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ADIABATIC APPROXIMATION FOR DEGENERATE OR ALMOST DEGENERATE STATES

G. F. Drukarev

Published Nov 1, 1963• 0 citations
OpenAlex

Abstract

The behavior of a system under the action of a timedependent perturbation is considered in the adiabatic approximation, degeneracy being assumed in the absence of the perturbation. The state of the system is characterized by the density matrix in space of eigenfunctions belonging to a given degenerate level. A unitary operator is set up that relates the density matrix before the perturbation is turned on to that after the perturbation is turned off. The case when there is no exact degeneracy in the absence of a perturbation but rather a set of closely spaced levels (almost degenerate states) is also considered. As an illustration of application of the theory, the behavior of spin 1 and 1/2 particles in a variable magnetic field is examined. (auth)

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Physical Review•Oct 1, 1925•14 citations
The behavior of a system under the action of a timedependent perturbation is considered in the adiabatic approximation, degeneracy being assumed in the absence of the perturbation. The state of the system is characterized by the density matrix in space of eigenfunctions belonging to a given degenerate level. A unitary operator is set up that relates the density matrix before the perturbation is turned on to that after the perturbation is turned off. The case when there is no exact degeneracy in the absence of a perturbation but rather a set of closely spaced levels (almost degenerate states) is also considered. As an illustration of application of the theory, the behavior of spin 1 and 1/2 particles in a variable magnetic field is examined. (auth)
The solution of most problems associated with electron quantum states in physical systems and structures (atoms, molecules, quantum nanostructure objects, and crystals) is hard to find because of the mathematical difficulties of getting exact solutions of the Schrödinger equation. Therefore, approximate methods of solving such problems are of special interest. We will consider some of these methods, such as the adiabatic approximation now and later the effective-mass method , using real physical systems as examples. In this chapter we will consider several widely used approximation methods for finding the wavefunctions and energies of quantum states as well as the probabilities of transitions between quantum states. First of all, we will consider stationary and non-stationary perturbation theories. What is common to these two theories is that it is assumed that the perturbation is weak and that it changes negligibly the state of the unperturbed system. Stationary perturbation theory is used for the approximate description of a system's behavior if the Hamiltonian of the quantum system being considered does not directly depend on time. In the opposite case, non-stationary theory is used. Then, we will briefly consider the quasiclassical approximation, which is used for the problems of quantum mechanics which are close to analogous problems of classical mechanics. Stationary perturbation theory for a system with non-degenerate states This theory is used for the approximate calculation of the energy levels and the wavefunctions of stationary states of systems that are subjected to the influence of small perturbations.
The subject of perturbation theory in non-relativistic quantum mechanics is introduced. First, perturbation theory for stationary states in the absence of degeneracy is studied. The case of nearby levels, perturbations of a one-dimensional harmonic oscillator, the occurrence of degeneracy, Stark and Zeeman effects are then described in detail. After a brief outline of the variational method, the Dyson series for time-dependent perturbation theory is derived, with application to harmonic perturbations. The Fermi golden rule is also presented. The chapter ends with an assessment of four branches of the subject: regular perturbation theory, asymptotic perturbation theory, and summability methods, spectral concentration and singular perturbations. Approximate methods for stationary states It is frequently the case, in physical problems, that the full Hamiltonian operator H consists of an operator H 0 whose eigenvalues and eigenfunctions are known exactly, and a second term V resulting from a variety of sources (e.g. the interaction with an electric field, or a magnetic field, or the relativistic corrections to the kinetic energy, or the effects of spin). The problems and aims of perturbation theory for stationary states can be therefore summarized as follows. (i) Once the domain of (essential) self-adjointness of the ‘unperturbed’ Hamiltonian H 0 is determined, find on which domain the ‘sum’ H = H 0 + V represents an (essentially) self-adjoint operator (the reader should remember from appendix 4. A that in general, once some operators A and B are given, the intersection of their domains, on which their sum is defined, might be the empty set). […]
