Related papers: Theoretical X-Ray Absorption Debye-Waller Factors
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 present a detailed, microscopic transport theory for light in strongly scattering disordered systems whose constituent materials exhibit linear absorption or gain. Starting from Maxwell's equations, we derive general expressions for…
The distributions of the reflection coefficients $P(R)$ for chaotic microwave cavities with time-reversal symmetry are investigated in different absorption and antenna coupling regimes. In all investigated regimes the agreement between the…
The absorption in the extremal D3-brane background is studied for a class of massless fields whose linear perturbations leave the ten-dimensional background metric unperturbed, as well as the minimally-coupled massive scalar. We find that…
A continuous approximation for the results of [1] is obtained. In this approximation the energy distribution is represented in the form of the product of the Gibbs factor and superstatistics factor. The mutual weights of the factors are…
Potential applications in spintronics and quantum computing have motivated much recent research in epitaxial films of bismuth telluride. This system is also an example of van der Waals (vdW) epitaxy where the interface coherence between…
We prove optimal estimates for the decay in time of solutions to a rather general class of non-local in time subdiffusion equations in $\mathbb{R}^d$. An important special case is the time-fractional diffusion equation, which has seen much…
In this work the wave functions associated to the quantum relativistic universe, which is described by the Wheeler-DeWitt equation, are obtained. Taking into account different kinds of energy density, namely, matter, radiation, vacuum, dark…
We investigate the sound absorption in quark matter due to the interaction of the sound wave with the precritical fluctuations of the diquark-pair field above $T_c$. The soft collective mode of the pair field is derived using the time…
The deuteron wave function can be presented as the table through the respective massifs of numerically values of radial wave functions. In calculations such arrays of numbers in the texts of programs to operate quite difficult. Therefore a…
Infrared spectroscopy (IR) and quantum chemistry calculations that are based on the density functional theory (DFT) have been used to study the structure, molecular interactions of the nematic and twist-bend phases for thioether-linked…
X-ray Thomson scattering (XRTS) has emerged as a widely used diagnostics for extreme states of matter in a great variety of situations, and over a broad range of parameters. The standard approach for the interpretation of XRTS measurements…
In existing theoretical approaches to core-level excitations of transition-metal ions in solids relaxation and polarization effects due to the inner core hole are often ignored or described phenomenologically. Here we set up an ab initio…
A theoretical description of local absorption is proposed in order to investigate spectral variations on a length scale comparable with the extension of the relevant quantum states. A general formulation is derived within the density-matrix…
When calculating the optical absorption spectra of molecular crystals from first principles, the influence of the crystalline environment on the excitations is of significant importance. For such systems, however, methods to describe the…
We propose a new type of effective densities via the potential distribution theorem. These densities are for the sake of enabling the mapping of the free energy of a uniform fluid onto that of a nonuniform fluid. The potential distribution…
Our direct atomic simulations reveal that a thermally activated phonon mode involves a large population of elastic wavepackets. These excitations are characterized by a wide distribution of lifetimes and coherence times expressing particle-…
We present a formalism for calculating the absorption coefficient of a pair of coaxial tubules. A spatially nonlocal, dynamical self-consistent field theory is obtained by calculating the electrostatic potential produced by the charge…
Causality constraints are known to bind sound absorption to a limit that can only be achieved by optimizing the system bandwidth for a specific material thickness. This limit is defined on the assumption of a one-port system, generally…
We use ultrafast electron diffraction to detect the temporal evolution of phonon populations in femtosecond laser-excited ultrathin single-crystalline gold films. From the time-dependence of the Debye-Waller factor we extract a 4.7 ps…