Related papers: Finite temperature external potential in crystalli…
The widely used thermal Hartree-Fock (HF) theory is generalized to include the effect of electron correlation while maintaining its quasi-independent-particle framework. An electron-correlated internal energy (or grand potential) is…
Low-temperature properties of crystalline solids can be understood using harmonic perturbations around a perfect lattice, as in Debye's theory. Low-temperature properties of amorphous solids, however, strongly depart from such descriptions,…
Consider a $d$-dimensional antiferromagnet with a quantum disordered ground state and a gap to bosonic excitations with non-zero spin. In a finite external magnetic field, this antiferromagnet will undergo a phase transition to a ground…
The bandgap of insulating materials is renormalized in various ways by the electron-phonon interaction owing to the dynamical and quantum fluctuations of nuclei. These fluctuation effects are considered in the perturbative…
Approximations to the many-fermion free energy density functional that include the Thomas-Fermi (TF) form for the non-interacting part lead to singular densities for singular external potentials (e.g. attractive Coulomb). This limitation of…
We present the finite temperature spectra of both bottomonium and charmonium, obtained from a consistent lattice QCD based potential picture. Starting point is the complex in-medium potential extracted on full QCD lattices with dynamical…
We assess the performance of nonempirical, truly nonlocal and semi-local functionals with regard to structural and thermal properties of $3d$, $4d$, and $5d$ non-magnetic transition metals. We focus on constraint-based functionals and…
We study the Wiedemann-Franz (WF) law in the d-density wave (DDW) model. Even though the opening of the DDW gap $(W_{0})$ profoundly modifies the electronic density of states and makes it dependent on energy, the value of the WF ratio at…
We present a finite-temperature density functional theory investigation of the nonequilibrium transient electronic structure of warm dense Li, Al, Cu, and Au created by laser excitation. Photons excite electrons either from the inner shell…
We propose a generalized thermodynamics in which quasi-homogeneity of the thermodynamic potentials plays a fundamental role. This thermodynamic formalism arises from a generalization of the approach presented in paper [1], and it is based…
Temperature effects in a scalar field non-minimally coupled to gravity are investigated. The Thermo Field Dynamics formalism is used. This is a topological field theory that allows us to calculate different effects, such as the…
An effective quasiparticle description of the thermodynamics of deconfined matter, compatible with both finite-temperature lattice data and the perturbative limit, is generalized to finite chemical potential. Within this approach, the…
We have conducted a thorough theoretical and numerical investigation of the electronic susceptibility, polarizability, plasmons, their damping rates, as well as the static screening in pseudospin-1 Dirac cone materials with a flat band, or…
Combining a precise ab initio electron band structure calculation of the TiO2 rutile structure with the temperature evolution of the Ti mean-square displacements, we reproduce a puzzling temperature increase of the electric field gradient…
The zero temperature d - wave superconductor phase transition theory given in the case of T=0 for two - dimensional superconductors (I. Herbut, PRL {\bf 85}, 1532 (2000)) is generalized for finite temperatures. The Gaussian behavior of the…
A spatially flat Friedmann-Robertson-Walker background with a general scale factor is considered. In this space-time, the energy-momentum tensor of the scalar field with a general curvature coupling parameter is obtained. Using the Thermo…
We use the density matrix formalism in order to calculate the energy level shifts, in second order on interaction, of an atom in the presence of a perfectly conducting wall in the dipole approximation. The thermal corrections are also…
There is an ever-growing need for predictive models for the elasto-viscoplastic deformation of solids. Our goal in this paper is to incorporate recently developed out-of-equilibrium statistical concepts into a thermodynamically consistent,…
Accurate description of finite-temperature vibrational dynamics is indispensable in the computation of two-dimensional electronic spectra. Such simulations are often based on the density matrix evolution, statistical averaging of initial…
The low-temperature thermal properties of dielectric crystals are governed by acoustic excitations with large wavelengths that are well described by plane waves. This is the Debye model, which rests on the assumption that the medium is an…