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arXiv:2603.13821 · The Journal of Chemical Physics

Higher order Magnus expansions for driven two-level quantum dynamics

Chen Wei, Frank Großmann

quant-phmath-phSubmitted Mar 14, 2026• Announced Mar 17, 2026• 0 citations• Revised May 13, 2026 (v2)
v1 · Mar 14, 2026v2 · May 13, 2026
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Abstract

We investigate the Magnus expansion for a generic time-dependent two-level system under single-axis driving.By virtue of the su(2) Lie algebra, the expansion is decomposed into a commutator-free form. To illustrate the usefulness of the gained expression, we then revisit the Landau-Zener-Stückelberg-Majorana model, with a focus on non-adiabatic transitions as well as the Stokes phase. In addition, the semiclassical Rabi model is systematically treated by determining the Floquet quasienergy up to different orders. We demonstrate how to employ suitable picture transformations as well as on how to enforce the symmetry of the underlying model in order to guarantee convergence of the expansion as well as to achieve satisfactory agreement with the exact results. For both models that we studied it turns out that a third order approximation yields results that are in next to perfect agreement with exact analytical ones. Surprisingly, in the case of the semiclassical Rabi model, even the second order Magnus approximation in the adiabatic picture produces almost exact results for a large parameter range.

Journal reference
J. Chem. Phys. 164, 224121 (2026)
DOI
10.1063/5.0333717

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We investigate the Magnus expansion for a generic time-dependent two-level system under single-axis driving.By virtue of the su(2) Lie algebra, the expansion is decomposed into a commutator-free form. To illustrate the usefulness of the gained expression, we then revisit the Landau-Zener-Stückelberg-Majorana model, with a focus on non-adiabatic transitions as well as the Stokes phase. In addition, the semiclassical Rabi model is systematically treated by determining the Floquet quasienergy up to different orders. We demonstrate how to employ suitable picture transformations as well as on how to enforce the symmetry of the underlying model in order to guarantee convergence of the expansion as well as to achieve satisfactory agreement with the exact results. For both models that we studied it turns out that a third order approximation yields results that are in next to perfect agreement with exact analytical ones. Surprisingly, in the case of the semiclassical Rabi model, even the second order Magnus approximation in the adiabatic picture produces almost exact results for a large parameter range.
We present a general, nonperturbative method for deriving effective Hamiltonians of arbitrary order for periodically driven systems based on an iterated integration-by-parts technique. The resulting family of effective Hamiltonians reproduces the well-known Floquet-Magnus expansion, now enhanced with explicit error bounds that quantify the distance between the exact and approximate dynamics at each order, even in cases where the Floquet-Magnus series fails to converge. We apply the method to the semiclassical Rabi model and provide explicit error bounds for both the Bloch-Siegert Hamiltonian and its third-order refinement. Our analysis shows that, while the rotating-wave approximation more accurately captures the true dynamics than the Bloch-Siegert Hamiltonian in most regimes, the third-order approximation ultimately outperforms both.
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.
The evolution of a quantum system under time-dependent driving exhibits phenomena that are absent in its stationary counterpart. However, the high dimensionality and non-commutative nature of quantum dynamics make this a challenging problem. The Magnus expansion provides an analytic framework to approximate the effective dynamics on short time-scales, but computing high-order terms with existing methods is computationally expensive. We introduce a scalable approach that reduces the computational effort to depend only on the degrees of freedom defining the time-dependent control function. We focus specifically on Hamiltonians consisting of a constant drift term and a controllable term. Our method provides a polynomial expression for the Magnus expansion which can be evaluated several orders of magnitude faster than previous techniques, enabling broad applications in the realms of quantum simulation and quantum optimal control. We showcase an application of the method by designing control pulses for the 5-qubit phase gate on a neutral-atom platform utilizing Rydberg atoms.
One of the most powerful and potentially useful methods of time-dependent matrix differential equations is the Magnus expansion. In this work, we applied the Magnus expansion for Schrödinger and master equations of a dissipative two-level system interacting with a time-dependent π pulse. Two different models of dissipative two-level systems are considered, namely (i) the system decays from two considered levels into some other levels with given decay rates; (ii) the system decays from its excited level to its ground level. The obtained approximate solutions of a time dynamics by the first-order Magnus expansion are well consistent with the results of numerical calculations obtained by the fourth-order Runge-Kutta method.
Solution of two level system using 3rd3^{rd}3rd order Magnus expansion
We derive a Magnus expansion for a frequency chirped quantum two-level system. We obtain a time-independent effective Hamiltonian which generates a stroboscopic time evolution. At lowest order the according dynamics is identical to results from using a rotating wave approximation. We determine, furthermore, also the next higher-order corrections within our expansion scheme in correspondence to the Bloch-Siegert shifts for harmonically driven systems. Importantly, our scheme can be extended to more complicated systems, i.e., even many-body systems.