Related papers: Structure of chalcogenide glasses by neutron diffr…
Small clusters of the As/Sb-S/Se system that is of importance for simulation of elementary structure units of chalcogenide glasses are calculated using DFT technique. Different structures of As2Xn- and Sb2Xn- (X=S,Se) with proper hydrogen…
Following upon our recent work on vector correlations in the Ar-NO collisions [PCCP 12, 1038 (2010)], we compare model results with close-coupling calculations for a range of channels and collision energies for the He-NO system. The…
The amorphous aluminium silicate (Al2O3)2(SiO2) [AS2] is investigated by means of large scale molecular dynamics computer simulations. We consider fully equilibrated melts in the temperature range 6100K >= T >= 2300K as well as glass…
The electromagnetic form factors of the proton and neutron encode information on the spatial structure of their charge and magnetization distributions. While measurements of the proton are relatively straightforward, the lack of a free…
High-resolution neutron-scattering measurements have been performed on bulk glasses of As2S3 and As2S3I1.65 at a spallation neutron source. For the case of As2S3, an isotopic-substitution experiment involving the S isotope has allowed some…
The influence of fast neutron irradiation on the structure and spatial distribution of Ge nanocrystals (NC) embedded in an amorphous SiO2 matrix has been studied. The investigation was conducted by means of laser Raman Scattering (RS), High…
Synchrotron X-ray diffraction experiments and molecular dynamics simulations have been performed on simple aliphatic aldehydes, from propanal to nonanal. The performance of the OPLS all-atom interaction potential model for aldehydes has…
The reliable calculation of electronic structures and understanding of electrical properties depends on an accurate model of the crystal structure. Here, we have reinvestigated the crystal structure of the high-zT thermoelectric material…
We propose structures of size between $\sim 1$ meter to 100 meters that drastically alter the local distribution of the Cosmic Neutrino Background ($C\nu B$). These structures have a shape reminiscent of a sea urchin: They consist of rods…
The nuclear and magnetic structure of Fe1+y(Te1-x,Sex) (0 < x < 0.20) compounds was analyzed between 2 K and 300 K by means of Rietveld refinement of neutron powder diffraction data. Samples with x < 0.075 undergo a tetragonal to monoclinic…
Tuning of the electronic properties of pre-synthesized colloidal semiconductor nanocrystals (NCs) by doping plays a key role in the prospect of implementing them in printed electronics devices such as transistors, and photodetectors. While…
Glass-ceramics with nanocrystals present a transparency higher than that expected from the theory of Rayleigh scattering. This ultra-transparency is attributed to the spatial correlation of the nanoparticles. The structure factor is…
In the present study, structural changes due to gradual doping of Sr in BaTiO3 were investigated by both x-ray and neutron powder diffraction techniques. Ba1-xSrxTiO3 (x=0.0, 0.5 and 1.0) samples were synthesized by PVA evaporation method…
Electronic structure of NiS_{2-x}Se_x system has been investigated for various compositions (x) using x-ray photoemission spectroscopy. An analysis of the core level as well as the valence band spectra of NiS_2 in conjunction with many-body…
The phenomena of electron, neutron, atomic and molecular diffraction have been studied by many experiments, and these experiments are explained by some theoretical works. In this paper, we study electronic double-slit diffraction with…
Structural, magnetic and electronic structural properties of Ni0.2Cd0.3Fe2.5-xAlxO4 ferrites nanoparticles have been studied x-ray diffraction (XRD), transmission electron microscopy (TEM), dc magnetization, and near edge x-ray absorption…
We use variable-temperature (150--300\,K) single-crystal X-ray diffraction to re-examine the interplay between structure and dynamics in the ambient phase of the isotropic negative thermal expansion (NTE) material Cd(CN)$_2$. We find strong…
Measurements of diffraction in electron-proton collisions are presented. All measured processes which occur through the exchange of a virtual photon (DIS) are consistent with a universal structure. For the diffractive photoproduction of…
We determined the electric form factor of the neutron $G_E^n$ via the reaction ${\vec{d}(\vec{e},e'n)p}$ using a longitudinally polarized electron beam and a frozen, polarized $^{15}ND_3$ target at Jefferson Lab. The knocked out neutrons…
Local and long range structure, optical and photoluminescence properties of sol-gel synthesized Ce1-xNixO2 nanostructures have been studied. The crystal structure, lattice strain and crystallite size have been analyzed. A decrease in…