Search results for "RAMAN"
showing 10 items of 1328 documents
Optical and structural study of the pressure-induced phase transition of CdWO$_4$
2017
Physical review / B 95(17), 174105 (2017). doi:10.1103/PhysRevB.95.174105
Phase transitions in wolframite-typeCdWO4at high pressure studied by Raman spectroscopy and density-functional theory
2009
Room-temperature Raman scattering was measured in ${\text{CdWO}}_{4}$ up to 43 GPa. We report the pressure dependence of all the Raman-active phonons of the low-pressure wolframite phase. As pressure increases changes in the Raman spectra are detected at 20 and 35 GPa due to the onset of reversible structural phase transitions. We also report ab initio total-energy and lattice-dynamics calculations for the different phases of ${\text{CdWO}}_{4}$. They helped us determine the crystalline structure of the high-pressure phases. Experimental and theoretical results suggest the coexistence of two structures from 20 to 35 GPa: one with tetragonal symmetry and another with triclinic symmetry. Beyo…
Lattice dynamics ofYVO4at high pressures
2010
We report an experimental and theoretical lattice-dynamics study of yttrium orthovanadate $({\text{YVO}}_{4})$ up to 33 GPa together with a theoretical study of its structural stability under pressure. Raman-active modes of the zircon phase are observed up to 7.5 GPa, where the onset of an irreversible zircon-to-scheelite phase transition is detected, and Raman-active modes in the scheelite structure are observed up to 20 GPa, where a reversible second-order phase transition occurs. Our ab initio total-energy calculations support that the second-order phase transition in ${\text{YVO}}_{4}$ is from the scheelite to the monoclinic M-fergusonite structure. The M-fergusonite structure remains u…
Putting the Squeeze on Lead Chromate Nanorods.
2019
We have studied by means of X-ray diffraction and Raman spectroscopy the high-pressure behavior of PbCrO4 nanorods. We have found that these nanorods follow a distinctive structural sequence that differs from that of bulk PbCrO4. In particular, a phase transition from a monoclinic monazite-type PbCrO4 to a novel monoclinic AgMnO4-type polymorph has been discovered at 8.5 GPa. The crystal structure, Raman-active phonons, and compressibility of this novel high-pressure phase are reported for the first time. The experimental findings are supported by ab initio calculations that provide information not only on structural and vibrational properties of AgMnO4-type PbCrO4 but also on the electroni…
Experimental and theoretical study on the optical properties of LaVO4 crystals under pressure
2018
We report optical absorption and luminescence measurements in pure and trivalent neodymium (Nd3+) doped LaVO4 crystals up to 25 GPa. Nd3+ luminescence has been employed as a tool to follow the structural changes in the crystal. We also present band-structure and crystal-field calculations that provide the theoretical framework to accurately explain the observed experimental results. In particular, both optical absorption and luminescence measurements evidence that a phase transition takes place close to 12 GPa. They also provide information on the pressure dependence of the band-gap as well as the emission lines under compression. We found drastic changes in the optical properties of LaVO4 …
Structural transitions under high-pressure in a langasite-type multiferroic Ba3TaFe3Si2O14
2015
Abstract The iron containing langasite family compound Ba3Ta57Fe3Si2O14 was studied at high pressure up to 30 GPa at room temperature by means of in situ X-ray diffraction, Raman and Mossbauer spectroscopies in diamond anvil cell. Two structural transitions at pressures ∼5 and ∼20 GPa are observed. At ∼5 GPa, the low-pressure trigonal P321 phase undergoes phase transition to the most likely P3 structure as manifested by slight increase in the c/a ratio and by anomalies of the Mossbauer and Raman spectra parameters. At ∼20 GPa, the first order phase transition to monoclinic structure occurred with a drop of unit cell volume by 9%. The appearance of the ferroelectric state at such transitions…
Experimental and theoretical study of dense YBO3 and the influence of non-hydrostaticity.
2021
[EN] YBO3 is used in photonics applications as a host for red phosphors due to its desirable chemical stability, high quantum efficiency and luminescence intensity. Despite its fundamental thermodynamic nature, the isothermal bulk modulus of YBO3 has remained a contentious issue due to a lack of comprehensive experimental and theoretical data and its vibrational modes are far from being understood. Here, we present an experimental-theoretical structural and vibrational study of YBO3. From structural data obtained from synchrotron X-ray diffraction data and ab initio calculations, we have determined the YBO3 bulk modulus, isothermal compressibility tensor and pressure-volume (P-V) equation o…
Cyano-bridged perovskite [(CH3)3NOH]2[KM(CN)6],[M: Fe(III), Co(III)] for high-temperature multi-axial ferroelectric applications with enhanced therma…
2020
Highly stable ferroelectrics with reversible high-temperature phase transitions and switchable nonlinear optical behaviour are much coveted targets for emerging optoelectronic applications. Here, we demonstrate a cyano-bridged perovskite [(CH3)3NOH]2[KCo(CN)6] (TMAO-Co), a new analogue of the multi-axial ferroelectric [(CH3)3NOH]2[KFe(CN)6] (TMAO-Fe) with improved thermal stability and enhanced second-order nonlinear optical response. Indeed, for TMAO-Co the Curie temperature (Tc) is shifted to a higher value of ca. 416 K (improvement by ca. 10 K versusTMAO-Fe); the separation between Tc and the decomposition threshold is 46 K. TMAO-Co is a biaxial ferroelectric as revealed by P(E) hysteres…
Phase transitions and upconversion luminescence in oxyfluoride glass ceramics containing Ba4Gd3F17 nanocrystals
2017
This is the peer reviewed version of the following article: G. Krieke, A. Sarakovskis, R. Ignatans, J. Gabrusenoks "Phase transitions and upconversion luminescence in oxyfluoride glass ceramics containing Ba4Gd3F17 nanocrystals", Journal of the European Ceramic Society, 2017, 37 (4), which has been published in final form at https://www.sciencedirect.com/science/article/abs/pii/S0955221916306768 This article may be used for non-commercial purposes in accordance with Elsevier Terms and Conditions for Sharing and Self-Archiving.
Pressure-induced structural evaluation and insulator-metal transition in the mixed spinel ferrite Zn0.2Mg0.8Fe2O4
2017
The effect of pressure on the electronic properties and crystal structure in a mixed spinel ferrite $\mathrm{Z}{\mathrm{n}}_{0.2}\mathrm{M}{\mathrm{g}}_{0.8}\mathrm{F}{\mathrm{e}}_{2}{\mathrm{O}}_{4}$ was studied for the first time up to 48 GPa at room temperature using x-ray diffraction, Raman spectroscopy, and electrical transport measurements. The sample was cubic (spinel-type $Fd\overline{3}m$) at ambient pressure and underwent a pressure-induced structural transition to an orthorhombic phase $(\mathrm{CaT}{\mathrm{i}}_{2}{\mathrm{O}}_{4}\ensuremath{-}\mathrm{type}\phantom{\rule{0.16em}{0ex}}Bbmm)$ at 21 GPa. This structural transformation corresponded to a first-order phase transition …