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Molecular Physics

On the exactness of time-propagators for periodically driven systems based on Fer expansion

Shreyan Ganguly, Ramesh Ramachandran

Published Jul 6, 2023• 4 citations
Publisher

Abstract

In this report, an alternate approach to time-evolution in quantum mechanics is discussed using Fer expansion. Specifically, the operational aspects and exactness of the time-propagators in the Schrödinger and Interaction representation is examined in systems modulated by multiple frequencies. Through experimentally relevant examples, the interplay between the natural frequency, driving amplitude and driving frequency in time evolution studies is discussed at both stroboscopic and non-stroboscopic time intervals. Additionally, the factors governing the long time behaviour and convergence properties of the time-propagators near resonance conditions is also discussed through perturbative methods.

DOI
10.1080/00268976.2023.2231107

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In this report, an alternate approach to time-evolution in quantum mechanics is discussed using Fer expansion. Specifically, the operational aspects and exactness of the time-propagators in the Schrödinger and Interaction representation is examined in systems modulated by multiple frequencies. Through experimentally relevant examples, the interplay between the natural frequency, driving amplitude and driving frequency in time evolution studies is discussed at both stroboscopic and non-stroboscopic time intervals. Additionally, the factors governing the long time behaviour and convergence properties of the time-propagators near resonance conditions is also discussed through perturbative methods.
The present report examines the utility and exactness of time-propagators derived from Fer expansion (FE). While the mathematical intricacies of the FE scheme are well established, the operational aspects of the same in time-evolution studies remain less explored and authenticated in physical problems of relevance. Through suitable examples, the operational inconsistencies observed in time-evolution studies based on the FE scheme are identified and corroborated through rigorous comparisons with simulations emerging from exact numerical methods. The limitations outlined seriously undermine the advantages associated with the FE scheme over other existing analytic methods.
The development of analytic methods for studying quantum systems driven by periodic Hamiltonians has remained an active pursuit for gaining insights into physical phenomena in spectroscopy and other related areas in chemical physics. From a theoretical perspective, the success of a given analytic method relies on the operational aspects as well as its exactness in replicating (known) experimental results. While analytic methods built around the Magnus expansion (ME) scheme have been preferred in time-evolution studies, the splitting of the time-propagator into a product of exponential operators in the Fer expansion (FE) scheme has gained wider attention in recent years. To this end, the operational advantages of one scheme over the other have always remained contentious and form the basis for the present report. Employing periodic Hamiltonians as examples, the operational aspects and the relative merits/demerits of the two methods are analyzed, and their long-term/short-term behavior is discussed through analytic expressions in experimentally verifiable systems.
In the different chapters of this dissertation we investigate multiple non-perturbative approaches that allow the study of solids subjected to time dependent fields. In the second chapter, we develop a very general non-perturbative and flexible approach that allows to study periodically driven quantum systems via an effective time-independent theory. It makes use of renormalization-group-like flow equations to find highly accurate effective Hamiltonians[Phys. Rev. X 9, 021037 (2019)]. The range of validity of the approach is checked numerically for various 1D spin systems and confirmed to be beyond the reaches of ordinary perturbative methods. It also compares favourably to another non-perturbative approach. In the third chapter we examine the wealth of different approximations to the time evolution operator that are known from the literature. Inspired by Hamilton-Jacobi theory we find a useful reformulation of the equation for the time evolution operator [Phys. Rev. A 100, 012132 (2019)]. This allows us to find the various known approximations of the time evolution operator in a unified fashion and new ones. Interestingly the RG-like flow equations from the second chapter are found to be one specific limit of the more general approach developed here. A periodically driven Ising model is used to verify the range of validity of the different approximations. This allows us to put them into a hierarchy. Up until here the methods that were explored are most valid in the high to mid frequency regime. In the fourth chapter we show how for the case of a weakly driven system a simple approach