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arXiv:2210.03536 · Journal of Mathematical Physics

The thermodynamic limit of an ideal Bose gas by asymptotic expansions and spectral ζ-functions

Daniel Alexander Weiss

Published Dec 1, 2022• 0 citations
arXivHTMLPDF

Abstract

We analyze the thermodynamic limit—modeled as the open-trap limit of an isotropic harmonic potential—of an ideal, non-relativistic Bose gas with a special emphasis on the phenomenon of Bose–Einstein condensation. This is accomplished by the use of an asymptotic expansion of the grand potential, which is derived by ζ-regularization techniques. Herewith, we can show that the singularity structure of this expansion is directly interwoven with the phase structure of the system: In the non-condensation phase, the expansion has a form that resembles usual heat kernel expansions. By this, thermodynamic observables are directly calculable. In contrast, the expansion exhibits a singularity of infinite order above a critical density, and a renormalization of the chemical potential is needed to ensure well-defined thermodynamic observables. Furthermore, the renormalization procedure forces the system to exhibit condensation. In addition, we show that characteristic features of the thermodynamic limit, such as the critical density or the internal energy, are entirely encoded in the coefficients of the asymptotic expansion.

DOI
10.1063/5.0114640

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We analyze the thermodynamic limit—modeled as the open-trap limit of an isotropic harmonic potential—of an ideal, non-relativistic Bose gas with a special emphasis on the phenomenon of Bose–Einstein condensation. This is accomplished by the use of an asymptotic expansion of the grand potential, which is derived by ζ-regularization techniques. Herewith, we can show that the singularity structure of this expansion is directly interwoven with the phase structure of the system: In the non-condensation phase, the expansion has a form that resembles usual heat kernel expansions. By this, thermodynamic observables are directly calculable. In contrast, the expansion exhibits a singularity of infinite order above a critical density, and a renormalization of the chemical potential is needed to ensure well-defined thermodynamic observables. Furthermore, the renormalization procedure forces the system to exhibit condensation. In addition, we show that characteristic features of the thermodynamic limit, such as the critical density or the internal energy, are entirely encoded in the coefficients of the asymptotic expansion.
Abstract In studies of the Bose–Einstein condensation of ideal gases in finite systems, the divergence problem usually arises in the equation of state. In this paper, we present a technique based on the heat kernel expansion and zeta function regularization to solve the divergence problem, and obtain the analytical expression of the Bose–Einstein condensation temperature for general finite systems. The result is represented by the heat kernel coefficients, where the asymptotic energy spectrum of the system is used. Besides the general case, for systems with exact spectra, e.g. ideal gases in an infinite slab or in a three-sphere, the sums of the spectra can be obtained exactly and the calculation of corrections to the critical temperatures is more direct. For a system confined in a bounded potential, the form of the heat kernel is different from the usual heat kernel expansion. We show that as long as the asymptotic form of the global heat kernel can be found, our method works. For Bose gases confined in three- and two-dimensional isotropic harmonic potentials, we obtain the higher-order corrections to the usual results of the critical temperatures. Our method can also be applied to the problem of generalized condensation, and we give the correction of the boundary on the second critical temperature in a highly anisotropic slab.
Abstract We have proposed an analytical solution to the problem of Bose–Einstein condensation (BEC) of harmonically trapped, two-dimensional, and ideal atoms. It is found that the number of atoms in vapor is characterized by an analytical function, which involves a series of q -digamma functions in mathematics. We employ the analytical solution to calculate the internal energy E , the entropy S , the Helmholtz free energy F , and the heat capacity at constant number C N of ideal Bose atoms in a two-dimensional isotropic harmonic trap. The first main finding in this paper is that the variation with temperature of the internal energy of a finite number of ideal Bose atoms has an inflection point, which occurs at the transition temperature T c . The second main finding is that the internal energy of a finite number of ideal Bose atoms has a classic limit E = 2 N k B T as T ≫ T c . The third main finding is that the variation with temperature of the heat capacity of a finite number of ideal Bose atoms has a maximal value, which occurs at T c . The fourth main finding is that the heat capacity of a finite number of ideal Bose atoms has a classic limit C N / k B = 2 N as T ≫ T c . The fifth main finding is that in the thermodynamic limit, at critical temperature T c the heat capacity at constant number shows a cusp singularity, which is analogous to the λ -transition of liquid helium. Consequently, the transition between normal and condensed states is a second-order phase transition.
