In this paper we introduce a generalization to the algebraic Bender-Wu recursion relation for the eigenvalues and the eigenfunctions of the anharmonic oscillator. We extend this well known formalism to the time-dependent quantum statistical Schroedinger equation, thus obtaining the imaginary-time evolution amplitude by solving a recursive set of ordinary differential equations. This approach enables us to evaluate global and local quantum statistical quantities of the anharmonic oscillator to much higher orders than by evaluating Feynman diagrams. We probe our perturbative results by deriving a perturbative expression for the free energy which is then subject to variational perturbation theory as developed by Kleinert, yielding convergent results for the free energy for all values of the coupling strength.
Variational Quantum Algorithms are among the most promising systems to implement quantum computing under the Noisy-Intermediate Scale Quantum (NISQ) technology. In variational quantum algorithm, wavefunction represented by a parametrized ansatz and variational parameters are updated iteratively with a classical computer based on the measurement outputs from the quantum computer. In this paper, we investigate perturbation theory with these algorithms and prospect the possibility of using the variational quantum algorithm to simulate quantum dynamics in perturbation theory. We illustrate the use…
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.
We develop convergent variational perturbation theory for quantum statistical density matrices. The theory is applicable to polynomial as well as nonpolynomial interactions. Illustrating the power of the theory, we calculate the temperature-dependent density of a particle in a double-well and of the electron in a hydrogen atom.
Variational weak-coupling perturbation theory yields converging approximations, uniformly in the coupling strength. This allows us to calculate directly the coefficients of `strong-coupling' expansions. For the anharmonic oscillator we explain the physical origin of the empirically observed convergence behavior which is exponentially fast with superimposed oscillations.
Variational perturbation theory is used to determine the decay rates of metastable states across a cubic barrier of arbitrary height. For high barriers, a variational resummation procedure is applied to the complex energy eigenvalues obtained from a WKB expansion; for low barriers, the variational resummation procedure converts the non-Borel-summable Rayleigh-Schrö\-din\-ger expansion into an exponentially fast convergent one. The results in the two regimes match and yield very accurate imaginary parts of the energy eigenvalues. This is demonstrated by comparison with the complex eigenvalues f…
We evaluate perturbatively the density matrix in the low-temperature limit and thus the ground-state wave function of the anharmonic oscillator up to second order in the coupling constant. We then employ Kleinert's variational perturbation theory to determine the ground-state wave function for all coupling strengths.
Variational perturbation expansions have recently been used to calculate directly the strong-coupling expansion coefficients of the anharmonic oscillator. The convergence is exponentially fast with superimposed oscillations, as recently observed empirically by the authors. In this note, the observed behavior is explained and used to determine accurately the magnitude and phase of the leading Bender-Wu singularity which is responsible for the finite convergence radius in the complex coupling constant plane.
As an application of a recently developed variational perturbation theory we find the first 22 terms of the convergent strong-coupling series expansion for the ground state energy of the quartic anharmonic oscillator.
We prove a powerful scaling property for the extremality condition in the recently developed variational perturbation theory which converts divergent perturbation expansions into exponentially fast convergent ones. The proof is given for the energy eigenvalues of an anharmonic oscillator with an arbitrary $x^p$-potential. The scaling property greatly increases the accuracy of the results.
In the study of open quantum systems, the polaron transformation has recently attracted a renewed interest as it offers the possibility to explore the strong system-bath coupling regime. Despite this interest, a clear and unambiguous analysis of the regimes of validity of the polaron transformation is still lacking. Here we provide such a benchmark, comparing second order perturbation theory results in the original untransformed frame, the polaron frame and the variational extension with numerically exact path integral calculations of the equilibrium reduced density matrix. Equilibrium quantit…
A new variational perturbation theory is developed based on the $q-$deformed oscillator. It is shown that the new variational perturbation method provides 200 or 10 times better accuracy for the ground state energy of anharmonic oscillator than the Gaussian and the improved Gaussian approximation, respectively.
