Unified approach for determining tetragonal tungsten bronze crystal structures

2014 ◽  
Vol 70 (3) ◽  
pp. 283-290 ◽  
Author(s):  
M. Smirnov ◽  
P. Saint-Grégoire
Keyword(s):  
Experimental Data ◽  
Crystal Structures ◽  
Tungsten Bronze ◽  
Unified Approach ◽  
Tetragonal Tungsten Bronze ◽  
Theoretical Predictions ◽  
Rigid Unit Modes

Tetragonal tungsten bronze (TTB) oxides are one of the most important classes of ferroelectrics. Many of these framework structures undergo ferroelastic transformations related to octahedron tilting deformations. Such tilting deformations are closely related to the rigid unit modes (RUMs). This paper discusses the whole set of RUMs in an ideal TTB lattice and possible crystal structures which can emerge owing to the condensation of some of them. Analysis of available experimental data for the TTB-like niobates lends credence to the obtained theoretical predictions.

Incommensurate modulation of calcium barium niobate (CBN28 and Ce:CBN28)

2012 ◽  
Vol 68 (2) ◽  
pp. 101-106 ◽  
Author(s):  
Heribert A. Graetsch ◽  
Chandra Shekhar Pandey ◽  
Jürgen Schreuer ◽  
Manfred Burianek ◽  
Manfred Mühlberg
Keyword(s):  
Crystal Structures ◽  
Tungsten Bronze ◽  
Atomic Displacement ◽  
Type Structure ◽  
Formula Unit ◽  
Tetragonal Tungsten Bronze ◽  
First Order ◽  
Oxygen Coordination ◽  
Incommensurate Modulation ◽  
Atomic Displacement Parameters

The incommensurately modulated crystal structures of Ca0.28Ba0.72Nb2O6 (CBN28) and Ce0.02Ca0.25Ba0.72Nb2O6 (Ce:CBN28) were refined in the supercentred setting X4bm(AA0,−AA0) of the 3 + 2-dimensional superspace group P4bm(aa½,−aa½). Both compounds are isostructural with a tetragonal tungsten bronze-type structure. The modulation of CBN28 consists of a wavy distribution of Ba and Ca atoms as well as vacancies on the incompletely occupied Me2 site with 15-fold oxygen coordination. The occupational modulation is coupled with a modulation of the atomic displacement parameters and a very weak modulation of the positional parameters of Me2. The surrounding O atoms show strong displacive modulations with amplitudes up to ca 0.2 Å owing to the cooperative tilting of the rigid NbO6 octahedra. The Me1 site with 12-fold coordination and Nb atoms are hardly affected by the modulations. Only first-order satellites were observed and the modulations are described by first-order harmonics. In Ce:CBN28 cerium appears to be located on both the Me2 and Me1 sites. Wavevectors and structural modulations are only weakly modified upon substitutional incorporation of 0.02 cerium per formula unit of calcium.

Structural studies by high-resolution electron microscopy: intergrowth of ReO3 and tetragonal tungsten bronze-type structures in the system Nb2O5–WO3

1978 ◽  
Vol 34 (6) ◽  
pp. 922-931 ◽  
Author(s):  
S. Iijama
Keyword(s):  
Electron Microscopy ◽  
High Resolution ◽  
Binary System ◽  
Crystal Structures ◽  
Tungsten Bronze ◽  
High Resolution Electron Microscopy ◽  
Host Lattice ◽  
Structural Studies ◽  
Tetragonal Tungsten Bronze ◽  
Resolution Electron

With high-resolution electron microscopy new crystal structures were found in the binary system of Nb2O5WO3 oxides. The compounds are proposed to have the mole ratios 4Nb2O5. 22WO3 and 4Nb2O5. 50WO3. The crystal structures are ascribed to intimate intergrowths of two known structures, the ReO3 type and tetragonal tungsten bronze type. The latter grows coherently in the host lattice of the former, forming regularly arranged slabs. The coherent intergrowth of the tetragonal tungsten bronze structures is described as the 'rotation operation' on the ReO3-type structure.

scholarly journals Atomic resolution imaging of cation ordering in niobium–tungsten complex oxides

