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arXiv:cond-mat/0511647 · International Journal of Modern Physics B

THERMODYNAMIC PROPERTIES OF A TRAPPED BOSE GAS: A DIFFUSION MONTE CARLO STUDY

S. DATTA

Published Sep 30, 2008• 3 citations
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Abstract

We investigate the thermodynamic properties of a trapped Bose gas of Rb atoms interacting through a repulsive potential at low but finite temperature (kBT < μ < Tc) by Quantum Monte Carlo method based upon the generalization of Feynman-Kac method1-3 applicable to many-body systems at T=0 to finite temperatures. In this paper, we report temperature variation of condensation fraction, chemical potential, density profile, total energy of the system, release energy, frequency shifts and moment of inertia within the realistic potential model (Morse type) for the first time by diffusion Monte Carlo technique. The most remarkable success was in achieving the same trend in the temperature variation of frequency shifts as was observed in JILA4 for both m=2 and m=0 modes. For other things, we agree with the work of Giorgini et al.,5 Pitaevskii et al.6 and Krauth.7

DOI
10.1142/s021797920804870x

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We investigate the thermodynamic properties of a trapped Bose gas of Rb atoms interacting through a repulsive potential at low but finite temperature (kBT < μ < Tc) by Quantum Monte Carlo method based upon the generalization of Feynman-Kac method1-3 applicable to many-body systems at T=0 to finite temperatures. In this paper, we report temperature variation of condensation fraction, chemical potential, density profile, total energy of the system, release energy, frequency shifts and moment of inertia within the realistic potential model (Morse type) for the first time by diffusion Monte Carlo technique. The most remarkable success was in achieving the same trend in the temperature variation of frequency shifts as was observed in JILA4 for both m=2 and m=0 modes. For other things, we agree with the work of Giorgini et al.,5 Pitaevskii et al.6 and Krauth.7
The thermodynamical properties of interacting Bose atoms in a harmonic potential are studied within the mean-field approximation. For weak interactions, the quantum statistics is equivalent to an ideal gas in an effective mean-field potential. The eigenvalue of the Gross–Pitaevskii equation is identified as the chemical potential of the ideal gas. The condensation temperature and density profile of atoms are calculated. It is found that the critical temperature Tc decreases as the interactions increase. Below the critical point, the condensation fraction exhibits a universal relation of N0/N = 1-(T/Tc)γ, with the index γ ≈ 2.3 independent of the interaction strength, the chemical potential, as well as the frequency of the confining potential.
We evaluate the zero temperature properties and Bose-Einstein condensation (BEC) of hard sphere bosons in a harmonic trap using Quantum Monte Carlo methods. The chief purpose of this work is to go beyond the dilute limit, to test the limits of the Gross-Pitaevskii equation and related mean field approximations and to explore the role of interactions in determining the zero temperature properties of the trapped Bose gas. The density is increased by adjusting both the number of trapped bosons, N , and the s-wave scattering length, a, to study systems from the highly dilute region corresponding to early experiments in trapped BEC [2, 3] up to liquid He densities and beyond. Rather than relying on the perturbative Bogoliubov approximation (which assumes a large condensate fraction) to describe the condensate, we use the one-body density matrix (OBDM) formulation of BEC so that the properties of the condensate for systems with arbitrarily large interactions may be studied. In this formulation of BEC, condensate properties are obtained by diagonalizing the OBDM and obtaining the corresponding single particle “natural orbitals” and their occupation numbers for the system. The condensate wave function and condensate fraction are then obtained from the single particle orbital(s) with macroscopic occupation (N0 >> 1). Within this framework, we calculate the effects of interactions and increased density on the ground state energy, the density profile, the momentum distribution, the condensate fraction and condensate “wave-function” and several other properties.
We investigate the thermodynamics of a Bose gas interacting with repulsive forces and confined in a harmonic trap. We show that the relevant parameters of the system (temperature, number NNN of atoms, harmonic oscillator length, deformation of the trap, sss-wave scattering length) fix its thermodynamic behavior in the large NNN limit through two dimensionless scaling parameters. These are the reduced temperature t=T/Tc0t\phantom{\rule{0ex}{0ex}}=\phantom{\rule{0ex}{0ex}}T/{T}_{c}^{0}t=T/Tc0​ and the ratio $\ensuremath{\eta}$ between the T=0T\phantom{\rule{0ex}{0ex}}=\phantom{\rule{0ex}{0ex}}0T=0 value of the chemical potential, evaluated in the Thomas-Fermi limit, and the critical temperature Tc0{T}_{c}^{0}Tc0​ of the noninteracting model. The scaling functions relative to the condensate fraction, energy, chemical potential, and moment of inertia are calculated within the Popov approximation.
We study thermal properties of a trapped Bose-Bose mixture in a dilute regime using quantum Monte Carlo methods. Our main aim is to investigate the dependence of the superfluid density and the condensate fraction on temperature for the mixed and separated phases. To this end we use the diffusion Monte Carlo method in the zero-temperature limit and the path-integral Monte Carlo method for finite temperatures. The results obtained are compared with solutions of the coupled Gross-Pitaevskii equations for the mixture at zero temperature. We notice the existence of an anisotropic superfluid density in some phase-separated mixtures. Our results also show that the temperature evolution of the superfluid density and condensate fraction is slightly different, showing noteworthy situations where the superfluid fraction is smaller than the condensate fraction.
We investigate two-species Bose gases in traps with various interactions using variational quantum Monte Carlo (VMC) techniques at zero temperature. The bosons are represented by hard spheres whose diameter is equivalent to the sss-wave scattering length in the low-energy and long-wavelength approximation. We explore the role of repulsive and attractive interspecies or intraspecies interactions on the condensate properties of the mixtures, particularly the condensate fraction of each species as compared to the case when each species is in a separate trap of its own. We model the repulsive interactions by a hard-core (HC) potential and the attractive interactions by a shallow model potential. The VMC density profiles and energies are evaluated at various interactions and two mass ratios of the species.
We report the effects of interaction on thermodynamic properties of a repulsive Bose-Einstein condensate confined in a harmonic trap by using the correlated potential harmonics expansion method. This many-body technique permits the use of a realistic interactomic interaction, which gives rise to the effective long-range interaction of the condensate in terms of the sss-wave scattering length. We have computed temperature (TTT) dependence of the chemical potential, specific heat, condensate fraction, entropy, pressure, and the average energy per particle of a system containing a large number (AAA) of 87{}^{87}87Rb atoms in the Joint Institute for Laboratory Astrophysics (JILA) trap. The repulsion among the interacting bosons results in a small but measurable drop of condensate fraction and critical temperature (Tc{T}_{c}Tc​), compared to those of a noninteracting condensate. These are in agreement with the experiment. Although all thermodynamic quantities have a strong dependence on AAA and to a smaller extent on the interatomic interaction, our numerical calculation appears to show that a thermodynamic quantity per particle follows a universal behavior as a function of T/TcT/{T}_{c}T/Tc​. This shows the importance of Tc{T}_{c}Tc​ for all thermodynamic properties of the condensate. As expected, for T>TcT>{T}_{c}T>Tc​, these properties follow those of a trapped noncondensed Bose gas.