Search results for " x-ray diffraction"
showing 10 items of 44 documents
An Investigation of the Pressure-Induced Structural Phase Transition of Nanocrystalline alpha-CuMoO4
2022
The structural behavior of nanocrystalline α-CuMoO4 was studied at ambient temperature up to 2 GPa using in situ synchrotron X-ray powder diffraction. We found that nanocrystalline α-CuMoO4 undergoes a structural phase transition into γ-CuMoO4 at 0.5 GPa. The structural sequence is analogous to the behavior of its bulk counterpart, but the transition pressure is doubled. A coexistence of both phases was observed till 1.2 GPa. The phase transition gives rise to a change in the copper coordination from square-pyramidal to octahedral coordination. The transition involves a volume reduction of 13% indicating a first-order nature of the phase transition. This transformation was…
Role of the thermal treatment on the microstructure of YAGG nanopowders prepared by urea glass route
2023
Yttrium aluminium gallium garnet (YAGG, Y3Al2Ga3O12) doped with rare-earth ions has drawn large attention owing to its optical properties with applications ranging from persistent luminescent phosphors to nanothermometers. Herein, three different YAGG materials were synthesized via the urea glass route followed by thermal treatment, relatively undoped; doped with Ce3+, Cr3+, and Nd3+; and doped with Ce3+, Cr3+, and Yb3+. The garnet formation was studied in situ upon thermal treatment from 300 to 1000 ◦C using synchrotron powder diffraction. Our results show that with this method, the onset of formation of the garnet is about 860 ◦C, with comparable cell parameters for both undoped and doped…
Coordination Complexes of a Neutral 1,2,4-Benzotriazinyl Radical Ligand: Synthesis, Molecular and Electronic Structures, andMagnetic Properties
2015
A series of d-block metal complexes of the recently reported coordinating neutral radical ligand 1-phenyl-3-(pyrid-2-yl)-1,4-dihydro-1,2,4-benzotriazin-4-yl (1) was synthesized. The investigated systems contain the benzotriazinyl radical 1 coordinated to a divalent metal cation, MnII, FeII, CoII, or NiII, with 1,1,1,5,5,5-hexafluoroacetylacetonato (hfac) as the auxiliary ligand of choice. The synthesized complexes were fully characterized by single-crystal X-ray diffraction, magnetic susceptibility measurements, and electronic structure calculations. The complexes [Mn(1)(hfac)2] and [Fe(1)(hfac)2] displayed antiferromagnetic coupling between the unpaired electrons of the ligand and the meta…
Metallic interconnects for SOFC : characterization of their corrosion resistance in hydrogen/water atmosphere and at the operating temperatures of di…
2006
International audience; Chromia forming alloys are one of the best candidates for the interconnecting materials in solid oxide fuels cells (SOFC). Recent research has enabled to decrease the operating temperature of the SOFC from 1000 °C to 800 °C. However, low electronic conductivity and high volatility of the chromia scale need to be solved to improve performance of interconnects. In the field of high temperature oxidation of metals, it is well known that the addition of reactive elements into alloys or in thin film coatings, improve the oxidation resistance of alloys at high temperature. The elements of the beginning of the lanthanide group and yttrium are the most efficient. The goal of…
Thin film growth and band lineup of In2O3 on the layered semiconductor InSe
1999
Thin films of the transparent conducting oxide In2O3 have been prepared in ultrahigh vacuum by reactive evaporation of indium. X-ray diffraction, optical, and electrical measurements were used to characterize properties of films deposited on transparent insulating mica substrates under variation of the oxygen pressure. Photoelectron spectroscopy was used to investigate in situ the interface formation between In2O3 and the layered semiconductor InSe. For thick In2O3 films a work function of φ = 4.3 eV and a surface Fermi level position of EF−EV = 3.0 eV is determined, giving an ionization potential IP = 7.3 eV and an electron affinity χ = 3.7 eV. The interface exhibits a type I band alignmen…
NaCl induced corrosion of Ti-6Al-4V alloy at high temperature
2016
International audience; This paper presents a study on the Ti-6Al-4V behaviour in presence of NaCl deposit under dry and moistair environments at 560◦C. The results evidence a detrimental effect of the NaCl deposit with a synergisticeffect in presence of moist air environment. Treatments under dry and moist air with NaCl deposit for600 h, lead respectively to weight gains per unit area 5 and 15 times higher than observed under classicoxidation in dry air. Enhancement of the corrosion phenomenon is attributed to the presence of gaseousmetal chlorides, leading to the establishment of an active corrosion process.
Electrodeposition of supported gadolinium-doped ceria solid solution nanowires
2012
Gadolinium-ceria solid solution nanowires with tunable composition have been prepared through template cathodic electrodeposition from solutions containing Ce 3+Gd 3+ in a variable ratio. The employed template is Porous Anodic Alumina because it can function as thermal resistant separator supporting the nanowires if used as ionic conductor in Solid Oxide Fuel Cell (SOFC). Scanning Electron Microscopy of the deposited nanostructures revealed that the use of ethanol as solvent and metal chloride as electrolyte allowed to prepare continuous, compact and well defined nanowires with morphological features stable even after thermal treatment. EDX compositional analysis confirms the presence of bo…
High-pressure crystal structure investigation of synthetic Fe2SiO4 spinel.
2011
AbstractThe crystal structure of Fe2SiO4 spinel at room temperature was investigated at seven different pressures by X-ray diffraction, using a diamond anvil cell to examine the influence of Fe substitution on ringwoodite behaviour at high pressure. The results compared with those of a pure Mg endmember show that the substitution of Fe into the spinel structure causes only small changes in the compression rate of coordination polyhedra and the distortion of the octahedron. The data show that the compression rate for the octahedron and tetrahedron in (Mg,Fe)2SiO4 can be considered statistically equal for FeO6 and MgO6, as well as for SiO4 in both the endmembers. This shows why almost identic…
Synthesis and characterization of 4,6-O-butylidene-N-(2-hydroxybenzylidene)-beta-D-glucopyranosylamine: crystal structures of 4,6-O-butylidene-alpha-…
2002
4,6-O-Butylidene-N-(2-hydroxybenzylidene)-β-D-glucopyranosylamine was synthesized and characterized using analytical, spectral and single-crystal X-ray diffraction methods. 1H and 13C NMR studies showed the presence of the β-anomer, which has also been confirmed by the crystal structure. The molecular structure of this compound showed the presence of the tridentate ONO ligation-core. Both precursors, 4,6-O-butylidene-α-D-glucopyranose and 4,6-O-butylidene-β-D-glucopyranosylamine were characterized using single crystal X-ray diffraction. The α-anomeric nature of the former and β-anomeric nature of the latter were proposed based on 1H NMR studies and were confirmed by determining the crystal …
X-ray diffraction measurements of Mo melting to 119 GPa and the high pressure phase diagram
2009
In this paper, we report angle-dispersive X-ray diffraction data of molybdenum melting, measured in a double-sided laser-heated diamond-anvil cell up to a pressure of 119 GPa and temperatures up to 3400 K. The new melting temperatures are in excellent agreement with earlier measurements up to 90 GPa that relied on optical observations of melting and in strong contrast to most theoretical estimates. The X-ray measurements show that the solid melts from the bcc structure throughout the reported pressure range and provide no evidence for a high temperature transition from bcc to a close-packed structure, or to any other crystalline structure. This observation contradicts earlier interpretation…