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The Journal of Chemical Physics

A stationary formulation of time-dependent problems in quantum mechanics

Peter Pfeifer, Raphael David Levine

Published Dec 1, 1983• 50 citations
Publisher

Abstract

A unifying framework is presented which treats time-dependent problems in nonrelativistic quantum mechanics on equal footing with stationary ones. This is accomplished by elevating time t to the role of a dynamical variable and considering evolution in an extended space with respect to a progress variable τ. Among the new objects in the extended space are the time operator as well as operators, such as energy, that are not diagonal in time. The latter bear, e.g., on the question of ‘‘quantum chaos.’’ Only τ-stationary states in the extended space are necessary to recover all of the Schrödinger time evolution. In particular, time-dependent constants of the motion (and these include time-evolved density matrices) elevate to stationary constants of the τ motion. Time-dependent problems, which may also involve time-dependent Hamiltonians, can then be solved by stationary-state methods. Special attention is given to applications based on time-dependent constants of the motion and to maximum-entropy states subject to time-dependent constraints. Two examples (rank-one perturbation, damped harmonic oscillator) illustrate some of these ideas. Scattering theory in the extended space is discussed in two appendices. It furnishes a picture of Hamiltonian τ evolution which promises to embrace also irreversible dynamics.

DOI
10.1063/1.445669

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A unifying framework is presented which treats time-dependent problems in nonrelativistic quantum mechanics on equal footing with stationary ones. This is accomplished by elevating time t to the role of a dynamical variable and considering evolution in an extended space with respect to a progress variable τ. Among the new objects in the extended space are the time operator as well as operators, such as energy, that are not diagonal in time. The latter bear, e.g., on the question of ‘‘quantum chaos.’’ Only τ-stationary states in the extended space are necessary to recover all of the Schrödinger time evolution. In particular, time-dependent constants of the motion (and these include time-evolved density matrices) elevate to stationary constants of the τ motion. Time-dependent problems, which may also involve time-dependent Hamiltonians, can then be solved by stationary-state methods. Special attention is given to applications based on time-dependent constants of the motion and to maximum-entropy states subject to time-dependent constraints. Two examples (rank-one perturbation, damped harmonic oscillator) illustrate some of these ideas. Scattering theory in the extended space is discussed in two appendices. It furnishes a picture of Hamiltonian τ evolution which promises to embrace also irreversible dynamics.
The time-dependent Schrödinger equation forms the chapter's starting point. For a time-independent Hamiltonian, a quantum state may be time evolved with the standard, unitary time evolution operator. After obtaining this operator, an algorithm is provided by which a state may be time evolved, and measurement probabilities determined. A spin 1/2 example illustrates time evolution concretely. All this makes close contact with the discussion of unitary operators in Chapter 10. The time dependence of expectation values forms the next topic, followed by the concept of a constant of the motion, which is carefully contrasted with that of a stationary state. The energy-time uncertainty relations, which rest on a quite different conceptual footing than the ‘standard’ uncertainty relations, occupy the rest of the chapter. An example from spin 1/2 illustrates the energy-time uncertainty relations.
We introduce a variational framework for approximating the time-evolution operator U^(t)\hat{U}(t)U^(t) within a physically motivated operator manifold, reformulating quantum dynamics as a tractable problem in operator space using stationary action principle. For periodically driven systems, the resulting approximate evolution operator directly yields an effective Floquet Hamiltonian, offering a non-perturbative alternative to conventional expansion-based methods. The framework is systematically improvable by enlarging the operator pool and naturally incorporates symmetries and physical constraints. When the operator manifold is chosen from the terms of a truncated Magnus expansion, the variational procedure effectively resums the Magnus series within the restricted space, significantly enhancing accuracy. We benchmark the approach on the driven Rabi model, the driven Lipkin-Meshkov-Glick model, and the one-dimensional driven Ising chain, yielding effective Floquet Hamiltonians that are systematically more accurate than low-order Magnus expansions, particularly in regimes where the latter converge poorly, and illustrating applicability to systems with exponentially large Hilbert spaces. Although we focus here on Floquet systems, the formalism applies equally to generic time-dependent Hamiltonians, providing a versatile tool for non-equilibrium quantum dynamics.
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Schroumloumloumldinger equation for joint bidirectional motion in time
The conventional time-dependent Schrödinger equation describes only unidirectional time evolution of the state of a physical system, i.e. forward or, less commonly, backward. This paper proposes a generalized quantum dynamics for the description of joint, and interactive, forward and backward time evolution within a physical system. The principal mathematical assumption for bidirectional evolution in general is that the space of states should be taken to be not merely a Hilbert space, but a more restricted entity known as a Kreĭn space, which is a complex Hilbert space with a Hermitian operator that has eigenvalues +1 and −1 only, and that therefore gives rise to an indefinite metric. The vector subspaces of states with positive or negative norm with respect to the indefinite metric will—for open channels—be construed to be states in forward or, respectively, backward evolution along the time axis. The quantum dynamics is generated by a pseudo-Hermitian Hamiltonian operator and conserves inner products with respect to the indefinite metric. Input and output states are defined in physically plausible ways such that the output comprises both reflected and transmitted states from a zone of interaction in time; a unitary transformation between input and output states is obtained from the pseudounitary transformation between the initial and final states. Three applications are studied: (1) a formal theory of collisions in terms of perturbation theory; (2) a relativistically invariant quantum field theory for a system that kinematically comprises the direct sum of two quantized real scalar fields, such that one subfield evolves forward and the other backward in time, and such that there is dynamical coupling between the subfields; (3) an argument that in the latter field theory, the dynamics predicts that in a range of values of the coupling constants, the expectation value of the vacuum energy of the universe is forced to be zero to high accuracy.
We provide a Hilbert space approach to quantum mechanics where space and time are treated on an equal footing. Our approach replaces the standard dependence on an external classical time parameter with a spacetime-symmetric algebraic structure, thereby unifying the axioms that traditionally distinguish the treatment of spacelike and timelike separations. Standard quantum evolution can be recovered from timelike correlators, defined by means of a quantum action operator, a quantum version of the action of classical mechanics. The corresponding map also provides an alternative perspective on the path integral formulation that, in the case of fermions, does not require the use of Grassmann variables. In addition, the formalism can be interpreted in terms of generalized quantum states, codifying both the conventional information of a quantum system at a given time and its evolution. We show that these states are solutions to a quantum principle of stationary action grounded in timelike correlations and pseudo-entropies.