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In quantum mechanics, adiabatic elimination is a standard tool that produces a low-lying reduced Hamiltonian for a relevant subspace of states, incorporating effects of its coupling to states with much higher energy. Suppose this powerful…

Quantum Physics · Physics 2020-09-21 Yiming Pan , Ye Yu , Huaiqiang Wang , Tao Chen , Xiaopeng Shen , Qingqing Cheng

Nonadiabatic dynamics methods are an essential tool for investigating photochemical processes. In the context of employing first principles electronic structure techniques, such simulations can be carried out in a practical manner using…

Chemical Physics · Physics 2024-05-08 Jonathan R. Mannouch , Aaron Kelly

We derive and implement analytic nuclear gradients and derivative couplings for a constrained Complete Active Space Self-Consistent Field with a small active space designed to model electron or hole transfer. Using a Lagrangian formalism,…

Computational Physics · Physics 2025-09-01 Tian Qiu , Joseph E. Subotnik

Surface hopping algorithms, as an important class of quantum dynamics simulation algorithms for non-adiabatic dynamics, are typically performed in the adiabatic representation, which can break down in the presence of ill-defined adiabatic…

Numerical Analysis · Mathematics 2022-05-06 Zhenning Cai , Di Fang , Jianfeng Lu

Near-resonant periodic driving of quantum systems promises the implementation of a large variety of novel effective Hamiltonians. The challenge of Floquet engineering lies in the preparation and measurement of the desired quantum state. We…

Periodic driving has emerged as a powerful experimental tool to engineer physical properties of isolated, synthetic quantum systems. However, due to the lack of energy conservation and heating effects, non-trivial (e.g., topological)…

Statistical Mechanics · Physics 2016-12-07 Wen Wei Ho , Dmitry A. Abanin

Accurate simulation the many-electronic nonadiabatic dynamics process at metal surfaces remains as a significant task. In this work, we present an orbital surface hopping (OSH) algorithm rigorously derived from the orbital quantum classical…

Chemical Physics · Physics 2025-11-24 Yong-Tao Ma , Rui-Hao Bi , Wenjie Dou

In this manuscript, we introduce an exact expression for the response of a semi-classical two-level quantum system subject to arbitrary periodic driving. Determining the transition probabilities of a two-level system driven by an arbitrary…

Quantum Physics · Physics 2025-11-07 Michael Warnock , David A. Hague , Vesna F. Mitrovic

Periodically driven non-Hermitian systems could possess exotic nonequilibrium phases with unique topological, dynamical and transport properties. In this work, we introduce an experimentally realizable two-leg ladder model subjecting to…

Quantum Physics · Physics 2020-08-26 Longwen Zhou

The dynamic engineering of band structures for ultracold atoms in optical lattices represents an innovative approach to understand and explore the fundamental principles of topological matter. In particular, the folded Floquet spectrum…

Periodically driven quantum systems can function as highly selective parameter filters. We demonstrate this capability in a finite-size, three-qubit system described by the transverse-field Floquet Ising model. In this system, we identify a…

We demonstrate that, for systems with spin-orbit coupling and an odd number of electrons, the standard fewest switches surface hopping (FSSH) algorithm does not conserve the total linear or angular momentum. This lack of conservation arises…

Chemical Physics · Physics 2023-11-29 Yanze Wu , Jonathan Rawlinson , Robert G. Littlejohn , Joseph E. Subotnik

We experimentally observe Floquet Raman transitions in the weakly driven solid state spin system of nitrogen-vacancy center in diamond. The periodically driven spin system simulates a two-band Wannier-Stark ladder model, and allows us to…

The device for the Josephson flux qubit (DJFQ) can be considered as a solid state artificial atom with multiple energy levels. When a large amplitude harmonic excitation is applied to the system, transitions at the energy levels avoided…

Superconductivity · Physics 2010-10-20 Alejandro Ferrón , Daniel Domínguez , María José Sánchez

We propose a simple approach to realize two-dimensional Floquet topological superfluid by periodically tuning the depth of square optical lattice potentials. We show that the periodic driving can induce topological phase transitions between…

Quantum Gases · Physics 2014-10-21 Xiaosen Yang

In this paper, we present a rigorous analysis of symmetry and underlying physics of the nonlinear two-mode system driven by a harmonic mixing field, by means of multiple scale asymptotic analysis method. The effective description in the…

In this article, we investigate periodically driven open quantum systems within the framework of Floquet-Lindblad master equations. Specifically, we discuss Lindblad master equations in the presence of a coherent, time-periodic driving and…

Periodically driven quantum systems can exhibit subharmonic response, usually characterized through physical observables and often discussed in interacting settings. Here we show that a sharp subharmonic signature already appears in the…

Quantum Physics · Physics 2026-04-28 Rishabh Jha

We develop a trajectory-based approach for excited-state molecular dynamics simulations of systems subject to an external periodic drive. We combine the exact-factorization formalism, allowing to treat electron-nuclear systems in…

Chemical Physics · Physics 2021-03-31 Marco Schirò , Florian G. Eich , Federica Agostini

High-harmonic generation (HHG) of a two-level-system driven by an intense monochromatic phase-locked laser is studied in terms of complex spectral analysis with the Floquet method. In contrast to the phenomenological approaches, this…

Quantum Physics · Physics 2021-02-03 Hidemasa Yamane , Ken-ichi Noba , Tomio Petrosky , Satoshi Tanaka