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arXiv:2011.10869 · Physical Review A

Simplified approach to the repulsive Bose gas from low to high densities and its numerical accuracy

Eric A. Carlen, Markus Holzmann, Ian Jauslin, Élliott H. Lieb

Published May 7, 2021• 15 citations
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Abstract

In 1963, a simplified approach was developed to study the ground-state energy of an interacting Bose gas with a purely repulsive potential. It consists in the derivation of an equation, which is not based on perturbation theory and which gives the exact expansion of the energy at low densities. This equation is expressed directly in the thermodynamic limit and only involves functions of three variables, rather than $3N$. Here, we revisit this approach, introduce two more equations, and show that these yields accurate predictions for various observables for all densities for repulsive potentials with positive Fourier transform. Specifically, in addition to the ground-state energy, we have shown that the simplified approach gives predictions for the condensate fraction, two-point correlation function, and momentum distribution. We have carried out a variety of tests by comparing the predictions of the equations with quantum Monte Carlo calculations for exponential interaction potentials as well as a different, finite range potential of positive type, and have found remarkable agreement. We thus show that the simplified approach provides an alternative theoretical tool to understand the behavior of the many-body Bose gas, not only in the small and large density ranges, which have been studied before, but also in the range of intermediate density, for which much less is known.

DOI
10.1103/physreva.103.053309

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In 1963, a simplified approach was developed to study the ground-state energy of an interacting Bose gas with a purely repulsive potential. It consists in the derivation of an equation, which is not based on perturbation theory and which gives the exact expansion of the energy at low densities. This equation is expressed directly in the thermodynamic limit and only involves functions of three variables, rather than 3N3N3N. Here, we revisit this approach, introduce two more equations, and show that these yields accurate predictions for various observables for all densities for repulsive potentials with positive Fourier transform. Specifically, in addition to the ground-state energy, we have shown that the simplified approach gives predictions for the condensate fraction, two-point correlation function, and momentum distribution. We have carried out a variety of tests by comparing the predictions of the equations with quantum Monte Carlo calculations for exponential interaction potentials as well as a different, finite range potential of positive type, and have found remarkable agreement. We thus show that the simplified approach provides an alternative theoretical tool to understand the behavior of the many-body Bose gas, not only in the small and large density ranges, which have been studied before, but also in the range of intermediate density, for which much less is known.
In 1963, a Simple Approach was developed to study the ground state energy of an interacting Bose gas. It consists in the derivation of an Equation, which is not based on perturbation theory, and which gives the exact expansion of the energy at low densities. This Equation is expressed directly in the thermodynamic limit, and only involves functions of 333 variables, rather than 3N3N3N. Here, we revisit this approach, and show that the Equation yields accurate predictions for various observables for all densities. Specifically, in addition to the ground state energy, we have shown that the Simple Approach gives predictions for the condensate fraction, two-point correlation function, and momentum distribution. We have carried out a variety of tests by comparing the predictions of the Equation with Quantum Monte Carlo calculations, and have found remarkable agreement. We thus show that the Simple Approach provides a new theoretical tool to understand the behavior of the many-body Bose gas, not only in the small and large density ranges, which have been studied before, but also in the range of intermediate density, for which little is known.
This is a book about Lieb's Simplified approach to the Bose gas, which is a family of effective single-particle equations to study the ground state of many-body systems of interacting Bosons. It was introduced by Lieb in 1963, and recently found to have some rather intriguing properties. One of the equations of the approach, called the Simple equation, has been proved to make a prediction for the ground state energy that is asymptotically accurate both in the low- and the high-density regimes. Its predictions for the condensate fraction, two-point correlation function, and momentum distribution also agree with those of Bogolyubov theory at low density, despite the fact that it is based on ideas that are very different from those of Bogolyubov theory. In addition, another equation of the approach called the Big equation has been found to yield numerically accurate results for these observables over the entire range of densities for certain interaction potentials. This book is an introduction to Lieb's Simplified approach, and little background knowledge is assumed. We begin with a discussion of Bose gases and quantum statistical mechanics, and the notion of Bose-Einstein condensation, which is one of the main motivations for the approach. We then move on to an abridged bibliographical overview on known theorems and conjectures about Bose gases in the thermodynamic limit. Next, we introduce Lieb's Simplified approach, and its derivation from the many-body problem. We then give an overview of results, both analytical and numerical, on the predictions of the approach. We then conclude with a list of open problems.
