Search results for "Exafs"
showing 10 items of 88 documents
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.
Local Structure of Supported Keggin and Wells-Dawson Heteropolyacids and Its Influence on the Catalytic Activity
2019
[EN] Keggin [PW12O40]3– and Wells–Dawson [P2W18O62]6– heteropolyanions are nanosized transition-metal-oxygen clusters belonging to the heteropolyacids (HPAs) family. They are widely used as catalysts due to their high Brønsted acidity, and their dispersion on solid supports favors the accessibility to their acid sites generally increasing the catalytic activity. A series of binary materials composed of Keggin or Wells–Dawson HPAs and SiO2, TiO2, and ZrO2 have been prepared by impregnation or solvothermal methods. Remarkable differences have been found in the catalytic activities among the unsupported and supported HPAs. These differences have been correlated in the past to the structural ch…
Identification of hexanuclear Actinide(IV) carboxylates with Thorium, Uranium and Neptunium by EXAFS spectroscopy
2012
International audience; Hydrated actinide(IV) ions undergo hydrolysis and further polymerization and precipitation with increasing pH. The resulting amorphous and partly crystalline oxydydroxides AnO(n)(OH)(4-2n)center dot xH(2)O can usually be observed as colloids above the An(IV) solubility limit. The aging process of such colloids results in crystalline AnO(2). The presence of carboxylates in the solution prevents the occurrence of such colloids by formation of polynuclear complexes through a competing reaction between hydrolysis and ligation. The majority of recently described carboxylates reveals a hexanuclear core of [An(6)(mu(3)-O)(4)(mu(3)-OH)(4)](12+) terminated by 12 carboxylate l…
The complementary structural studies of the double metal cyanide type catalysts for the ring opening polymerization of the oxiranes
2016
Przeprowadzono badania strukturalne katalizatorów dimetalocyjankowych (DMC) z dwoma rodzajami ligandów organicznych. Zaproponowano wyjaśnienie etapów przebiegu krzywych otrzymanych metodą analizy termograwimetrycznej i różnicowej kalorymetrii skaningowej (TG/DSC) badanych katalizatorów. Wykazano obecność kilku stopni związania ligandów w kompleksach DMC. Na podstawie wyników badań z wykorzystaniem absorpcji rentgenowskiej (XAS) stwierdzono, że centrum aktywne katalizatora stanowi atom cynku. W bezpośrednim sąsiedztwie atomów Zn wykryto obecność atomów Cl, natomiast w najbliższych sferach koordynacyjnych atomu Zn nie wykryto atomów tlenu.
Role of Surface Chemistry in the Superhydrophobicity of the Springtail Orchesella cincta (Insecta:Collembola)
2020
Collembola are ancient arthropods living in soil with extensive exposure to dirt, bacteria, and fungi. To protect from the harsh environmental conditions and to retain a layer of air for breathing when submerged in water, they have evolved a superhydrophobic, liquid-repelling cuticle surface. The nonfouling and self-cleaning properties of springtail cuticle make it an interesting target of biomimetic materials design. Recent research has mainly focused on the intricate microstructures at the cuticle surface. Here we study the role of the cuticle chemistry for the Collembola species Orchesella cincta (Collembola, Entomobryidae). O. cincta uses a relatively simple cuticle structure with prima…
Uranyl sorption onto birnessite: A surface complexation modeling and EXAFS study
2014
This work investigates the mechanism of the uranyl interaction with birnessite, one of the most common layer-type MnO2 mineral at the Earth's surface, by coupling macroscopic (surface complexation experiments) and microscopic (EXAFS measurements) approaches. The sorption of uranyl on synthetic hexagonal birnessite, the low-pH birnessite form, was studied under various conditions of pH (3–6), electrolyte backgrounds (0.1 M NaClO4, NaNO3 and Na2CO3), and solid/liquid ratios (from 0.27 to 4.5 g/L). Sorption isotherms exhibit a complex form indicative of at least two types of sorption sites. EXAFS data reveal the presence of two equatorial O shells at ca. 2.32 Å and 2.46 Å for all the samples, …
Morphology and local organization of water-containing (1R,2S)-Dodecyl(2-hydroxy-1-methyl-2-phenylethyl)dimethylammonium bromide reverse micelles disp…
2014
The structure of (1R,2S)-dodecyl(2-hydroxy-1-methyl-2-phenylethyl)dimethylammonium bromide (DMEB) reverse micelles, at various water-to-surfactant molar ratio (R-w, R-w = [water]/[DMEB]) and DMEB concentrations, has been investigated by small angle X-ray scattering (SAXS) and extended X-ray absorption fine structure spectroscopy (EXAFS). SAXS data of dry reverse micelles are consistent with a model of spherical hydrophilic core surrounded by DMEB alkyl chains whose polydispersity decreases significantly with surfactant concentration. By adding water, a sphere to cylinder transition occurs leading to a one-dimensional growth of reverse micellar cores with R-w and surfactant concentration. Th…
Plutonium(III) complexation by humic substances studied by X-ray absorption fine structure spectroscopy
2006
Abstract We determined structural parameters for the near-neighbor surrounding of plutonium(III) in complexes with humic and fulvic acids at pH 1 and for the purpose of comparison also for the plutonium(III) aquo ion by means of X-ray absorption fine structure (XAFS) spectroscopy. It could be shown that in the complexes with humic substances as well as in the plutonium(III) aquo ion sample the trivalent oxidation state of plutonium was stable within the time of the experiment. In the humate and fulvate complexes, the plutonium(III) is surrounded by about eight oxygen atoms with an average Pu–O distance of 2.48 ± 0.02 A. The structural parameters determined for plutonium(III)–humate and –ful…
Structural characterization of U(VI) surface complexes on kaolinite in the presence of humic acid using EXAFS spectroscopy.
2007
To determine the influence of humic acid (HA), pH, and presence of atmospheric CO2 on the sorption of U(VI) onto kaolinite, the structure of the surface complexes was studied by U L III-edge extended X-ray absorption fine structure (EXAFS) spectroscopy. The best fits to the experimental EXAFS data were obtained by including two uranium coordination shells with two axial (O ax) and five equatorial (O eq) oxygen atoms at 1.77+/-0.02 and 2.34+/-0.02 A, respectively, and two coordination shells with one Al/Si atom each at 3.1 and 3.3 A. As in the case of the binary system U(VI)-kaolinite, uranium forms inner-sphere surface complexes by edge sharing with aluminum octahedra and/or silicon tetrahe…
Crossing the boundary between fcc and hcp: the structure of nanosized cobalt is unraveled by a model of size distribution, shape and stacking faults …
2014
The properties of nanostructured cobalt in the fields of magnetic, catalytic and biomaterials depend critically on Co close-packing. In this paper we report a structural analysis of nanosized cobalt based on the whole XRD pattern simulation allowed by the Debye equation. The underlying structural model involves statistical sequences of cobalt layers and produces simulated XRD powder patterns bearing the concurrent signatures of hexagonal and cubic close packing. Size distribution, shape and distance distribution between pairs of atoms are also modelled. The simulation algorithm allows straightforward fitting to experimental data and hence the assessment of the model parameters. Analysis of …