can be used to treat the low frequency regime [Phys. Rev. B 101, 024303 (2020)]. To achieve this we derive a quasi-energy dependent Hamiltonians and very crucially require self-consistency for the quasi-energies. For the simple two band example of single layer graphene it is found to be highly accurate approach that also allows for accurate descriptions of even sensitive quantities like Chern numbers For the last fifth chapter of the thesis we switch gears and consider a specific system of much recent interest - twisted bilayer graphene. We investigate how light that is altered by the boundary conditions of a metallic waveguide can change the strength of interlayer couplings [arXiv:2001.04416 (2020)]. We investigate how this change affects the twist angles at which flat bands appear and find very simple analytic results that are in good agreement with a numerical treatment. In the sixth chapter of the thesis, we investigate the effects circularly polarized light has on twisted bilayer graphene[ arXiv:2002.05124 (2020)]. We derive two effective Hamiltonians valid in different driving regimes. One is valid for weak drives but low frequencies and the other for relatively strong drives. The Hamiltonian for the strongly driven regime is compared to exact numeric results and found to perform better than other common methods. We analyse the newly generated terms in both Hamiltonians for their symmetry.
We give a general overview of the high-frequency regime in periodically driven systems and identify three distinct classes of driving protocols in which the infinite-frequency Floquet Hamiltonian is not equal to the time-averaged Hamiltonian. These classes cover systems, such as the Kapitza pendulum, the Harper–Hofstadter model of neutral atoms in a magnetic field, the Haldane Floquet Chern insulator and others. In all setups considered, we discuss both the infinite-frequency limit and the leading finite-frequency corrections to the Floquet Hamiltonian. We provide a short overview of Floquet theory focusing on the gauge structure associated with the choice of stroboscopic frame and the differences between stroboscopic and non-stroboscopic dynamics. In the latter case, one has to work with dressed operators representing observables and a dressed density matrix. We also comment on the application of Floquet Theory to systems described by static Hamiltonians with well-separated energy scales and, in particular, discuss parallels between the inverse-frequency expansion and the Schrieffer–Wolff transformation extending the latter to driven systems.
Quantum systems can show qualitatively new forms of behavior when they are driven by fast time-periodic modulations. In the limit of large driving frequency, the long-time dynamics of such systems can often be described by a time-independent effective Hamiltonian, which is generally identified through a perturbative treatment. Here, we present a general formalism that describes time-modulated physical systems, in which the driving frequency is large, but resonant with respect to energy spacings inherent to the system at rest. Such a situation is currently exploited in optical-lattice setups, where superlattice (or Wannier-Stark-ladder) potentials are resonantly modulated so as to control the tunneling matrix elements between lattice sites, offering a powerful method to generate artificial fluxes for cold-atom systems. The formalism developed in this work identifies the basic ingredients needed to generate interesting flux patterns and band structures using resonant modulations. Additionally, our approach allows for a simple description of the micromotion underlying the dynamics; we illustrate its characteristics based on diverse dynamic-lattice configurations. It is shown that the impact of the micromotion on physical observables strongly depends on the implemented scheme, suggesting that a theoretical description in terms of the effective Hamiltonian alone is generally not sufficient to capture the full time evolution of the system.
The Floquet-Magnus expansion is a widely used tool to derive effective descriptions of time-periodic quantum systems by approximating their dynamics with a time-independent Hamiltonian. However, its standard formulation is, strictly speaking, restricted to bounded Hamiltonians. In this work, we extend its definition and analysis to a broad class of time-periodic unbounded Hamiltonians. Our approach is based on an a priori distinct nonperturbative framework for the construction of effective Hamiltonians, which we show to reproduce the Floquet-Magnus expansion. A particular strength of our framework is that it allows us to prove that the resulting effective dynamics approximates the original time evolution propagators to arbitrary order in the high-frequency limit without requiring convergence of the Floquet-Magnus expansion, a condition that is already highly restrictive even in the bounded setting. We illustrate the scope of the method on representative models: the quantum Rabi Hamiltonian in the interaction picture, and the periodically driven quantum harmonic oscillator.