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Time-Dependent Gaussian Solution for the Kostin Equation around Classical Trajectories

Fernando Haas, José Maria Filardo Bassalo, Antonio Boulhosa Nassar, M. Cattani

Published Aug 14, 2016• 6 citations
OpenAlex

Abstract

The structure of time-dependent Gaussian solutions for the Kostin equation in dissipative quantum mechanics is analyzed. Expanding the generic external potential near the center of mass of the wave packet, one conclude that: the center of mass follows the dynamics of a classical particle under the external potential and a damping proportional to the velocity; the width of the wave packet satisfy a non-conservative Pinney equation. An appropriate perturbation theory is developed for the free particle case, solving the long standing problem of finding analytic expressions for square integrable solutions of the free Kostin equation. The associated Wigner function is also studied.

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The present work considers the damped Pinney equation, defined as the model arising when a linear in velocity damping term is included in the Pinney equation. In the general case, the resulting equation does not admit Lie point symmetries or reduction to a simpler form by any obvious coordinate transformation. In this context, the method of Kuzmak–Luke is applied to derive a perturbation solution, for weak damping and slow time dependence of the frequency function. The perturbative and numerical solutions are shown to be in good agreement. The results are applied to examine the time evolution of Gaussian-shaped wave functions in the Kostin formulation of dissipative quantum mechanics.

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Journal of Physics Conference Series•Sep 1, 2019•2 citations
The structure of time-dependent Gaussian solutions for the Kostin equation in dissipative quantum mechanics is analyzed. Expanding the generic external potential near the center of mass of the wave packet, one conclude that: the center of mass follows the dynamics of a classical particle under the external potential and a damping proportional to the velocity; the width of the wave packet satisfy a non-conservative Pinney equation. An appropriate perturbation theory is developed for the free particle case, solving the long standing problem of finding analytic expressions for square integrable solutions of the free Kostin equation. The associated Wigner function is also studied.
The present work considers the damped Pinney equation, defined as the model arising when a linear in velocity damping term is included in the Pinney equation. In the general case, the resulting equation does not admit Lie point symmetries or reduction to a simpler form by any obvious coordinate transformation. In this context, the method of Kuzmak–Luke is applied to derive a perturbation solution, for weak damping and slow time dependence of the frequency function. The perturbative and numerical solutions are shown to be in good agreement. The results are applied to examine the time evolution of Gaussian-shaped wave functions in the Kostin formulation of dissipative quantum mechanics.
Abstract Fifty years ago Kostin (J Chem Phys 57(9):3589–3591, 1972. https://doi.org/10.1063/1.1678812 ) proposed a description of damping in quantum mechanics based on a nonlinear Schrödinger equation with the potential being governed by the phase of the wave function. We show for the example of a moving Gaussian wave packet, that the deceleration predicted by this equation is the result of the same non-dissipative, homogeneous but time-dependent force, that also stops a classical particle. Moreover, we demonstrate that the Kostin equation is a special case of the linear Schrödinger equation with three potentials: (i) a linear potential corresponding to this stopping force, (ii) an appropriately time-dependent parabolic potential governed by a specific time dependence of the width of the Gaussian wave packet and (iii) a specific time-dependent off-set. The freedom of the width opens up the possibility of engineering the final state by the time dependence of the quadratic potential. In this way the Kostin equation is a precursor of the modern field of coherent control. Motivated by these insights, we analyze in position and in phase space the deceleration of a Gaussian wave packet due to potentials in the linear Schrödinger equation similar to those in the Kostin equation.
We reexamine the general solution of a Schr\"odinger equation in the presence of a time-dependent linear potential in configuration space based on the Lewis-Riesenfeld framework. For comparison, we also solve the problem in momentum space and then Fourier transform the solution to get the general wave function. Appropriately choosing the weight function in the latter method, we can obtain the same wave function as the former method. It is found that a non-Hermitian time-dependent linear invariant can be used to obtain Gaussian-type wave-packet solutions of the time-dependent system. This operator is a specific linear combination of the initial momentum and initial position operators. This fact indicates that the constants of integration such as the initial position and initial momentum that determine the classical motion play important roles in the time-dependent quantum system. The eigenfunction of the linear invariant is interpreted as a wave packet with a ``center of mass'' moving along the classical trajectory, while the ratio between the coefficients of the initial position and initial momentum determines the width of the wave packet.
We show that one can obtain analytic solutions of the time-dependent Schrödinger equation that are more complex than the well-known oscillating coherent wave packet. Such Hermite-Gaussian or initially square wave packets exist for a free particle or for one subject to the harmonic oscillator potential. In either case, the Hermite-Gaussian packets retain their nodal structure even after long times. There is a single class of exact solutions for the system with oscillator constant K > 0, K = 0, or K < 0, leading to wave functions for the harmonic oscillator, the free particle, and the inverted oscillator, respectively.
In this paper we develop a new approach to semiclassical dynamics which exploits the fact that extended wavefunctions for heavy particles (or particles in harmonic potentials) may be decomposed into time−dependent wave packets, which spread minimally and which execute classical or nearly classical trajectories. A Gaussian form for the wave packets is assumed and equations of motion are derived for the parameters characterizing the Gaussians. If the potential (which may be nonseparable in many coordinates) is expanded in a Taylor series about the instantaneous center of the (many−particle) wave packet, and up to quadratic terms are kept, we find the classical parameters of the wave packet (positions, momenta) obey Hamilton’s equation of motion. Quantum parameters (wave packet spread, phase factor, correlation terms, etc.) obey similar first order quantum equations. The center of the wave packet is shown to acquire a phase equal to the action integral along the classical path. State−specific quantum information is obtained from the wave packet trajectories by use of the superposition principle and projection techniques. Successful numerical application is made to the collinear He + H2 system widely used as a test case. Classically forbidden transitions are accounted for and obtained in the same manner as the classically allowed transitions; turning points present no difficulties and flux is very nearly conserved.
Abstract The time-dependent Schrödinger equation for quadratic Hamiltonians has Gaussian wave packets as exact solutions. For the parametric oscillator with frequency ω(t), the width of these wave packets must be time-dependent. This time-dependence can be determined by solving a complex nonlinear Riccati equation or an equivalent real nonlinear Ermakov equation. All quantum dynamical properties of the system can easily be constructed from these solutions, e.g., uncertainties of position and momentum, their correlations, ground state energies, etc. In addition, the link to the corresponding classical dynamics is supplied by linearizing the Riccati equation to a complex Newtonian equation, actually representing two equations of the same kind: one for the real and one for the imaginary part. If the solution of one part is known, the missing (linear independent) solution of the other can be obtained via a conservation law for the motion in the complex plane. Knowing these two solutions, the solution of the Ermakov equation can be determined immediately plus the explicit expressions for all the quantum dynamical properties mentioned above. The effect of a dissipative, linear velocity dependent friction force on these systems is discussed.