Search results for "absorption spectroscopy"
showing 10 items of 828 documents
Investigation of the local structure of As-related acceptor centres in InSe by means of fluorescence-detected XAS
2002
In this paper we report on fluorescence-detected XAS measurements in arsenic-doped p-type indium selenide. Absorption spectra taken at the arsenic K-edge allow for an unambiguous determination of the bond length of the As atoms with their first neighbours that turns out to be 2.56 ± 0.02 A. The XANES spectrum and the bond length (as determined from EXAFS oscillations) exhibit weak anisotropy as the angle between the crystal c-axis and the x-ray polarization vector is changed. These results are fully compatible with the model of a single substitutional acceptor (As in Se site), with no bonds along the c-axis (that would give rise to strong linear dicroism in the XANES spectrum). The In–As bo…
A Study Using Sulfur K-Edge XAS of Bitumens, Asphaltenes, Maltenes and their Oxidation Products by Comparison with Model Compounds
1997
High resolution Sulfur K-edge XANES spectra have been recorded at the ESRF on test samples of bitumen, asphaltene and maltene fractions and various model compounds. All these fractions were found to have a low content of sulfidic species as opposed to thiophenic species and it is therefore not surprising that thermally oxidized samples (RTFOT) had also a low content (1%) of sulfoxides. This is indeed consistent with the absence of any detectable S=O signature in the EXAFS spectra which were recorded over more than 1300 eV using the undulator gap scan technique.
Magnetic and Electronic Properties of Heusler Alloy Films Investigated by X-Ray Magnetic Circular Dichroism
2008
We have investigated the magnetic properties of epitaxial Heusler alloy films using x-ray absorption spectroscopy (XAS) and x-ray magnetic circular dichroism∈dex{x-ray!magnetic circular dichroism} (XMCD) in the transmission (TM) and in the surface sensitive total electron yield (TEY) mode. We have investigated Ni_2MnGa based shape memory alloys and half-metallic Co2Cro.6Feo.4 films. Single crystalline Ni2MnGa(110)/Al2O3(1120) and Ni2MnGa(100)/MgO(100) films show a martensitic transition from a cubic high temperature phase to a martensitic low-temperature phase at 250–275 K as concluded from magnetometry and x-ray diffraction. The martensitic transition of this Heusler compound is shifted in…
Electronic structure of single-crystal rocksalt CdO studied by soft x-ray spectroscopies andab initiocalculations
2008
Soft x-ray emission spectroscopy (XES) and x-ray absorption spectroscopy (XAS) are employed to investigate the occupied and unoccupied electronic structures in rocksalt-phase single-crystal CdO. Resonant XES at the OK edge reveals a clear Cd 4d-O 2p hybridized peak and momentum-dependent coherent contributions to the resonant emission spectra. Good agreement is obtained between the above-threshold XES and XAS spectra, and the calculated O 2p local partial density of states (PDOS). Calculation of the O 2p PDOS was performed within the GW framework of many-body perturbation theory.
Interplay between local structure, vibrational and electronic properties on CuO under pressure
2020
The electronic and local structural properties of CuO under pressure have been investigated by means of X-ray absorption spectroscopy (XAS) at Cu K edge and ab initio calculations, up to 17 GPa. The crystal structure of CuO consists of Cu motifs within CuO4 square planar units and two elongated apical Cu-O bonds. The CuO4 square planar units are stable in the studied pressure range, with Cu-O distances that are approximately constant up to 5 GPa, and then decrease slightly up to 17 GPa. In contrast, the elongated Cu-O apical distances decrease continuously with pressure in the studied range. An anomalous increase of the mean square relative displacement (EXAFS Debye-Waller, s2) of the elong…
Local Environment of Yttrium in Y-Doped Barium Cerate Compounds
2006
The local structure of yttrium in Y-doped BaCeO3 compounds was studied using X-ray absorption spectroscopy (XAS) at the Y K-edge. Data analysis shows that the local environment of Y3+ changes, resulting in a distorted octahedron. The structural distortion found does not depend on the dopant amount at the investigated compositions, but on the level of hydration, as clearly demonstrated by the distortion increase in the BaCe0.9Y0.1O3-ä sample after the treatment in O2/H2O. In situ measurements performed in O2/H2O flux, which show that the distortion is retained at 753 K, are also reported. The observed significative structural changes seem to point out a preferential insertion of the hydroxyl…
Pressure-induced structural changes in α-MoO3 probed by X-ray absorption spectroscopy
2019
The authors are grateful to Prof. Alain Polian for providing NDAC cell. The research leading to this result has been supported by the project CALIPSOplus under the Grant Agreement 730872 from the EU Framework Programme for Research and Innovation HORIZON 2020. The work was supported by philanthropist MikroTik and administrated by the University of Latvia Foundation.
X-ray absorption spectroscopy of strongly disordered glasses: Local structure around Ag ions ing−Ag2O∙nB2O3
2006
The local structure around Ag ions in silver borate glasses $g\text{\ensuremath{-}}{\mathrm{Ag}}_{2}\mathrm{O}∙n{\mathrm{B}}_{2}{\mathrm{O}}_{3}$ $(n=2,4)$ was studied by x-ray absorption spectroscopy at the Ag $K$ edge for temperatures from $77\phantom{\rule{0.3em}{0ex}}\text{to}\phantom{\rule{0.3em}{0ex}}450\phantom{\rule{0.3em}{0ex}}\mathrm{K}$. Extended x-ray absorption fine structure (EXAFS) analysis based on cumulant expansion or multishell Gaussian model fails for these systems. Therefore, the radial distribution functions (RDFs) around Ag ions were reconstructed using a method based on the direct inversion of the EXAFS expression. The RDFs consist of about eight atoms (oxygens and b…
XANES and EXAFS modelling of configurational disorder in silver borate glasses
2005
The sensitivity of X-ray absorption spectroscopy (XAS) to the local structure around a selected atomic species (symmetry, distances and angles) is commonly exploited to quantitatively describe systems where all the configurations around the absorbing atoms may be approximated by the mean one. However, in many cases of disordered systems a simple description of the local structure with singleconfiguration models cannot be reconciled with experimental spectra. In this paper the necessity to analyse the XAS spectra by considering a multiplicity of atomic structural configurations is demonstrated in the case of silver borate glasses. The local coordination around Ag cations in (Ag2O.nB2O3) glas…
Metal-support interaction and redox behavior of Pt(1 wt %)/Ce0.6Zr0.4O2
2006
The catalyst Pt(1 wt %)/Ce(0.6)Zr(0.4)O(2) is studied by CO-temperature programmed reduction (CO-TPR), isothermal oxygen storage complete capacity (OSCC), X-ray absorption spectroscopy (XAS) at the Pt L(III) edge, and in situ X-ray diffraction (in situ XRD), with the aim of elucidating the role of supported metal in CO oxidation by ceria-based three-way catalysts (TWC). The redox behavior of Pt(1 wt %)/Ce(0.6)Zr(0.4)O(2) is compared to that of bare ceria-zirconia. OSCC of redox-aged Pt/ceria-zirconia is twice that of bare ceria-zirconia, and the maximum of CO consumption occurs at a temperature about 300 K lower than redox-aged ceria-zirconia. XAS analysis allows one to evidence the formati…