Related papers: Polaron dynamics with off-diagonal coupling: beyon…
Energy loss in collisions of charged projectiles with many-electron systems can be dealt with in time-dependent density functional theory by invoking Ehrenfest's theorem for the time evolution of expectation values of observables. We derive…
Density functional theory with linear combination of atomic orbitals (LCAO) basis sets is useful for studying large atomic systems, especially when it comes to computationally highly demanding time-dependent dynamics. We have implemented…
The exciton dispersion is examined in the case of four selected prototypical molecular solids: pentacene,tetracene,picene,chrysene. The model parameters are determined by fitting to experimental data obtained by inelastic electron…
Frenkel exciton population dynamics of an excitonic dimer is studied by comparing results from a quantum master equation (QME) involving rates from second-order perturbative treatment with respect to the excitonic coupling with…
The evolution of the properties of a finite density electronic system as the electron-phonon coupling is increased are investigated in the Holstein model using the Dynamical Mean-Field Theory (DMFT). We compare the spinless fermion case, in…
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…
An variational expression for the zero temperature polaron impedance is obtained by minimizing the free energy in a generalized quadratic Feynman model. The impedance function of the quadratic model serves as the variational parameter. It…
We apply weak-coupling perturbation theory to the Holstein molecular crystal model in order to compute an electron-phonon correlation function characterizing the shape and size of the polaron lattice distortion in one, two, and three…
The ultrafast conversion of coherent excitons into incoherent excitons, as well as the subsequent exciton diffusion and thermalization, are central topics in current scientific research due to their relevance in optoelectronics,…
We investigate the non-equilibrium dynamics of an impurity coupled to a Bose-Einstein condensate, systematically compared with recent experimental results [M. G. Skou et al., Nat. Phys. (2021)]. The dynamics of the impurity is tracked down…
The Heisenberg ferromagnet (uniaxially anisotropic along z-direction), in the presence of time dependent (but uniform over space) magnetic field, is studied by Monte Carlo simulation. The time dependent magnetic field was taken as…
Interactions between out-of-plane dipoles in bosonic gases enable the long-range propagation of excitons. The lack of direct control over collective dipolar properties has hitherto limited the degrees of tunability and the microscopic…
One-dimensional semiconductors are characterized by strongly bound excitons. Therefore, the Frenkel regime of excitons localized within a few unit cells is readily reached and traditional Wannier exciton models become inadequate. In the…
Static and dynamical properties of elastic phase transitions under the influence of short--range defects, which locally increase the transition temperature, are investigated. Our approach is based on a Ginzburg--Landau theory for…
We theoretically investigate the corrections of exciton binding energy in monolayer transition metal dichalcogenides (TMDs) due to the exciton-optical phonon coupling in the Fr$\ddot{o}$hlich interaction model by using the linear operator…
The efficiency of two-dimensional Dion-Jacobson-type materials relies on the complex interplay between electronic and lattice dynamics; however, questions remain about the functional role of exciton-phonon interactions. This study…
The transport and distribution of charged particles are crucial in the study of many physical and biological problems. In this paper, we employ an Energy Variational Approach to derive the coupled Poisson-Nernst-Planck-Navier-Stokes system.…
We develop a variational perturbation expansion around dynamical mean-field theory (DMFT) that systematically incorporates nonlocal correlations beyond the local correlations treated by DMFT. We apply this approach to investigate how the…
We study a crossover from classical to quantum picture in the electron energy statistics in a system with broken time-reversal symmetry. The perturbative and nonperturbative parts of the two level correlation function, $R(\omega)$ are…
We explore the dynamics of active elements performing persistent random motion with fluctuating active speed and in the presence of translational noise in a $d$-dimensional harmonic trap, modeling active speed generation through an…