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arXiv:cond-mat/0607600 · Physical Review A

Analytic, group-theoretic density profiles for confined, correlated N -body systems

W. Blake Laing, Martin Dunn, D. K. Watson

Published Dec 5, 2006• 13 citations
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Abstract

Confined quantum systems involving $N$ identical interacting particles are to be found in many areas of physics, including condensed-matter, atomic, and chemical physics. A beyond-mean-field perturbation method that is applicable, in principle, to weakly, intermediate, and strongly interacting systems has been set forth by the authors in a previous series of papers. Dimensional perturbation theory was used, and in conjunction with group theory, an analytic beyond-mean-field correlated wave function at lowest order for a system under spherical confinement with a general two-body interaction was derived. In the present paper, we use this analytic wave function to derive the corresponding lowest-order, analytic density profile and apply it to the example of a Bose-Einstein condensate.

DOI
10.1103/physreva.74.063605

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Confined quantum systems involving NNN identical interacting particles are to be found in many areas of physics, including condensed-matter, atomic, and chemical physics. A beyond-mean-field perturbation method that is applicable, in principle, to weakly, intermediate, and strongly interacting systems has been set forth by the authors in a previous series of papers. Dimensional perturbation theory was used, and in conjunction with group theory, an analytic beyond-mean-field correlated wave function at lowest order for a system under spherical confinement with a general two-body interaction was derived. In the present paper, we use this analytic wave function to derive the corresponding lowest-order, analytic density profile and apply it to the example of a Bose-Einstein condensate.
Systems involving N-identical interacting particles under quantum confinement appear in many areas of physics, including chemical, condensed matter, and atomic physics. We discuss a beyondmean- field perturbation method that is applicable to weakly, intermediate and strongly-interacting systems. Group theory is used to derive an analytic beyond-mean-field correlated wave function at zeroth order for a system under spherical confinement. We derive the corresponding zeroth-order analytic density profile and apply it to the example of a Bose-Einstein condensate.
In this paper, the second in a series of two, we complete the derivation of the lowest-order wave function of a dimensional perturbation theory (DPT) treatment for the N-body quantum-confined system. Taking advantage of the symmetry of the zeroth-order configuration, we use group theoretic techniques and the FG matrix method from quantum chemistry to obtain analytic results for frequencies and normal modes. This method directly accounts for each two-body interaction, rather than an average interaction so that even lowest-order results include beyond-mean-field effects. It is thus appropriate for the study of both weakly and strongly interacting systems and the transition between them. While previous work has focused on energies, lowest-order wave functions yield important information such as the nature of excitations and expectation values of physical observables at low orders including density profiles. Higher orders in DPT also require as input the zeroth-order wave functions. In the earlier paper we presented a program for calculating the analytic normal-mode coordinates of the large-D system and illustrated the procedure by deriving the two simplest normal modes. In this paper we complete this analysis by deriving the remaining, and more complex, normal coordinates of the system.
In this paper we continue our development of a dimensional perturbation theory (DPT) treatment of N identical particles under quantum confinement. DPT is a beyond-mean-field method which is applicable to both weakly and strongly-interacting systems and can be used to connect both limits. In a previous paper we developed the formalism for low-order energies and excitation frequencies. This formalism has been applied to atoms, Bose-Einstein condensates and quantum dots. One major advantage of the method is that N appears as a parameter in the analytical expressions for the energy and so results for N up to a few thousand are easy to obtain. Other properties however, are also of interest, for example the density profile in the case of a BEC,and larger N results are desirable as well. The latter case requires us to go to higher orders in DPT. These calculations require as input zeroth-order wave functions and this paper, along with a subsequent paper, addresses this issue.
Confined quantum systems involving NNN identical interacting fermions are found in many areas of physics, including condensed matter, atomic, nuclear, and chemical physics. In a previous series of papers, a many-body perturbation method that is applicable to both weakly and strongly interacting systems of bosons has been set forth by the author and coworkers. A symmetry-invariant perturbation theory was developed that uses group theory coupled with the dimension of space as the perturbation parameter to obtain an analytic correlated wave function through first order for a system under spherical confinement with a general two-body interaction. In the present paper, we extend this formalism to large systems of fermions, circumventing the numerical demands of applying the Pauli principle by enforcing the Pauli principle on paper. The method does not scale in complexity with NNN and has minimal numerical cost. We apply the method to a unitary Fermi gas and compare to recent Monte Carlo values.
The resources required to solve the general interacting quantum N-body problem scale exponentially with N, making the solution of this problem very difficult when N is large. In a previous series of papers we develop an approach for a fully-interacting wave function with a general two-body interaction which tames the N-scaling by developing a perturbation series that is order-by-order invariant under a point group isomorphic with S_N . Group theory and graphical techniques are then used to solve for the wave function exactly and analytically at each order. Recently this formalism has been used to obtain the first-order, fully-interacting wave function for a system of harmonically-confined bosons interacting harmonically. In this paper, we report the first application of this N-body wave function to a system of N fully-interacting bosons in three dimensions. We determine the density profile for a confined system of harmonically-interacting bosons. Choosing this simple interaction is not necessary or even advantageous for our method, however this choice allows a direct comparison of our exact results through first order with exact results obtained in an independent solution. Our density profile through first-order in three dimensions is indistinguishable from the first-order exact result obtained independently and shows strong convergence to the exact result to all orders.
The resources required to solve the general interacting quantum NNN-body problem scale exponentially with NNN, making the solution of this problem very difficult when NNN is large. In a previous series of papers we develop an approach for a fully interacting wave function for a confined system of identical bosons with a general two-body interaction. This method tames the NNN scaling by developing a perturbation series that is order-by-order invariant under a point group isomorphic with SN{S}_{N}SN​. Group theory and graphical techniques are then used to solve for the wave function exactly and analytically at each order, yielding a solution for the general NNN-body problem which scales as N0{N}^{0}N0 at any given order. Recently this formalism has been used to obtain the first-order fully interacting wave function for a system of harmonically confined bosons interacting harmonically. In this paper, we report the application of this NNN-body wave function to a system of NNN fully interacting bosons in three dimensions. We derive an expression for the density profile for a confined system of harmonically interacting bosons. Choosing this simple interaction is not necessary or even advantageous for our method, however this choice allows a direct comparison of our exact results through first order with exact results obtained in an independent solution. Our density profile for the wave function through first order in three dimensions is indistinguishable from the first-order exact result obtained independently and shows strong convergence to the exact result to all orders.