The variational perturbation theory for wave functions, which has been shown to work well for bound states of the anharmonic oscillator, is applied to resonance states of the anharmonic oscillator with negative coupling constant. We obtain uniformly accurate wave functions starting from the bound states.
We propose a variational perturbation method based on the observation that eigenvalues of each parity sector of both the anharmonic and double-well oscillators are approximately equi-distanced. The generalized deformed algebra satisfied by the invariant operators of the systems provides well defined Hilbert spaces to both of the oscillators. There appears a natural expansion parameter defined by the ratios of three distance scales of the trial wavefunctions. The energies of the ground state and the first order excited state, in the $0^{th}$ order variational approximation, are obtained with er…
We compute the shift of the transition temperature for a homogenous weakly interacting Bose gas in leading order in the scattering length a for given particle density n. Using variational perturbation theory through six loops in a classical three-dimensional scalar field theory, we obtain Delta T_c/T_c = 1.25+/-0.13 a n^(1/3), in agreement with recent Monte-Carlo results.
The Quantum Fisher Information matrix (QFIM) is a central metric in promising algorithms, such as Quantum Natural Gradient Descent and Variational Quantum Imaginary Time Evolution. Computing the full QFIM for a model with $d$ parameters, however, is computationally expensive and generally requires $\mathcal{O}(d^2)$ function evaluations. To remedy these increasing costs in high-dimensional parameter spaces, we propose using simultaneous perturbation stochastic approximation techniques to approximate the QFIM at a constant cost. We present the resulting algorithm and successfully apply it to pr…
In this paper, a variational perturbation scheme for nonrelativistic many-Fermion systems is generalized to a Bosonic system. By calculating the free energy of an anharmonic oscillator model, we investigated this variational expansion scheme for its efficiency. Using the modified Feynman rules for the diagrams, we obtained the analytical expression of the free energy up to the fourth order. Our numerical results at various orders are compared with the exact and other relevant results.
A variationally improved Sturmian approximation for solving time-independent Schrödinger equation is developed. This approximation is used to obtain the energy levels of a quartic anharmonic oscillator, a quartic potential, and a Gaussian potential. The results are compared with those of the perturbation theory, the WKB approximation, and the accurate numerical values.
We calculate the ground--state energy and other physical properties of the hydrogen atom inside a spherical box with an impenetrable wall. We apply the variational method and perturbation theory and compare both approximate results. We show that the total, kinetic and potential energies for the moving--nucleus model are greater than those for the case in which the nucleus is clamped at the box center.
The shift of the Bose-Einstein condensation temperature for a homogenous weakly interacting Bose gas in leading order in the scattering length `a' is computed for given particle density `n.' Variational perturbation theory is used to resum the corresponding perturbative series for Delta<phi^2>/Nu in a classical three-dimensional scalar field theory with coupling `u' and where the physical case of N=2 field components is generalized to arbitrary N. Our results for N=1,2,4 are in agreement with recent Monte-Carlo simulations; for N=2, we obtain Delta T_c/T_c = 1.27 +/- 0.11 a n^(1/3). We use sev…
We discuss two simple variational approaches to quantum wells. The trial harmonic functions analyzed in an earlier paper give reasonable results for all well depths and are particularly suitable for deep wells. On the other hand, the exponential functions proposed here are preferable for shallow wells. We compare the shallow-well expansions for both kind of functions and show that they do not exhibit the cubic term appearing in the exact series. It is also shown that the deep-well expansion for the harmonic functions agree with the first terms of perturbation theory.
We present a basis-set-free approach to the variational quantum eigensolver using an adaptive representation of the spatial part of molecular wavefunctions. Our approach directly determines system-specific representations of qubit Hamiltonians while fully omitting globally defined basis sets. In this work, we use directly determined pair-natural orbitals on the level of second-order perturbation theory. This results in compact qubit Hamiltonians with high numerical accuracy. We demonstrate initial applications with compact Hamiltonians on up to 20 qubits where conventional representation would…
