which we account for. Our results are therefore a benchmark for other methods and a prediction for ultracold-atom experiments.