In a recent paper we studied an equation (called the “simple equation'') introduced by one of us in 1963 for an approximate correlation function associated with the ground state of an interacting Bose gas. Solving the equation yields a relation between the density ρ\rhoρ of the gas and the energy per particle. Our construction of solutions gave a well-defined function ρ(e)\rho(e)ρ(e) for the density as a function of the energy eee. We had conjectured that ρ(e)\rho(e)ρ(e) is a strictly monotone increasing function, so that it can be inverted to yield the strictly monotone increasing function e(ρ)e(\rho)e(ρ). We had also conjectured that ρe(ρ)\rho e(\rho)ρe(ρ) is convex as a function of ρ\rhoρ. We prove both conjectures here for small densities, the context in which they have the most physical relevance, and the monotonicity also for large densities. Both conjectures are grounded in the underlying physics, and their proof provides further mathematical evidence for the validity of the assumptions underlying the derivation of the simple equation, at least for low or high densities, if not intermediate densities, although the equation gives surprisingly good predictions for all densities ρ\rhoρ. Another problem left open in our previous paper was whether the simple equation could be used to compute accurate predictions of observables other than the energy. Here, we provide a recipe for computing predictions for any one- or two-particle observables for the ground state of the Bose gas. We focus on the condensate fraction and the momentum distribution, and show that they have the same low density asymptotic behavior as that predicted for the Bose gas. Along with the computation of the low density energy of the simple equation in our previous paper, this shows that the simple equation reproduces the known and conjectured properties of the Bose gas at low densities.
In this chapter, we will review the results obtained thus far by Eric A. Carlen, Elliott H. Lieb, and me on a Simplified Approach to the Bose gas. The Simplified Approach yields a family of effective one-particle equations, which capture some non-trivial physical properties of the Bose gas at both low and high densities, and even some of the behavior at intermediate densities. In particular, the Simplified Approach reproduces Bogolyubov’s estimates for the ground state energy and condensate fraction at low density, as well as the mean-field estimate for the energy at high densities.We will also discuss a phase that appears at intermediate densities with liquid-like properties. The simplest of the effective equations in the Simplified Approach can be studied analytically, and we will review several results about it; the others are so far only amenable to numerical analysis, and we will discuss several numerical results. We will start by reviewing some results and conjectures on the Bose gas and then introduce the Simplified Approach and its derivation from the Bose gas.We will then discuss the predictions of the Simplified Approach and compare these to results and conjectures about the Bose gas. Finally, we will discuss a few open problems about the Simplified Approach.
Abstract The simplified approach to the Bose gas was introduced by Lieb in 1963 to study the ground state of systems of interacting Bosons. In a series of recent papers, it has been shown that the simplified approach exceeds earlier expectations, and gives asymptotically accurate predictions at both low and high density. In the intermediate density regime, the qualitative predictions of the simplified approach have also been found to agree very well with quantum Monte Carlo computations. Until now, the simplified approach had only been formulated for translation invariant systems, thus excluding external potentials, and non-periodic boundary conditions. In this paper, we extend the formulation of the simplified approach to a wide class of systems without translation invariance. This also allows us to study observables in translation invariant systems whose computation requires the symmetry to be broken. Such an observable is the momentum distribution, which counts the number of particles in excited states of the Laplacian. In this paper, we show how to compute the momentum distribution in the simplified approach, and show that, for the simple equation, our prediction matches up with Bogolyubov’s prediction at low densities, for momenta extending up to the inverse healing length.
The isotropic scattering phase shift is calculated for nonrelativistic bosons interacting at low energies via an arbitrary finite-range potential in ddd space-time dimensions. Scattering on a $(d\ensuremath{-}1)$-dimensional torus is then considered, and the eigenvalue equation relating the energy levels on the torus to the scattering phase shift is derived. With this technology in hand, and focusing on the case of two spatial dimensions, a perturbative expansion is developed for the ground-state energy of NNN identical bosons which interact via an arbitrary finite-range potential in a finite area. The leading nonuniversal effects due to range corrections and three-body forces are included. It is then shown that the thermodynamic limit of the ground-state energy in a finite area can be taken in closed form to obtain the energy per particle in the low-density expansion by explicitly summing the parts of the finite-area energy that diverge with powers of NNN. The leading and subleading finite-size corrections to the thermodynamic limit equation of state are also computed. Closed-form results---some well known, others perhaps not---for two-dimensional lattice sums are included in an Appendix.