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arXiv:cond-mat/0607721 · Physical Review A

Equation of state of an interacting Bose gas at finite temperature: A path-integral Monte Carlo study

Sebastiano Pilati, K. Sakkos, Jordi Boronat, J. Casulleras, S. Giorgini

Published Oct 27, 2006• 29 citations
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Abstract

By using exact path-integral Monte Carlo methods we calculate the equation of state of an interacting Bose gas as a function of temperature both below and above the superfluid transition. The universal character of the equation of state for dilute systems and low temperatures is investigated by modeling the interatomic interactions using different repulsive potentials corresponding to the same $s$-wave scattering length. The results obtained for the energy and the pressure are compared to the virial expansion for temperatures larger than the critical temperature. At very low temperatures we find agreement with the ground-state energy calculated using the diffusion Monte Carlo method.

DOI
10.1103/physreva.74.043621

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By using exact path-integral Monte Carlo methods we calculate the equation of state of an interacting Bose gas as a function of temperature both below and above the superfluid transition. The universal character of the equation of state for dilute systems and low temperatures is investigated by modeling the interatomic interactions using different repulsive potentials corresponding to the same sss-wave scattering length. The results obtained for the energy and the pressure are compared to the virial expansion for temperatures larger than the critical temperature. At very low temperatures we find agreement with the ground-state energy calculated using the diffusion Monte Carlo method.
We investigate the thermodynamic properties of a dilute Bose gas in a correlated random potential using exact path integral Monte Carlo methods. The study is carried out in continuous space and disorder is produced in the simulations by a three-dimensional (3D) speckle pattern with tunable intensity and correlation length. We calculate the shift of the superfluid transition temperature due to disorder and we highlight the role of quantum localization by comparing the critical chemical potential with the classical percolation threshold. The equation of state of the gas is determined in the regime of strong disorder, where superfluidity is suppressed and the normal phase exists down to very low temperatures. We find a T 2 dependence of the energy in agreement with the expected behavior in the Bose glass phase. We also discuss the major role played by the disorder correlation length and we make contact with a Hartree–Fock mean-field approach that holds if the correlation length is very large. The density profiles are analyzed as a function of temperature and interaction strength. Effects of localization and the depletion of the order parameter are emphasized in the comparison between local condensate and total density. At very low temperature, we find that the energy and the particle distribution of the gas are very well described by the T =0 Gross–Pitaevskii theory, even in the regime of very strong disorder.
We present precise path-integral Monte Carlo results for the thermodynamics of a homogeneous dilute Bose gas. Pressure and energy are calculated as a function of temperature both below and above the Bose-Einstein transition. Specifically, we address interaction effects, focusing on deviations from the ideal-gas law in the thermodynamic limit. We also calculate the isothermal compressibility and the contact parameter, which provide a clear signature of the role played by interactions. In particular, we obtain indications of a discontinuity of the compressibility at the transition point. To gain physical insight, numerical results are systematically compared with the predictions of first-order Hartree-Fock and second-order Popov theories, both giving an approximate description of the gas thermodynamics. The comparison shows the extension of the critical region around the transition point, where the inaccuracies of the perturbative expansions are more pronounced.
We calculate the superfluid transition temperature of homogeneous interacting Bose gases in three and two spatial dimensions using large-scale path integral Monte Carlo simulations (with up to N=10;{5} particles). In 3D we investigate the limits of the universal critical behavior in terms of the scattering length alone by using different models for the interatomic potential. We find that this type of universality sets in at small values of the gas parameter na3 < or approximately 10(-4). This value is different from the estimate na3 < or approximately 10(-6) for the validity of the asymptotic expansion in the limit of vanishing na3. In 2D we study the Berezinskii-Kosterlitz-Thouless transition of a gas with hard-core interactions. For this system we find good agreement with the classical lattice |psi|4 model up to very large densities. We also explain the origin of the existing discrepancy between previous studies of the same problem.
The equation of state of a homogeneous two-dimensional Bose gas is calculated using quantum Monte Carlo methods. The low-density universal behavior is investigated using different interatomic model potentials, both finite ranged and strictly repulsive and zero ranged, supporting a bound state. The condensate fraction and the pair distribution function are calculated as a function of the gas parameter, ranging from the dilute to the strongly correlated regime. In the case of the zero-range pseudopotential we discuss the stability of the gaslike state for large values of the two-dimensional scattering length, and we calculate the critical density where the system becomes unstable against cluster formation.
The equation of state of dilute Bose gases, in which the energy only depends on the s -wave scattering length, is rather unknown beyond the universal limit. We have carried out a set of diffusion Monte Carlo calculations up to gas parameters of 10 − 2 to explore how the departure from the universality emerges. Using different model potentials, we calculate the energies of the gas in an exact way, within some statistical noise, and report the results as a function of the three relevant scattering parameters: the s -wave scattering length a 0 , the s -wave effective range r 0 , and the p -wave scattering length a 1 . If the effective range is not large, we observe universality in terms of a 0 and r 0 up to gas parameters of 10 − 2 . If r 0 grows, the regime of universality in these two parameters is reduced and effects of a 1 start to be observed. In the ( a 0 , r 0 ) universal regime we propose an analytical law that reproduces fairly well the exact energies. Published by the American Physical Society 2024