Related papers: Ehrenfest approach to open double-well dynamics
A double well loaded with bosonic atoms represents an ideal candidate to simulate some of the most interesting aspects in the phenomenology of thermalisation and equilibration. Here we report an exhaustive analysis of the dynamics and…
Ehrenfest's theorem in the infinite square well is up to now only manifested indirectly. The manifestation of this theorem is first done in the finite square well, and then consider the infinite square well as the limit of the finite well.…
A quantum mechanical treatment of an asymmetric double-well potential (DWP) interacting with a heat bath is presented for circumstances where the contribution of higher vibrational levels to the relaxation dynamics cannot be excluded from…
We show how non-Hermitian potentials used to describe probability gain and loss in effective theories of open quantum systems can be achieved by a coupling of the system to an environment. We do this by coupling a Bose-Einstein condensate…
The exact nuclear time-dependent potential energy surface arises from the exact decomposition of electronic and nuclear motion, recently presented in [A. Abedi, N. T. Maitra, and E. K. U. Gross, Phys. Rev. Lett. 105, 123002 (2010)]. Such…
Due to the exponential growth of the state space of coupled quantum systems it is not possible, in general, to numerically store the state of a very large number of quantum systems within a classical computer. We demonstrate a method for…
We present in detail the recently derived ab-initio molecular dynamics (AIMD) formalism [Phys. Rev. Lett. 101 096403 (2008)], which due to its numerical properties, is ideal for simulating the dynamics of systems containing thousands of…
In previous works, we introduced a geometric route to define our Ehrenfest Statistical Dynamics (ESD) and we proved that, for a simple toy-model, the resulting ESD does not preserve purity. We now take a step further: we investigate…
An economic modeling approach for cavity quantum electrodynamics is provided by mean-field dynamics, wherein the optical field is described classically while a self-consistent interaction with quantum emitters is incorporated through the…
This paper is devoted to the study of the dynamics of two weakly-coupled Bose-Einstein condensates confined in a double-well trap and perturbed by random external forces. Energy diffusion due to random forcing allows the system to visit…
Thermalization in open systems coupled to macroscopic environments is usually analyzed from the perspective of relaxation of the reduced state of the system to the equilibrium state. Less emphasis is given to the change of the state of the…
We point out that two of the most important theorems of Quantum Mechanics, the Ehrenfest theorem and the Hellmann-Feynman theorem, lack in their standard form important information: there are cases where non-Hermitian boundary contributions…
We derive a generalization of Ehrenfest theorem valid for open quantum systems. From this result, we identify three contributions to the evolution of expected values: i) the explicit time dependence of the observable, ii) the…
We develop a Landauer-B\"uttiker theory of entropy evolution in time-dependent strongly coupled electron systems. This formalism naturally avoids the problem of system-bath distinction caused by the strong hybridization of central system…
We study the dynamics of a particle tunneling between the ground states of a symmetric double potential well system, in the presence of simultaneous diagonal and non-diagonal couplings to an Ohmic oscillator bath. We use the…
We study the dynamics of a Bose-Einstein condensate in a double-well potential in the two-mode approximation. The dissipation of energy from the condensate is described by the coupling to a thermal reservoir of non-condensate modes. As a…
This paper develops a general method to construct Ehrenfest-like relations for Lagrangian field theories when an external, coordinate-dependent scalar potential is applied. To do so, we derive continuity equations in which the spatial and…
Injection from metallic electrodes serves as a main channel of charge generation in organic semiconducting devices and the quantum effect is normally regarded to be essential. We develop a dynamic approach based upon the surface hopping…
We present a new theoretical approach to describe the quantum behavior of a macroscopic system interacting with an external irradiation field, close to the resonant condition. Here we consider the extremely underdamped regime for a system…
Due to a continuum of electronic states present in periodic systems, the description of molecular dynamics on surfaces poses a serious computational challenge. One of the most used families of approaches in these settings are friction…