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arXiv:quant-ph/0504146 · Journal of Mathematical Physics

Large-D expansion from variational perturbation theory

Sebastian F. Brandt, Axel Pelster

Published Nov 1, 2005• 7 citations
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Abstract

We derive recursively the perturbation series for the ground-state energy of the D-dimensional anharmonic oscillator and resum it using variational perturbation theory (VPT). From the exponentially fast converging approximants, we extract the coefficients of the large-D expansion to higher orders. The calculation effort is much smaller than in the standard field-theoretic approach based on the Hubbard-Stratonovich transformation.

DOI
10.1063/1.2116247

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We derive recursively the perturbation series for the ground-state energy of the D-dimensional anharmonic oscillator and resum it using variational perturbation theory (VPT). From the exponentially fast converging approximants, we extract the coefficients of the large-D expansion to higher orders. The calculation effort is much smaller than in the standard field-theoretic approach based on the Hubbard-Stratonovich transformation.
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The accuracy of the renormalized perturbation series for anharmonic oscillators and other simple quantum-mechanical models increases with the quantum number when the adjustable parameter is determined by a simple variational criterion. In the semiclassical limit of quantum mechanics such an expansion converges towards the result of the Jeffreys–Wentzel–Kramers–Brillouin method to all orders. The hypervirial and Hellmann–Feynman theorems facilitate the derivation of the semiclassical series from Rayleigh–Schrödinger perturbation theory.
A thermodynamic perturbation method for the quantum-anharmonic oscillator is studied, based upon the Bloch equation. By this method the density matrix (Green's function) for the anharmonic oscillator can be obtained in a compact form for each order of the perturbation series. It is shown that the density matrix of the anharmonic oscillator can be readily expanded in series of the Hermite polynomials. The various expressions of the expansion series for the density matrix are also derived by a unified method.
This paper discusses some practical problems in quantum mechanics, particularly finding solutions of the Schrödinger equation for some cases, as it is a pivotal part of this area. The article focuses on using perturbation theory to calculate the approximate ground state energy for both helium atom and quartic anharmonic oscillator. For the helium atom, conventional perturbation theory is used to solve for the approximate energy, whilst for the anharmonic oscillator, a slightly different approach, that is perturbation theory incorporating a parameter, is chosen to improve the precision of the approximation. The final relative errors for the ground state energy of helium atom model are, for the first order perturbation, , and for the second order, , and that for the anharmonic oscillator is . The study of perturbation theory gives insights into understandings of how it may be modified further to pursue a better level of precision. This facilitates development of new approximation techniques for solving quantum-mechanical issues.
A new formalism of the thermodynamic perturbation theory for the quantum-anharmonic oscillator is proposed. By this method, for each order of the perturbation series, the partition function and the free energy of the system can be obtained in a compact form which is expressed by the temperature Green's function of the harmonic quanta. Based upon a unified method, the various expressions of the perturbation series for the partition function and the free energy are also given. It is shown that the perturbation series for the free energy can be naturally formulated in terms of a cluster expansion.