Abstract:Lanthanum gallate (LaGaO 3 ) is known to undergo orthorhombic to rhombohedral first order phase transition at 150 8C. In this article we have shown that by introducing 2% La deficiency in the system, coexistence of above two phases can be obtained at lower temperature and a complete phase transition occurs at 200 8C. The evolution of structural parameters of the system with temperature is reported from X-ray diffraction measurements and Rietveld analysis of the diffraction patterns. The change in local octahed… Show more
“…The sequence of structural phase transitions from a low temperature phase in Pbnm to a higher temperature phase in F32=n is not without precedent, having being found in BaCeO 3 [25,26] and BaPrO 3 [27], but in both of these cases, it occurs via a continuous phase transition to an intermediate phase in space group Ibnn. Despite the large number of crystallographic studies of the Pbnm to F32=n phase transition in LaGaO 3 [1,[7][8][9]11,12,[14][15][16][17][18][19] none have been carried out in sufficiently fine enough temperature intervals to ascertain whether an intermediate phase exists in this system.…”
Section: Introductionmentioning
confidence: 99%
“…The first order structural phase transition in LaGaO 3 , from orthorhombic Pbnm (Pnma in standard setting) to rhombohedral F32=n (R3c in standard setting) has been the subject of numerous studies in recent years [3][4][5][6][7][8][9][10][11][12][13][14][15][16][17][18][19][20][21]. We make this choice of the rhombohedral space group setting as it allows ease of comparison with both the aristotype and hettotype phases of perovskitestructured phases that is not immediately apparent from the more commonly used primitive rhombohedral, or triply-primitive hexagonal settings.…”
“…The sequence of structural phase transitions from a low temperature phase in Pbnm to a higher temperature phase in F32=n is not without precedent, having being found in BaCeO 3 [25,26] and BaPrO 3 [27], but in both of these cases, it occurs via a continuous phase transition to an intermediate phase in space group Ibnn. Despite the large number of crystallographic studies of the Pbnm to F32=n phase transition in LaGaO 3 [1,[7][8][9]11,12,[14][15][16][17][18][19] none have been carried out in sufficiently fine enough temperature intervals to ascertain whether an intermediate phase exists in this system.…”
Section: Introductionmentioning
confidence: 99%
“…The first order structural phase transition in LaGaO 3 , from orthorhombic Pbnm (Pnma in standard setting) to rhombohedral F32=n (R3c in standard setting) has been the subject of numerous studies in recent years [3][4][5][6][7][8][9][10][11][12][13][14][15][16][17][18][19][20][21]. We make this choice of the rhombohedral space group setting as it allows ease of comparison with both the aristotype and hettotype phases of perovskitestructured phases that is not immediately apparent from the more commonly used primitive rhombohedral, or triply-primitive hexagonal settings.…”
“…[2][3][4][5][6][7] As a case, the orthorhombic (Pnma) LaGaO3 transforms to a rhombohedral (R3 � c) structure at 150°C as well as at 2.5 GPa. 7,8 On the contrary, the cubic perovskite-type fluorides BaLiF3 and KMgF3 remain stable up to significantly higher pressure, viz > 40 GPa. 9, 10 4 On the other hand, although a number of structural studies on orthorhombic perovskites have been reported in the literature, the structural transitions are not unique.…”
The effects of high pressure on the crystal structure of orthorhombic (Pnma) perovskite-type cerium scandate were studied in situ under high pressure by means of synchrotron X-ray powder diffraction, using a diamond-anvil cell. We found that the perovskite-type crystal structure remains stable up to 40 GPa, the highest pressure reached in the experiments. The evolution of unit-cell parameters with pressure indicated an anisotropic compression. The room-temperature pressure-volume equation of state (EOS) obtained from the experiments indicated the EOS parameters V = 262.5(3) Å, B = 165(7) GPa, and B' = 6.3(5). From the evolution of microscopic structural parameters like bond distances and coordination polyhedra of cerium and scandium, the macroscopic behavior of CeScO under compression was explained and reasoned for its large pressure stability. The reported results are discussed in comparison with high-pressure results from other perovskites.
“…In the present case the tilt angles were calculated from the observed Sc-O-Sc bond angles according to the methods reported in the literature. 27,28 The tilt angles θ, φ and ϕ for ambient temperature orthorhombic CeScO 3 are 18.3°, 8.7°, and 20.2°, respectively. The representative tilt angles ϕ about the (111) p axis for PrScO 3 , Pr 0.75 Ce 0.25 ScO 3 , Pr 0.5 Ce 0.5 ScO 3 , Pr 0.25 Ce 0.75 ScO 3 and CeScO 3 were 19.9°, 20.6°, 19.8°, 19.3°and 20.2°, respectively.…”
A new series of Pr1-xCexScO3 (0.0 ≤x≤ 1.0) compounds was synthesized by a two-step synthesis route, involving a combustion reaction followed by reduction while heating in a low partial pressure of O2, generated by a zirconium sponge that acts as an oxygen getter. For the first time, perovskite solid solution formation was observed in this series in the entire homogeneity range. These compounds were characterized using XRD, Raman spectroscopy and DRUV-visible spectroscopy. Rietveld refinement was carried out on the XRD data to determine unit cell parameters, bond lengths, bond angles along with the tilt angles for ScO6 octahedra. The analyses of the Raman shift were also in agreement with the XRD data. All compounds in this series showed a decreasing trend in the bandgap from 4.74 to 2.91 eV as a function of increasing Ce(3+) concentration.
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