Related papers: Efficient ab initio Migdal-Eliashberg calculation …
The main objective of the work is to provide sharp two-sided estimates of $\lambda$-Green function of hyperbolic Brownian motion of a half-space. We strongly rely on recent results obtained by K. Bogus and J. Malecki [3], regarding precise…
We present a spectral weight conserving formalism for Fermionic thermal Green's functions that are discretized in imaginary time and thus periodic in imaginary ("Matsubara") frequency. The formalism requires a generalization of the Dyson…
To unravel pairing mechanism of a superconductor from limited, indirect experimental data is always a difficult task. It is common but sometimes dubious to explain by a theoretical model with some tuning parameters. In this work, we propose…
We theoretically investigate the electric transport in the pseudogap state of High-Tc cuprates. Starting from the repulsive Hubbard model, we perform the microscopic calculation to describe the pseudogap phenomena which are induced by the…
We present a first-principles approach for the computation of the magnetic Gibbs free energy of materials using magnetically constrained supercell calculations. Our approach is based on an adiabatic approximation of slowly varying local…
We use an effective field model (transverse Ising model) to describe the dependence on the temperature of the energy gap of some two-dimensional $(2-D)$ superconducting systems. The order parameter of this model is put in a direct…
We study the superconducting transition temperature and the electronic properties of the metallic phase of $\kappa$-type (BEDT-TTF)$_2$X which shows unconventional properties in experiments, on the basis of the third order perturbation…
Far-infrared reflectance of a MgB2 film has been measured by Fourier-transform spectroscopy for frequencies 10 cm^{-1}<\nu <4000 cm^{-1} above and below the superconducting transition. The data provide clear experimental evidence for the…
We solve the anisotropic, full-bandwidth and non-adiabatic Eliashberg equations for phonon-mediated superconductivity by fully including the first vertex correction in the electronic self-energy. The non-adiabatic equations are solved…
Millisecond focal plane telemetry is now becoming practical due to a new generation of near-IR detector arrays with sub-electron noise that are capable of kHz readout rates. Combining these data with those simultaneously available from the…
To compute and analyze vibrationally resolved electronic spectra at zero temperature, we have recently implemented the on-the-fly ab initio extended thawed Gaussian approximation [A. Patoz et al., J. Phys. Chem. Lett. 9, 2367 (2018)], which…
This work presents a Green's function approach, originally implemented in graphene with well-defined edges, to the surface of a strong 3D Topological Insulator (TI) with a sequence of proximitized superconducting (S) and ferromagnetic (F)…
Superconducting systems based on attractive electron-phonon interactions are the ones which are best understood at a fundamental level. They are well described using Eliashberg theory, which, unlike BCS theory, explicitly takes into account…
This paper presents a novel and efficient approach for the computation of energy eigenvalues in quantum semiconductor heterostructures. Accurate determination of the electronic states in these heterostructures is crucial for understanding…
On the basis of spin and pairing fluctuation-exchange approximation, we study the superconductivity in quasi-two-dimensional Hubbard model. The integral equations for the Green's function are self-consistently solved by numerical…
We present a fully ab initio based scheme to compute transport properties, i.e. the electrical conductivity {\sigma} and thermopower S, in the presence of electron-phonon interaction. Therefore, we explicitly investigate the k-dependent…
Suppression of rectification at metal--Mott-insulator interfaces, which is previously shown by numerical solutions to the time-dependent Schr\"odinger equation and experiments on real devices, is reinvestigated theoretically by…
Replacement of hydrogen by deuterium in palladium hydride results in higher superconducting temperatures and an anomalous isotope effect that has not been yet fully explained. In this work, we try a new approach to the explanation of the…
We study the radial flow of retarded Green's function of energy-momentum tensor and $R$-current of dual gauge theory in presence of generic higher derivative terms in bulk Lagrangian. These are first order non-linear Riccati equations. We…
Understanding time-resolved quantum transport is crucial for developing next-generation quantum technologies, particularly in nano- and molecular junctions subjected to time-dependent perturbations. Traditional steady-state approaches to…