Related papers: Density Functional Theory for Plasmon-Assisted Sup…
Advances in light sources and time resolved spectroscopy have made it possible to excite specific atomic vibrations in solids and to observe the resulting changes in electronic properties but the mechanism by which phonon excitation causes…
Electron-phonon superconductors at high pressures have displayed the highest values of critical superconducting temperature $T_c$ on record, now rapidly approaching room temperature. Despite the importance of high-$P$ superconductivity in…
This article is a review o over theory of superconductivity, which is constructed for systems with two overlapping energy bands at the Fermi surface and with arbitrary charge carrier density.There is taken into account all possible kinds of…
We study a mechanism to induce superconductivity in atomically thin semiconductors where excitons mediate an effective attraction between electrons. Our model includes interaction effects beyond the paradigm of phonon-mediated…
We analyze the mathematical structure of equations for temperature Tc of the superconductivity transition in a gas of interacting Fermi particles or at the phonon-mediated pairing in a metal in case of non-adiabatic conditions, i. e., when…
A spin-current density-functional theory (SCDFT) is introduced, which takes into account currents of the spin-density and thus currents of the magnetization in addition to the electron density, the non-collinear spin-density, and the…
We formulate a time-dependent density functional theory (TDDFT) in terms of the density matrix to study ultrafast phenomena in semiconductor structures. A system of equations for the density matrix components, which is equivalent to the…
We introduce a tempering approach with stochastic density functional theory (sDFT), labeled t-sDFT, which reduces the statistical errors in the estimates of observable expectation values. This is achieved by rewriting the electronic density…
A theoretical model involving phonon and lochon (local charged boson) mediated pairing of electrons in Pd(H/D)x is suggested to explain the possible observation of superconductivity in the range 51K < Tc < 295K (when x exceeds unity). In…
Using the theory of the high temperature superconductivity based on the idea of the fermion condensation quantum phase transition (FCQPT), we show that neither the d-wave pairing symmetry, nor the pseudogap phenomenon, nor the presence of…
The description of superconductivity at high temperature is a problem that has recently been addressed. Transition temperature of superconductivity, $T_c$, depends on the lattice structure type, size, and room pressure. In super-lattices…
Recently, two-dimensional Nb$_2$C has garnered increasing attention due to its functional-group-dependent superconductivity, both experimentally and theoretically. In contrast to the halogen and chalcogen additives that have been the main…
Using first-principles calculations, we examine the transition temperature $T_{\rm c}$ of superconductivity in sodium tungsten bronze ( Na$_x$WO$_3$, where $x$ is equal to or less than unity ). Although $T_{\rm c}$ is relatively low $T_{\rm…
A recently proposed "DFT+dispersion" treatment (Rajchel et al., Phys. Rev. Lett., 2010, 104, 163001) is described in detail and illustrated by more examples. The formalism derives the dispersion-free density functional theory (DFT)…
We study the plasmonic properties of coupled noble-metal nanochains in the case of different number of coupled chains and doping by different transition-metal (TM) atoms within the time-dependent density-functional theory (TDDFT) approach.…
The charge-density response of extended materials is usually dominated by the collective oscillation of electrons, the plasmons. Beyond this feature, however, intriguing many-body effects are observed. They cannot be described by one of the…
During the last decade, density function theory (DFT) in its static and dynamic time dependent forms, has emerged as a powerful tool to describe the structure and dynamics of doped liquid helium and droplets. In this review, we summarize…
Motivated by recent studies on the dynamics of colloidal solutions in narrow channels, we consider the steady state properties of an assembly of non interacting particles subject to the action of a traveling potential moving at a constant…
Transition-metal compounds (TMCs) with open-shell d-electrons are characterized by a complex interplay of lattice, charge, orbital, and spin degrees of freedom, giving rise to a diverse range of fascinating applications. Often exhibiting…
Increasing of electronic thermal conductivity of superconductor in the model with nontrivial density of states was considered. The electronic thermal conductivity K(T) of SC in the presence of external magnetic field was investigated. It…