Search results for "spinel"
showing 10 items of 103 documents
Hybrid density functional calculations of hyperfine coupling tensor for hole-type defects in MgAl2O4
2020
This work has been performed within the framework of the EUROfusion Enabling Research project: ENR-MFE19.ISSP-UL-02 “Advanced experimental and theoretical analysis of defect evolution and structural disordering in optical and dielectric materials for fusion application”. The views and opinions expressed herein do not necessarily reflect those of the European Commission.
Neutron irradiation influence on magnesium aluminium spinel inversion
2002
Abstract Grown by the Verneuil method MgO · nAl2O3 single crystals and natural spinel crystal have been studied using X-ray diffraction and photoluminescence spectra. The fast neutron irradiation of magnesium aluminium spinel leads to the lattice parameter decrease. The bond lengths of Mg–O and Al–O vary with the u-parameter and the lattice parameter. On the other hand, the bond lengths are related with the inversion parameter. Using changes of the lattice parameter during irradiation we have calculated the inversion parameter, which is 15–20%. In the luminescence spectra, the fast neutron radiation (fluence 1016 cm−2) produces an increase in the intensity ratio of the N- to R-lines by 5–20…
Evidence from Antarctic mantle peridotite xenoliths for changes in mineralogy, geochemistry and geothermal gradients beneath a developing rift
2006
Abstract Garnet and spinel peridotite xenoliths associated with the Phanerozoic Lambert–Amery Rift in eastern Antarctica contain evidence for several stages in the development of the mantle beneath the rift. Despite the fact that equilibria were only partly attained, a combination of petrography, whole-rock geochemistry, mineral chemistry and thermobarometry can be used to decipher four stages prior to entrainment of the xenoliths in the host magma during the initial stages of the breakup of Antarctica, India and Madagascar. The first chronological stage is represented by harzburgitic protoliths represented by rare occurrences of low-Ca olivines and orthopyroxenes in spinel lherzolites: the…
Are highly siderophile elements (PGE, Re and Au) fractionated in the upper mantle of the earth? New results on peridotites from Zabargad
2000
Abstract Seven peridotite samples from Zabargad Island (Red Sea) were analyzed for highly siderophile elements (HSE), including five platinum-group elements (PGE: Os, Ir, Ru, Rh, Pd) and Re and Au. Petrography and chemical composition of the samples had been published earlier [Kurat, G., Palme, h., Embey-Isztin, A., Touret, J., Ntaflos, T., Spettel, B., Brandstatter, F., Palme, C., Dreibus, G., Prinz, m., 1993. Petrology and geochemistry of peridotites and associated vein rocks of Zabargad Island, Red Sea, Egypt. Mineralogy and Petrology 48, 309–341]. Five samples with chemical compositions typical of upper mantle rocks, from fertile to increasingly depleted mantle (CaO: 3.39 to 0.21%), hav…
Highly siderophile element geochemistry of the Earth's mantle: new data for the Lanzo (Italy) and Ronda (Spain) orogenic peridotite bodies
2000
Abstract Nine plagioclase/spinel lherzolites from the Lanzo (Italy) and Ronda (Spain) peridotite bodies were analysed for Re, Os, Ir, Ru, Rh, Pd, and Au using a high-precision instrumental neutron activation (INA) procedure after NiS fire assay. Our data conform with previous observations that orogenic lherzolite massifs sampled domains of the subcontinental lithospheric mantle (SCLM) displaying a characteristic enrichment of Ru, Rh and Pd (i.e. the light platinum group elements; PGEs) over Os and Ir. The Pd/Ir, Rh/Ir and Ru/Ir ratios are superchondritic and very similar in both suites (2.46±0.32 vs. 2.42±0.21; 0.46±0.07 vs. 0.45±0.10; 1.99±0.14 vs. 2.25±0.25, respectively). Rhenium and gol…
Crystal Chemistry of CdIn2S4, MgIn2S4, and MnIn2S4 Thiospinels under High Pressure
2012
We report X-ray diffraction measurements in CdIn2S4, MgIn2S4, and MnIn2S4 thiospinels at room temperature and high pressures. The pressure dependences of the structural parameters have been determined and compared to those from theoretical calculations. It is found that the three thiospinels have similar bulk moduli (B-0) between 75 and 80 GPa (B-0' similar to 3). The degree of inversion of these thiospinels has also been determined. The three thiospinels undergo a phase transition toward a defect LiTiO2-type structure above 9.5, 8.3, and 6.8 GPa in CdIn2S4, MgIn2S4, and MnIn2S4, respectively. Interestingly, the low- and high-pressure phases belong to the same symmetry group (Fd-3m), the tr…
Low temperature measurements by infrared spectroscopy in $CoFe_2O_4$ ceramic
2012
In this paper results of new far-infrared and middle-infrared measurements (wavenumber range of 4000cm-1 - 100cm-1) in the range of the temperature from 300K to 8K of the CoFe2O4 ceramic are presented. The bands positions and their shapes are the same in the wide temperature range. The quality of the sample was investigated by X-ray, EDS and EPMA studies. The CoFe2O4 reveals the cubic structure (Fd-3m) in the temperature range from 85K to 360 K without any traces of distortion. On the current level of knowledge the polycrystalline CoFe2O4 does not exhibit phase transition in the temperature range from 8 K to 300 K.
Pressure-induced structural and semiconductor-semiconductor transitions in Co0.5Mg0.5Cr2O4
2018
The effect of pressure on the structural, vibrational, and electronic properties of Mg-doped Cr bearing spinel $\mathrm{C}{\mathrm{o}}_{0.5}\mathrm{M}{\mathrm{g}}_{0.5}\mathrm{C}{\mathrm{r}}_{2}{\mathrm{O}}_{4}$ was studied up to 55 GPa at room-temperature using x-ray diffraction, Raman spectroscopy, electrical transport measurements, and ab initio calculations. We found that the ambient-pressure phase is cubic (spinel-type, $Fd\overline{3}m$) and underwent a pressure-induced structural transition to a tetragonal phase (space group $I\overline{4}m2$) above 28 GPa. The ab initio calculation confirmed this first-order phase transition. The resistivity of the sample decreased at low pressures …
Pressure-induced order–disorder transitions in β-In2S3: an experimental and theoretical study of structural and vibrational properties
2021
This joint experimental and theoretical study of the structural and vibrational properties of β-In2S3 upon compression shows that this tetragonal defect spinel undergoes two reversible pressure-induced order-disorder transitions up to 20 GPa. We propose that the first high-pressure phase above 5.0 GPa has the cubic defect spinel structure of α-In2S3 and the second high-pressure phase (ϕ-In2S3) above 10.5 GPa has a defect α-NaFeO2-type (R3m) structure. This phase, related to the NaCl structure, has not been previously observed in spinels under compression and is related to both the tetradymite structure of topological insulators and to the defect LiTiO2 phase observed at high pressure in oth…
Lattice dynamics of ZnAl2O4 and ZnGa2O4 under high pressure
2010
In this work we present a ¿rst-principles density functional study of the vibrational properties of ZnAl2 O4 and ZnGa2 O4 as function of hydrostatic pressure. Based on our previous structural characterization of these two compounds under pressure, herewith, we report the pressure dependence on both systems of the vibrational modes for the cubic spinel structure, for the CaFe2 O4-type structure (Pnma) in ZnAl2 O4 and for marokite (Pbcm) ZnGa2 O4. Additionally we report a second order phase transition in ZnGa2 O4 from the marokite towards the CaTi2 O4-type structure (Cmcm), for which we also calculate the pressure dependence of the vibrational modes at the ¿ point. Our calculations are comple…