Search results for "RAMAN"
showing 10 items of 1328 documents
Optical behavior of Eu3+-doped BaTiO3 nano-crystallites prepared by sol–gel method
2003
Abstract Eu 3+ -doped BaTiO 3 nano-crystallites with grain sizes 32–38 nm have been obtained by a sol–gel method. It has been found that the luminescence characteristics are strongly dependent on the sintering temperature. Powders sintered at temperatures below 1000 °C demonstrate a luminescence behavior at room temperature associated with a lack of the inversion symmetry of Eu 3+ sites. Above 1000 °C nano-crystallites undergo a phase transition characterized by an inversion symmetry of Eu 3+ sites. The size effect of Eu 3+ :BaTiO 3 nano-crystallites on luminescence characteristics is observed.
High-pressure monoclinic–monoclinic transition in fergusonite-type HoNbO4
2021
Abstract In this paper we perform a high-pressure (HP) study of fergusonite-type HoNbO4. Powder x-ray diffraction experiments and ab initio density-functional theory (DFT) simulations provide evidence of a phase transition at 18.9(1.1) GPa from the monoclinic fergusonite-type structure (space group I2/a) to another monoclinic polymorph described by space group P21/c. The phase transition is reversible and the HP structural behavior is different than the one previously observed in related niobates. The HP phase remains stable up to 29 GPa. The observed transition involves a change in the Nb coordination number from 4 to 6, and it is driven by mechanical instabilities. We have determined the …
Lattice dynamics study of nanocrystalline yttrium gallium garnet at high pressure
2014
This work reports an experimental and theoretical lattice dynamics study of nanocrystalline Y3Ga5O12 (YGG) garnet at high pressures. Raman scattering measurements in nanocrystalline Tm3+-doped YGG garnet performed up to 29 GPa have been compared to lattice dynamics ab initio calculations for bulk garnet carried out up to 89 GPa. Good agreement between the theoretical vibrational modes of bulk crystal and the experimental modes measured in the nanocrystals is found. The contribution of GaO4 tetrahedra and GaO6 octahedra to the different phonon modes of YGG is discussed on the basis of the calculated total and partial phonon density of states. Symmetries, frequencies, and pressure coefficient…
Pressure-induced phase transition in hydrothermally grown ZnO nanoflowers investigated by Raman and photoluminescence spectroscopy.
2015
This paper reports the pressure-dependent photoluminescence and Raman spectral investigation of hydrothermally synthesized ZnO nanoflowers at room temperature. Intrinsic near-band-edge UV emission from ZnO nanoflowers is monotonously blue-shifted under pressures up to 13.8 GPa with a pressure coefficient of 26 meV GPa(-1), and this pressure value is nearly 5 GPa above the transition pressure from the wurtzite to the rock salt phase for bulk ZnO. The Raman band corresponds to the wurtzite phase, the [Formula: see text] and [Formula: see text] modes were observed up to about 11 GPa from the spectra. The apparent discrepancy in the transition pressures as determined from photoluminescence and …
High-pressure behavior ofCaMoO4
2017
We report a high-pressure study of tetragonal scheelite-type $\mathrm{CaMo}{\mathrm{O}}_{4}$ up to 29 GPa. In order to characterize its high-pressure behavior, we have combined Raman and optical-absorption measurements with density functional theory calculations. We have found evidence of a pressure-induced phase transition near 15 GPa. Experiments and calculations agree in assigning the high-pressure phase to a monoclinic fergusonite-type structure. The reported results are consistent with previous powder x-ray-diffraction experiments, but are in contradiction with the conclusions obtained from earlier Raman measurements, which support the existence of more than one phase transition in the…
Low temperature structural transformations on the (001) surface of SrTiO 3 single crystals
2020
This work was supported by the Ministry of Education and Science of Ukraine under the contract M/51–2019 within the framework of the Program of Ukrainian–Latvian Scientific and Technical Cooperation and Latvian–Ukranian Grant LV-UA/2018/2. Authors are indebted to L.L. Rusevich, G. Zvejnieks, V.P. Gnezdilov and A. Glamazda for stimulating discussions.
Phase transition systematics in BiVO4 by means of high-pressure–high-temperature Raman experiments
2018
We report here high-pressure--high-temperature Raman experiments performed on ${\text{BiVO}}_{4}$. We characterized the fergusonite and scheelite phases (powder and single crystal samples) and the zircon polymorph (nanopowder). The experimental results are supported by ab initio calculations, which, in addition, provide the vibrational patterns. The temperature and pressure behavior of the fergusonite lattice modes reflects the distortions associated with the ferroelastic instability. The linear coefficients of the zircon phase are in sharp contrast to the behavior observed in the fergusonite phase. The boundary of the fergusonite-to-scheelite second-order phase transition is given by ${T}_…
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 …
Lattice dynamics of zircon-type NdVO4 and scheelite-type PrVO4 under high-pressure
2021
Abstract Zircon-type NdVO4 and scheelite-type PrVO4 have been studied by means of Raman spectroscopy up to approximately 20 GPa. In the first compound, zircon-scheelite and scheelite-fergusonite phase transitions are reported at 6.4(3) and 19.6(4) GPa, respectively. In the case of scheelite-type PrVO4, a reversible phase transition to a PbWO4-III structure is observed at 16.8(5) GPa. In both cases, a scheelite-type structure is recovered in a metastable state at low pressures. The pressure evolution of the Raman modes is also reported. Our experimental findings are supported by ab initio calculations, which allowed us to discuss the role of mechanic and dynamical instabilities in the phase …
High-pressure electronic structure and phase transitions in monoclinic InSe: X-ray diffraction, Raman spectroscopy, and density functional theory
2008
We have studied the crystal and electronic structure of monoclinic (MC) InSe under pressure finding a reversible phase transition to a ${\mathrm{Hg}}_{2}{\mathrm{Cl}}_{2}$-like tetragonal phase. The pressure evolution of the crystal structure was investigated by angle-dispersive x-ray diffraction and Raman spectroscopy in a diamond-anvil cell up to $30\phantom{\rule{0.3em}{0ex}}\mathrm{GPa}$. From the diffraction experiments, we deduced that MC InSe becomes gradually more symmetric under pressure, transforming the crystal structure into a tetragonal one at $19.4\ifmmode\pm\else\textpm\fi{}0.5\phantom{\rule{0.3em}{0ex}}\mathrm{GPa}$. This phase transition occurs without any volume change. Ra…