Related papers: Analytic calculation of nonadiabatic transition pr…
An extension of the CCS-method [Chem. Phys. 2004, 304, p. 103-120] for simulating non-adiabatic dynamics with quantum effects of the nuclei is put forward. The time-dependent Schr\"{o}dinger equation for the motion of the nuclei is solved…
We consider the time evolution of the occupation probabilities for the 2s-2p transition in a hydrogen atom interacting with an external field, V(t). A two-state model and a dipole approximation are used. In the case of degenerate energy…
The nonadiabatic quantum kinetic equations and Dirac-Heisenberg-Wigner formalism for Schwinger pair production in a spatially uniform and time-varying electric field with multiple components are derived and proven to be equivalent. The…
Tracking the complex non-adiabatic transitions in far-ultraviolet photodissociation demands highly accurate diabatic potential energy matrices (PEMs) across numerous excited states. To address this, we introduce a fully automated…
Contraction analysis establishes exponential incremental convergence of a nonlinear system by solving a linear matrix inequality for a contraction metric, and has become a standard resource for solving problems in nonlinear control and…
We extend the concept of superadiabatic dynamics, or transitionless quantum driving, to quantum open systems whose evolution is governed by a master equation in the Lindblad form. We provide the general framework needed to determine the…
We construct a measure for the adiabatic contribution to quantum transitions in an arbitrary basis, tackling the generic complex case where dynamics is only partially adiabatic, simultaneously populates several eigenstates and transitions…
Non-adiabatic transitions in multilevel systems appear in various fields of physics, but it is not easy to analyze their dynamics in general. In this paper, we propose to extend the adiabatic impulse approximation to multilevel systems.…
We study a two-dimensional fermionic QFT used to model 1D strongly correlated electrons in the presence of a time-dependent impurity that drives the system out of equilibrium. In contrast to previous investigations, we consider a dynamic…
For a class of polynomial non-autonomous differential equations of degree n, we use phase plane analysis to show that each equation in this class has n periodic solutions. The result implies that certain rigid two-dimensional systems have…
Sped-up protocols (shortcuts to adiabaticity) that drive a system quickly to the same populations than a slow adiabatic process may involve Hamiltonian terms difficult to realize in practice. We use the dynamical symmetry of the Hamiltonian…
A stable and fast path linking two arbitrary states of a quantum system is generally required for state-engineering protocols, such as stimulated Raman adiabatic passage, shortcuts to adiabaticity, and holonomic transformation. Such a path…
We present a numerical method for computing optimal transition pathways and transition rates in systems of stochastic differential equations (SDEs). In particular, we compute the most probable transition path of stochastic equations by…
Three analytic solutions to the Schr\"{o}dinger equation for the time-dependent Landau-Zener Hamiltonian are presented. They correspond to specific finite-time driving paths in a bounded parameter space of a two-level system. Two of these…
With recent developments in simulating nonadiabatic systems to high accuracy, it has become possible to determine how much energy is attributed to nuclear quantum effects beyond zero-point energy. In this work we calculate the…
Nonanalyticities of thermodynamic functions are studied by adopting an approach based on stationary points of the potential energy. For finite systems, each stationary point is found to cause a nonanalyticity in the microcanonical entropy,…
A numerical method based on Matrix Product Formalism is proposed to study the phase transitions and shock formation in the Asymmetric Simple Exclusion Process with open boundaries and parallel dynamics. By working in a canonical ensemble,…
In this paper, the asymptotic behaviors of the transition probability for two-level avoided crossings are studied under the limit where two parameters (adiabatic parameter and energy gap parameter) tend to zero. This is a continuation of…
A new methodology of simulating nonadiabatic dynamics using frozen-width Gaussian wavepackets within the moving crude adiabatic representation with the on-the-fly evaluation of electronic structure is presented. The main feature of the new…
The transitionless tracking (TT) algorithm enables the exact tracking of quantum adiabatic dynamics in an arbitrary short time by adding a counterdiabatic Hamiltonian to the original adiabatic Hamiltonian. By applying Husimi's method…