Related papers: Raman Tensor Calculation for Magnesium Phthalocyan…

State-of-the-art methods for calculating neutral excitation energies are typically demanding and limited to single electron-hole pairs and their composite plasmons. Here we introduce excitonic density-functional theory (XDFT) a…

We studied Faraday rotation measure (RM) in turbulent media with the rms Mach number of unity, using isothermal, magnetohydrodynamic turbulence simulations. Four cases with different values of initial plasma beta were considered. Our main…

We present a framework for systematic computations of scattering amplitudes for gravitational Raman scattering, -- the inelastic scattering of massless fields off compact relativistic objects. We focus on the small-frequency…

A method used previously to calculate the masses of the vector mesons is extended to the calculation of the nucleon resonances. The method is based on the choice of integration kernels which eliminate the unknown parts of the spectrum. We…

X-ray absorption (XAS) and x-ray magnetic circular dichroism (XMCD) spectra at the L$_{2,3}$ edges of Mn in (Ge,Mn) compounds have been measured and are compared to the results of first principles calculation. Early \textit{ab initio}…

We measure molecular vibrations with femtometer precision using time-resolved x-ray absorption spectroscopy. For a demonstration, a Raman process excites the A$_{1g}$ mode in gas-phase SF$_6$ molecules with an amplitude of $\approx50$ fm,…

Raman scattering excitation (RSE) is an experimental technique in which the spectrum is made up by sweeping the excitation energy when the detection energy is fixed. We study the low-temperature ($T$=5~K) RSE spectra measured on four high…

We describe a density-functional method which aims at computing the ground state electron density and the spectral function at the same time. One basic ingredient of our method is the construction of the spectral function from the first…

We present a method for calculation of Raman modes of the quantum solid phase I solid hydrogen and deuterium. We use the mean-field assumption that the quantised excitations are localized on one molecule. This is done by explicit solution…

The engineering of the optical response of materials is a paradigm that demands microscopic-level accuracy and reliable predictive theoretical tools. Here we compare and contrast the dispersive permittivity tensor, using both a low-energy…

Using circularly polarised radiation and a combination of bulk-sensitive hard X-ray photoelectron spectroscopy and X-ray-absorption spectroscopy (XAS) we studied the electronic and magnetic structure of epitaxial Mn$_{1.8}$Co$_{1.2}$Ga thin…

New type of radiation in crystals is predicted and investigated in computer simulation. It is shown that process of volume reflection of electrons and positrons in bent crystals is accomplished with high-power radiation of photons. Volume…

Lattice dynamics for several ordered supercells with composition PbMg1/3Nb2/3O (PMN) were calculated with first-principles frozen phonon methods. Nominal symmetries of the supercells studied are reduced by lattice instabilities. Lattice…

We present a numerically efficient and accurate Multiple Scattering formalism, which is a generalization of the Multiple Scattering method with a truncated basis set [X. -G. Zhang and W. H. Butler, Phys. Rev. B 46,7433 (1992)]. Compared to…

We present a Raman study of Ar(+)-bombarded graphene samples with increasing ion doses. This allows us to have a controlled, increasing, amount of defects. We find that the ratio between the D and G peak intensities for a given defect…

The low-energy vibrational density of states (VDOS)of hydrogenated or deuterated poly(methyl methacrylate)(PMMA)plasticized by dibutyl phtalate (DBP) is determined by inelastic neutron scattering.From experiment, it is equal to the sum of…

The article provides ready-to-use 1pN-accurate frequency-domain gravitational wave forms for eccentric nonspinning compact binaries of arbitrary mass ratio including the first post-Newtonian (1pN) point particle corrections to the far-zone…

Relative $K$ x-ray intensities of $Mn$ in $Mn$, $MnO_{2}$, $LaMnO_{3}$ and $La_{0.7}B_{0.3}MnO_{3}$ ($B$ = $Ca$, $Sr$, and $Ce$) systems have been measured following excitation by 59.54 keV $\gamma$-rays from a 200 mCi $^{241}$Am…

Massless Dirac fermions in graphene can acquire a mass through different kinds of sublattice-symmetry-breaking perturbations, and there is a growing need to determine this mass using a conventional method. We describe how the mass caused by…

In this paper, we present an improvement of a method for computing scattering amplitudes that include external (polarized) fermions with the following features: the formulas are quite general and work for different kinematic configurations…