Search results for "X-Ray Absorption Spectroscopy"
showing 10 items of 129 documents
Ancient wood of the Acqualadrone rostrum: Materials history through gas chromatography/mass spectrometry and sulfur X-ray absorption spectroscopy
2012
In 2008 the rostrum from an ancient warship was recovered from the Mediterranean near Acqualadrone, Sicily. To establish its provenance and condition, samples of black and brown rostrum wood were examined using sulfur K-edge X-ray absorption spectroscopy (XAS) and gas chromatography/mass spectrometry (GC/MS). GC/MS of pyrolytic volatiles yielded only guaiacyl derivatives, indicating construction from pinewood. A derivatized extract of black wood yielded forms of abietic acid and sandaracopimaric acid consistent with pine pitch waterproofing. Numerical fits to the sulfur K-edge XAS spectra showed that about 65% of the endogenous sulfur consisted of thiols and disulfides. Elemental sulfur was…
Water Influences on the Copper Active Site in Hemocyanin
2010
Active metal sites play a key role in the biochemistry of oxygen transport by hemocyanins. Observing the changes in the local electronic structure of the copper sites upon oxygenation is thus essen...
X-ray Absorption under Operating Conditions for Solid-Oxide Fuel Cells Electrocatalysts: The Case of LSCF/YSZ
2019
We describe a novel electrochemical cell for X-ray absorption spectroscopy (XAS) experiments during electrical polarization suitable for high-temperature materials such as those used in solid oxide fuel cells. A half-cell LSCF/YSZ was then investigated under cathodic and anodic conditions (850 °
<title>Local structure of Ta-Re mixed oxide thin films studied by x-ray absorption spectroscopy</title>
2003
Mixed Ta-Re oxide thin films were synthesized for the first time by dc magnetron co-sputtering. Local environment around tantalum and rhenium atoms was studied by the Ta and Re L3-edges x-ray absorption spectroscopy in pure Ta2O5 and mixed Ta-Re oxide thin films (Ta:Re = 50:50, 38:62, 20:80 as determined from the ratio of the Ta-to-Re absorption edges). It was found that rhenium atoms are four-fold coordinated by oxygen atoms with R(Re-O) = 1.74 ± 0.01 Å and the mean square relative displacement (MSRD) σ2 = 0.0012 ± 0.0005 Å2. In pure Ta2O5 thin film, tantalum ions are coordinated by six oxygen atoms at R(Ta-O) = 2.02 ± 0.01 Å with the MSRD σ2 = 0.010 ± 0.001 Å2. The addition of rhenium ion…
Origin of Pressure-Induced Metallization in Cu 3 N: An X-ray Absorption Spectroscopy Study
2018
The authors are grateful to Professor Alain Polian for providing the NDAC cell.
Using photoelectron emission microscopy with hard-X-rays
2001
We present several successful test cases of using photoelectron emission microscopy (PEEM) for photon energy up to 25 keV. First, the full extended X-ray absorption fine structure analysis was implemented in areas as small as 100 mum(2) for transition-metal K edge absorption spectra and, therefore, demonstrated the feasibility of combining structural and chemical analysis with hard-X-ray absorption spectroscopy with high lateral resolution. We also show that PEEM can be used in a transmission (radiography) mode as an imaging detector for hard-X-ray, This approach again leads to the unprecedented 0.3 mum lateral resolution, particularly critical for the use of coherence-based phase contrast …
Jahn-Teller distortion aroundFe4+inSr(FexTi1−x)O3−δfrom x-ray absorption spectroscopy, x-ray diffraction, and vibrational spectroscopy
2007
$\mathrm{Sr}({\mathrm{Fe}}_{x}{\mathrm{Ti}}_{1\ensuremath{-}x}){\mathrm{O}}_{3\ensuremath{-}\ensuremath{\delta}}$ perovskites (strontium titanate ferrite solid solution) with well-defined oxygen stoichiometry have been studied as a function of iron concentration by x-ray diffraction, Fe and Ti $K$-edge x-ray absorption spectroscopy (XAS), and vibrational (Raman and infrared) spectroscopy. In reduced $\mathrm{Sr}({\mathrm{Fe}}_{x}{\mathrm{Ti}}_{1\ensuremath{-}x}){\mathrm{O}}_{3\ensuremath{-}x∕2}$ samples, the analysis of the Fe $K$-edge extended x-ray absorption fine structure indicates the expected presence of oxygen vacancies ${\mathrm{V}}_{\mathrm{O}}^{∙∙}$ in the first coordination shell…
Comparative Experimental and Theoretical Study of the Fe L-2,L-3-Edges X-ray Absorption Spectroscopy in Three Highly Popular, Low-Spin Organoiron Com…
2019
The occupied and unoccupied electronic structures of three highly popular, closed shell organoiron complexes ([Fe(CO)(5)], [(eta(5)-C5H5 )Fe(CO)(mu-CO)](2), and [(eta(5)-C5H5)(2)Fe]) have been theoretically investigated by taking advantage of density functional theory (DFT) calculations coupled to the isolobal analogy (Elian et al. Inorg. Chem. 1976, 15, 1148). The adopted approach allowed us to look into the relative role played by the ligand -> Fe donation and the Fe -> ligand back-donation in title molecules, as well as to investigate how CO- (terminal or bridging) and [(eta(5)-C5H5)](-)-based pi* orbitals compete when these two ligands are simultaneously present as in [(eta(5)-C5H…
Electronic and Magnetic Study of Polycationic Mn-12 Single-Molecule Magnets with a Ground Spin State S=11
2010
International audience; The preparation, magnetic characterization, and X-ray structures of two polycationic Mn-12 single-molecule magnets (Mn12O12(bet)(16)(EtOH)(4)](PF6)(14)center dot 4CH(3)CN center dot H2O (1) and [Mn12O12(bet)(16)(EtOH)(3)(H2O)](PF6)(13)(OH)center dot 6CH(3)CN center dot EtOH center dot H2O (2) (bet = betaine = (CH3)(3)N+-CH2-CO2-) are reported. 1 crystallizes in the centrosymmetric P2/cspace group and presents a (0:2:0:2) arrangement of the EtOH molecules in its structure. 2 crystallizes in the noncentrosymmetric P (4) over bar space group with two distinct Mn-12 polycations, [Mn12O12(bet)(16)(EtOH)(2)(H2O)(2)](14+) (2A) and [Mn12O12(bet)(16)(EtOH)(4)](14+)(2B) per un…
A Study Using X-ray Absorption and Emission Spectroscopy of Dioxygen-Binding Xerogels Incorporating Cyclam Units Complexed with Copper Salts.
2005
X-ray absorption spectroscopy was used to elucidate how hybrid xerogels complexed with CuCl2 could reversibly bind molecular dioxygen. Difference EXAFS analyses at the Cu K-edge suggest that dioxygen could bridge two Cu atoms in a μ-η1:η1 peroxo-like conformation with unequal Cu···O distances. Only the short distance (RCu–O1 = 1.86 ± 0.01 A) was unambiguously determined and looks typical of a CuII site. The Cu···Cu internuclear distances would be rather long: RCu–Cu ≈ 4.0 A (3.9 A) for the oxygenated (oxygen-free) xerogels. Cl K-edge EXAFS spectra revealed the pre-existence in the oxygen-free xerogels of CuI sites with short Cl–Cu bonds (2.11 ± 0.03 A). Pentacoordinate CuII sites with a lon…