We rigorously revisit a textbook model used to figure out the Bose-Einstein condensation (BEC) phenomenon created by dilute cold alkali atoms gases in a magnetic-optical trap. It consists of a d-dimensional (d=1,2,3) ideal non-relativistic spin-0 Bose gas confined in a box and trapped in an isotropic harmonic potential. Throughout we review and clarify a series of methods involved in the derivation of the thermodynamics in the grand-canonical situation. To make the derivation consistent with the usual rules of the statistical mechanics, we assign through our open-trap limit approach the role of canonical parameter to a rescaled number of particles (instead of an effective density involving the pulsation of the trap). Within this approach, we formulate an Einstein-like and Penrose-Onsager-like criterion of BEC and show their equivalence. Afterwards, we focus on the spatial localization of the condensate/thermal gas. When dealing with the reduced density matrix, our method is similar to the loop path approach.
We employ the q-digamma function to calculate the internal energy E, the entropy S, the Helmholtz free energy F, and the heat capacity at constant number of ideal Bose atoms in a one-dimensional harmonic trap. The first main finding in this paper is that in a one-dimensional harmonic trap and when the temperature approaches zero, the entropy of a finite number of ideal Bose atoms is nonzero but the entropy of an infinite number of ideal Bose atoms is zero. The second main finding is that the heat capacity at constant number has a classic limit as . In the thermodynamic limit, we find that at critical temperature the heat capacity at constant number is discontinuous. Hence, at there is a jump in the heat capacity and this jump is calculated. Consequently, the transition between normal and condensed states is a second-order phase transition.
We study thermodynamic properties of a one-dimensional ideal Bose gas trapped by a steep potential of an exponential type U(q)=U0[e(2q/a)b−1]. Fugacity, energy, and heat capacity of such a system are calculated for various combinations of the potential parameters as well for several values of the number of particles N. Both the thermodynamic limit and finite N are considered. Estimations for the single-particle spectrum asymptotics are obtained in the analytical form involving the Lambert W function. In the thermodynamic limit, the Bose–Einstein condensation is predicted for 0 < b < 2. We associate such behavior with an effective temperature-dependent space dimensionality arising due to the influence of the external potential of the analyzed type.
We find the universal structure and scaling of the Bose-Einstein condensation (BEC) statistics and thermodynamics (Gibbs free energy, average energy, heat capacity) for a mesoscopic canonical-ensemble ideal gas in a trap with an arbitrary number of atoms, any volume, and any temperature, including the whole critical region. We identify a universal constraint-cutoff mechanism that makes BEC fluctuations strongly non-Gaussian and is responsible for all unusual critical phenomena of the BEC phase transition in the ideal gas. The main result is an analytical solution to the problem of critical phenomena. It is derived by, first, calculating analytically the universal probability distribution of the noncondensate occupation, or a Landau function, and then using it for the analytical calculation of the universal functions for the particular physical quantities via the exact formulas which express the constraint-cutoff mechanism. We find asymptotics of that analytical solution as well as its simple analytical approximations which describe the universal structure of the critical region in terms of the parabolic cylinder or confluent hypergeometric functions. The obtained results for the order parameter, all higher-order moments of BEC fluctuations, and thermodynamic quantities perfectly match the known asymptotics outside the critical region for both low and high temperature limits. We suggest two- and three-level trap models of BEC and find their exact solutions in terms of the cutoff negative binomial distribution (which tends to the cutoff gamma distribution in the continuous limit) and the confluent hypergeometric distribution, respectively. Also, we present an exactly solvable cutoff Gaussian model of BEC in a degenerate interacting gas. All these exact solutions confirm the universality and constraint-cutoff origin of the strongly non-Gaussian BEC statistics. We introduce a regular refinement scheme for the condensate statistics approximations on the basis of the infrared universality of higher-order cumulants and the method of superposition and show how to model BEC statistics in the actual traps. In particular, we find that the three-level trap model with matching the first four or five cumulants is enough to yield remarkably accurate results for all interesting quantities in the whole critical region. We derive an exact multinomial expansion for the noncondensate occupation probability distribution and find its high-temperature asymptotics (Poisson distribution) and corrections to it. Finally, we demonstrate that the critical exponents and a few known terms of the Taylor expansion of the universal functions, which were calculated previously from fitting the finite-size simulations within the phenomenological renormalization-group theory, can be easily obtained from the presented full analytical solutions for the mesoscopic BEC as certain approximations in the close vicinity of the critical point.