We present details and expand on the framework leading to the recently introduced degenerate adiabatic perturbation theory [Phys. Rev. Lett. 104, 170406 (2010)], and on the formulation of the degenerate adiabatic theorem, along with its necessary and sufficient conditions [given in Phys. Rev. A 85, 062111 (2012)]. We start with the adiabatic approximation for degenerate Hamiltonians that paves the way to a clear and rigorous statement of the associated degenerate adiabatic theorem, where the non-Abelian geometric phase (Wilczek-Zee phase) plays a central role to its quantitative formulation. We then describe the degenerate adiabatic perturbation theory, whose zeroth-order term is the degenerate adiabatic approximation, in its full generality. The parameter in the perturbative power-series expansion of the time-dependent wave function is directly associated to the inverse of the time it takes to drive the system from its initial to its final state. With the aid of the degenerate adiabatic perturbation theory we obtain rigorous necessary and sufficient conditions for the validity of the adiabatic theorem of quantum mechanics. Finally, to illustrate the power and wide scope of the methodology, we apply the framework to a degenerate Hamiltonian, whose closed-form time-dependent wave function is derived exactly, and also to other nonexactly solvable Hamiltonians whose solutions are numerically computed.
By stating the adiabatic theorem of quantum mechanics in a clear and rigorous way, we establish a necessary condition and a sufficient condition for its validity, where the latter is obtained employing our recently developed adiabatic perturbation theory. Also, we simplify further the sufficient condition into a useful and simple practical test at the expense of its mathematical rigor. We present results for the most general case of quantum systems, i.e., those with degenerate energy spectra. These conditions are of upmost importance for assessing the validity of practical implementations of non-Abelian braiding and adiabatic quantum computation. To illustrate the degenerate adiabatic approximation, and the necessary and sufficient conditions for its validity, we analyze in depth an exactly solvable time-dependent degenerate problem.
We study the adiabatic limit in the density matrix approach for a quantum system coupled to a weakly dissipative medium. The energy spectrum of the quantum model is supposed to be non-degenerate. In the absence of dissipation, the geometric phases for periodic Hamiltonians obtained previously by M.V. Berry are recovered in the present approach. We determine the necessary condition satisfied by the coefficients of the linear expansion of the non-unitary part of the Liouvillian in order to the imaginary phases acquired by the elements of the density matrix, due to dissipative effects, be geometric. The results derived are model-independent. We apply them to spin 1/2 model coupled to reservoir at thermodynamic equilibrium.
By analogy with the mathematical definition of degenerate systems, it is suggested that systems which are interrupted before they have traversed a full period, or which are in an external field which varies greatly in the time of one period, be called physically degenerate. It is further suggested, in harmony with the ideas of Ehrenfest and Tolman, that such systems show weak quantization, the quantization becoming less and less complete as the degeneracy increases. In the case of partially degenerate systems, the values of the related action variable and of the energy are grouped more or less closely about the mean values which they would all have if the systems were completely quantized. As examples, these ideas are applied to several problems, such as quantization in a small or rapidly changing magnetic field (including Glaser's results for the change of diamagnetic susceptibility of some gases with pressure, experiments by Breit and Ellett and by Wood and Ellett on depolarization, and the experiment of Gerlach and Stern in which atoms are projected into a strong field), absorption in the higher lines of the principal series of an alkali (including a discussion of quantization in hyperbolic and parabolic obits), and the continuous x-ray spectrum. It is then pointed out that this assumption demands the existence of quantum forces which have not been previously considered in quantum theory and whose action is to stabilize the stationary states, bringing the action variables and energy rapidly nearer and nearer to the proper values as time goes on. The suggestion is made that these forces are responsible for the large change of energy and action variables during a quantum transition. From this point of view the adiabatic theorem appears in a simple light; when the external parameters vary too rapidly, the quantization becomes poor, the quantum forces become strong and put the atom into a quantized state again. In any atom but hydrogen, quantum forces must be continuously acting to oppose the interchange of energy and momentum between electrons and to keep each electron quantized. These forces thus may prove to be important in the solution of problems of the quantum dynamics of the constitution of atoms, though they must be considered in connection with the dynamics of the oscillators.