Related papers: X-ray absorption Debye-Waller factors from ab init…
We describe new methods for denoising and detection of gravitational waves embedded in additive Gaussian noise. The methods are based on Total Variation denoising algorithms. These algorithms, which do not need any a priori information…
The rates of protein folding with photon absorption or emission and the cross section of photon -protein inelastic scattering are calculated from the quantum folding theory by use of standard field-theoretical method. All these protein…
In this paper, we review the main problem concerning the calculation of X-ray scattering of simulated model systems, namely their finite size. A novel method based on the Rayleigh-Debye-Gans approximation was derived, which allows…
An algebraic model taking into account the influence of the molecular rotation on the wave functions of vibrational-rotational states of the diatomic molecule using the formalism of the ladder operators and an expansion in a small parameter…
We propose an iterative method for computing vibrational spectra that significantly reduces the memory cost of calculations. It uses a direct product primitive basis, but does not require storing vectors with as many components as there are…
A new quantum-theoretical derivation of the elastic and inelastic scattering probability of He atoms from a metal surface, where the energy and momentum exchange with the phonon gas can only occur through the mediation of the surface…
Understanding the molecular vibrations underlying each of the unknown infrared emission (UIE) bands (such as those found at 3.3, 3.4, 3.5, 6.2, 6.9, 7.7, 11.3, 15.8, 16.4, 18.9 mm) observed in or towards astronomical objects is a vital link…
We provide a physical interpretation of the Kirchhoff index of any molecules as well as of the Wiener index of acyclic ones. For the purpose, we use a local vertex invariant that is obtained from first principles and describes the atomic…
We present a wavefunction methodology to account for finite temperature initial conditions in the quantum Rabi model. The approach is based on the Davydov-Ansatz together with a statistical sampling of the canonical harmonic oscillator…
The leading order "temperature" of a dense two dimensional granular material fluidised by external vibrations is determined. An asymptotic solution is obtained where the particles are considered to be elastic in the leading approximation.…
We study the dynamics of spiral waves and oscillation modes in relativistic rotating discs around black holes. Generalizing the Newtonian theory, we show that wave absorption can take place at the corotation resonance, where the pattern…
The $ab$ oscillations in absorbing matter are considered. The standard model based on optical potential does not describe the total $ab$ transition probability as well as the channel corresponding to absorption of the $b$-particle. We…
We propose a continuum model for the theoretical study of hybridized moir\'e excitons in transition metal dichalcogenides heterobilayers, and we use a variational method to solve the exciton wavefunction and calculate the optical absorption…
The equation for temporary evolution of spectral energy of collisionless Alfven waves is derived in framework of weak turbulence theory. The main nonlinear processes for such conditions are induced scattering and two quantum absorption of…
This paper presents a robust numerical method for calculating the total absorption rate of electromagnetic waves in magnetized plasmas, capable of determining the absorption ratio among different plasma components. The method adopts…
Atom-in-jellium calculations of the Einstein frequency were used to calculate the mean displacement of an ion over a wide range of compression and temperature. Expressed as a fraction of the Wigner-Seitz radius, the displacement is a…
A method for estimating the relative content of crystalline phases of a multiphase sample, based on probabilistic analysis of the intensities of the diffraction pattern reflexes, has been developed. The method is based on the introduction…
We consider the subdiffusion--absorption process in a system which consists of two different media separated by a thin membrane. The process is described by subdiffusion--absorption equations with fractional Riemann--Liouville time…
Many statistical properties of X-ray aperiodic variability from accreting compact objects can be explained by the propagating fluctuations model applied to the accretion disc. The mass accretion rate fluctuations originate from variability…
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…