Related papers: Phonon-modulated-hopping Polarons: X-representatio…
Exploiting an approach similar to the R-matrix theory, the diffusion Monte Carlo method is employed to compute phase shifts and threshold cross sections for the elastic scattering of o-positronium off light atoms. Results are obtained for…
Using for unperturbed electron and phonon Hamiltonians a representation by the Jacobi matrices a one-dimensional model of the electron-phonon interaction is constructed. In frame of the model the polaron and scattering spectral bands are…
We develop a theoretical model for polarization-selective phonon pumping induced by magnon-phonon coupling in a ferromagnetic/non-magnetic acoustic bilayer structure, focusing on the effects arising from a misalignment between the magnetic…
We present a new Monte Carlo method for obtaining solutions of the Boltzmann equation for describing phonon transport in micro and nanoscale devices. The proposed method can resolve arbitrarily small signals (e.g. temperature differences)…
We develop an approximation-free Diagrammatic Monte Carlo technique to study fermionic particles interacting with each other simultaneously through both an attractive Coulomb potential and bosonic excitations of the underlying medium.…
A quantum Monte Carlo algorithm is constructed starting from the standard perturbation expansion in the interaction representation. The resulting configuration space is strongly related to that of the Stochastic Series Expansion (SSE)…
A recently developed quantum Monte Carlo approach to the Holstein model with one electron [PRB 69, 024301 (2004)] is extended to two and three dimensional lattices. A moderate sign problem occurs, which is found to diminish with increasing…
The Holstein Molecular Crystal Model is investigated by a strong coupling perturbative method which, unlike the standard Lang-Firsov approach, accounts for retardation effects due to the spreading of the polaron size. The effective mass is…
It is widely accepted that phonon-mediated high-temperature superconductivity is impossible at ambient pressure, because of the very large effective masses of polarons/bipolarons at strong electron-phonon coupling. Here we challenge this…
We study a single polaron in the Su-Schrieffer-Heeger (SSH) model using four different techniques (three numerical and one analytical). Polarons show a smooth crossover from weak to strong coupling, as a function of the electron-phonon…
Feasibility of accurate quantum calculations is often restricted by the dimensionality of the truncated Hilbert space required for the numerical computations. The present work demonstrates Bayesian machine learning (ML) models that use…
We develop an analytical microscopic theory to describe the polaron-polariton dispersion, formed by hybridizing excitons, photons, and phonons, and their coherent dynamics inside optical cavities. Starting from a microscopic light-matter…
The one-dimensional Holstein-Hubbard model with two electrons of opposite spin is studied using an extension of a recently developed quantum Monte Carlo method, and a very simple yet rewarding variational approach, both based on a…
Polaron spectral functions are computed for highly doped graphene-on-substrate and other atomically thin graphitic systems using the diagrammatic Monte Carlo technique. The specific aim is to investigate the effects of interaction on…
We study a class of polaron-type Hamiltonians with sufficiently regular form factor in the interaction term. We investigate the strong-coupling limit of the model, and prove suitable bounds on the ground state energy as a function of the…
We study two identical fermions, or two hard-core bosons, in an infinite chain and coupled to phonons by interactions that modulate their hopping as described by the Peierls/Su-Schrieffer-Heeger (SSH) model. We show that exchange of phonons…
Electron-phonon (e-ph) interactions play a crucial role in determining many properties of materials. In this context, the Su-Schrieffer-Heeger (SSH) model, where atomic motion modulates the electronic hopping, has gained significant…
We generalize the Momentum Average approximations MA$^{(0)}$ and MA$^{(1)}$ to study the effects of coupling to multiple optical phonons on the properties of a Holstein polaron. As for a single phonon mode, these approximations are…
Using the momentum average approximation we study the importance of adding higher-than-linear terms in the electron-phonon coupling on the properties of single polarons described by a generalized Holstein model. For medium and strong linear…
We use the continuous-time interaction expansion (CT-INT) quantum Monte Carlo method to calculate the phonon spectral function of the one-dimensional Holstein-Hubbard model at half-filling. Our results are consistent with a soft-mode…