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Related papers: Cubic lead perovskite PbMoO3 with anomalous metall…

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The effect of doping Mo for Mn on the magnetic and transport properties of the colossal magnetoresistance material, La0.67Ba0.33MnO3, has been studied. Compounds of the series La0.67Ba0.33Mn1-xMoxO3 (x=0.0 to 0.1) have been prepared and…

Materials Science · Physics 2009-11-11 Darshan C. Kundaliya , Reeta Vij , R. G. Kulkarni , B. Varughese , A. K. Nigam , S. K. Malik

We present a high-pressure x-ray diffuse scattering study of the ABO$_3$ ferroelectric perovskites BaTiO_3 and KNbO_3. The well-known diffuse lines are observed in all the phases studied. In KNbO_3, we show that the lines are present up to…

Materials Science · Physics 2009-11-13 Sylvain Ravy , Jean-Paul Itie , Alain Polian , Michael Hanfland

The temperature dependent dielectric properties revealed re-entrant relaxor behaviour (Tm ~130 K and 210 K for 1 kHz) below a high temperature diffused phase transition, Tc ~270 K in lead cobalt niobate (PCN). Multiple positive/negative…

Materials Science · Physics 2018-10-30 Adityanarayan H. Pandey , Surya Mohan Gupta

Great success has been achieved in improving the photovoltaic energy conversion efficiency of the organic-inorganic perovskite-based solar cells, but with very limited knowledge on the thermal transport in hybrid perovskites, which would…

Materials Science · Physics 2016-03-02 Xin Qian , Xiaokun Gu , Ronggui Yang

Chalcogenide perovskites provide a promising avenue for non-toxic, stable thermoelectric materials. Here, thermal transport and thermoelectric properties of BaZrS$_3$ as a typical orthorhombic perovskite are investigated. An extremely low…

Materials Science · Physics 2023-12-14 Yu Wu , Ying Chen , Qiaoqiao Li , Kui Xue , Hezhu Shao , Hao Zhang , Liujiang Zhou

The incompatibility of partial d occupation on the perovskite B-site with the standard charge transfer mechanism for ferroelectricity has been a central paradigm in multiferroics research. Nevertheless, it was recently shown by density…

Materials Science · Physics 2013-05-29 Claude Ederer , Tim Harris , Roman Kovacik

The low frequency lattice vibrations and relaxations are investigated in single crystals of the four 3D hybrid organolead perovskites, MAPbBr$_3$, FAPbBr$_3$, MAPbI$_3$, and $\alpha$-FAPbI$_3$, at the Brillouin zone center using Raman and…

For the intrinsic carriers of MAPbBr$_{3}$, the temperature $T$ dependent mobility $\mu(T)$ of behaves like $\mu\propto T^{-1/2}$ in piezoelectric tetragonal phase, $\mu\propto T^{-1.4}$ in non-piezoelectric cubic phase. But for the…

Materials Science · Physics 2018-05-07 Ming-Hui Zhang , Ming-Liang Zhang

CsSnI3 is a promising eco-friendly solution for energy harvesting technologies. It exists at room temperature in either a black perovskite polymorph or a yellow 1D double-chain, which irreversibly deteriorates in the air. In this work, we…

Materials Science · Physics 2023-02-10 Lorenzo Monacelli , Nicola Marzari

We report sample preparation, structure, electrical resistivity, magnetic susceptibility and heat capacity studies of a new compound Yb$_2$Ir$_3$Ge$_5$. We find that this compound crystallizes in an orthorhombic structure with a space group…

Strongly Correlated Electrons · Physics 2009-11-10 Yogesh Singh , S. Ramakrishnan

We report a comprehensive investigation of the triple perovskite iridate Ba$_{3}$CoIr$_{2}$O$_{9}$. Stabilizing in the hexagonal $P6_{3}/mmc$ symmetry at room temperature, this system transforms to a monoclinic $C2/c$ symmetry at the…

Strongly Correlated Electrons · Physics 2021-02-03 Charu Garg , Deepak Roy , Martin Lonsky , Pascal Manuel , Antonio Cervellino , Jens Müller , Mukul Kabir , Sunil Nair

First-principles molecular dynamics simulations have been employed to analyze the proton diffusion in cubic BaZrO3 perovskite at 1300K, and a non-linear effect of an applied isometric strain of 2% on the lattice parameter has been observed.…

Materials Science · Physics 2020-07-30 Marco Fronzi , Yoshitaka Tateyama , Nicola Marzari , Enrico Traversa

The pure CsPbBr$_3$ perovskite is an archetypal example of a strongly anharmonic crystal that poses a major challenge for computational methods to describe its thermodynamic properties. Its lattice dynamics exhibits characteristics of a…

Mesoscale and Nanoscale Physics · Physics 2024-01-04 Jonathan Lahnsteiner , Max Rang , Menno Bokdam

A method for the calculation of the temperature dependence of dielectric and piezoelectric responses, based on the use of a first-principles effective Hamiltonian, is described. Results are presented for the ferroelectric perovskite PbTiO3.…

Materials Science · Physics 2009-10-31 Karin M. Rabe , Eric Cockayne

The structure of BaMg1/3Ta2/3O3 (BMT) has been studied using X-ray scattering. The phonons have been measured and the results are similar to those of other materials with the perovskite structure such as PbMg1/3Nb2/3O3 (PMN). The acoustic…

The symmetry was examined using neutron diffraction method on Pb(Zn1/3Nb2/3)O3 -9%PbTiO3 (PZN/9PT) which has a composition at the morphotropic phase boundary (MPB) between Pb(Zn1/3Nb2/3)O3 and PbTiO3. The results were compared with those of…

Using data obtained from first-principles calculations, we show that the position of the morphotropic phase boundary (MPB) and transition temperature at MPB in ferroelectric perovskite solutions can be predicted with quantitative accuracy…

Materials Science · Physics 2009-11-11 Ilya Grinberg , Matthew R. Suchomel , P. K. Davies , Andrew M. Rappe

Cooling oxygen-deficient strontium titanate to liquid-helium temperature leads to a decrease in its electrical resistivity by several orders of magnitude. The temperature dependence of resistivity follows a rough T$^{3}$ behavior before…

Strongly Correlated Electrons · Physics 2017-07-25 Xiao Lin , Carl Willem Rischau , Lisa Buchauer , Alexandre Jaoui , Benoit Fauque , Kamran Behnia

Information about the crystal structures in the range of morphotropic phase boundary of ferroelectric perovskite solid solutions is important for understanding their intricate properties which result in wide opportunities for practical…

Materials Science · Physics 2025-11-04 Alexei A. Bokov , Haiyan Guo , Zuo-Guang Ye

A review is given of recent neutron and x-ray scattering studies of the lead-oxide perovskite relaxor systems Pb(Zn1/3Nb2/3)O3-xPbTiO3 and Pb(Mg1/3Nb2/3)O3-xPbTiO3. X-ray measurements by Noheda et al. have established that these two systems…

Strongly Correlated Electrons · Physics 2007-05-23 G. Shirane , Guangyong Xu , P. M. Gehring