2021 ◽  
Vol 2 (1) ◽  
Author(s):  
Sumio Iijima ◽  
Wenhui Yang ◽  
Syo Matsumura ◽  
Ichiro Ohnishi
Keyword(s):  
Crystal Structures ◽  
Tungsten Bronze ◽  
Lithium Ion ◽  
Atomic Resolution ◽  
Energy Storage Materials ◽  
Cation Ordering ◽  
Tetragonal Tungsten Bronze ◽  
X Ray ◽  
Scanning Transmission ◽  
Complex Metal Oxide

AbstractEnergy dispersive X-ray emission imaging at atomic resolution is a powerful tool to solve order–disorder problems in complex metal oxide crystals, supplementing conventional X-ray or neutron diffraction. Here, we use this method, based on scanning transmission electron microscopy, to investigate cation ordering in ternary metal oxides 4Nb2O5·9WO3 and 2Nb2O5·7WO3, which have recently attracted attention as energy storage materials in lithium-ion batteries. Their crystal structures are a tetragonal tungsten bronze-type and its hybrid with a ReO3-type ‘block structure’, respectively. Our study reveals the presence of chemical ordering of metal ions in these materials, which have previously been assumed to be solid-solutions. In particular, we show that the two types of cations, Nb and W, are well ordered in their lattices, and that the Nb ions tend to occupy one third of the pentagonal channel sites. These results demonstrate that atomic resolution X-ray emission imaging is an effective alternative approach for the study of locally ordered crystal structures.

Epitaxial Growth of Sr0.3Ba0.7Nb2O6 Thin Films Prepared by Sol-Gel Process

1999 ◽  
Vol 606 ◽  
Author(s):  
Keishi Nishio ◽  
Jirawat Thongrueng ◽  
Yuichi Watanabe ◽  
Toshio Tsuchiya
Keyword(s):  
Thin Film ◽  
Thin Films ◽  
Epitaxial Growth ◽  
Raw Materials ◽  
Substrate Surface ◽  
Sol Gel ◽  
Tungsten Bronze ◽  
Monomethyl Ether ◽  
Tetragonal Tungsten Bronze ◽  
Sol Gel Process

AbstructWe succeeded in the preparation of strontium-barium niobate (Sr0.3Ba0.7Nb2O6 : SBN30)that have a tetragonal tungsten bronze type structure thin films on SrTiO3 (100), STO, or La doped SrTiO3 (100), LSTO, single crystal substrates by a spin coating process. LSTO substrate can be used for electrode. A homogeneous coating solution was prepared with Sr and Ba acetates and Nb(OEt)5 as raw materials, and acetic acid and diethylene glycol monomethyl ether as solvents. The coating thin films were sintered at temperature from 700 to 1000°C for 10 min in air. It was confirmed that the thin films on STO substrate sintered above 700°C were in the epitaxial growth because the 16 diffraction spots were observed on the pole figure using (121) reflection. The <130> and <310> direction of the thin film on STO were oriented with the c-axis in parallel to the substrate surface. However, the diffraction spots of thin film on LSTO substrate sintered at 700°C were corresponds to the expected pattern for (110).

Tetragonal Tungsten Bronze Type Sn(II)-Based Quaternary Oxides: A New Type of Visible-Light-Absorbing Semiconductors for Photoelectrochemical Water Oxidation

2021 ◽  
Author(s):  
Yalong Zou ◽  
Jiabo Le ◽  
Yufeng Cao ◽  
Na An ◽  
Yang Zhou ◽  
...  
Keyword(s):  
Visible Light ◽  
Water Oxidation ◽  
Tungsten Bronze ◽  
Complex Oxides ◽  
Tetragonal Tungsten Bronze ◽  
Visible Light Absorption ◽  
New Type ◽  
Hydrogen Fuels ◽  
Photoelectrochemical Water Oxidation ◽  
Pec Water Splitting

The attractive photoelectrochemical (PEC) water splitting for hydrogen fuels always desires new semiconductors which provide stronger visible light absorption with suitable band positions. Sn(II) complex oxides are expected to offer...

scholarly journals An Additive Model to Predict the Rheological and Mechanical Properties of Polypropylene Blends Made by Virgin and Reprocessed Components

Recycling ◽  
2021 ◽  
Vol 6 (1) ◽  
pp. 2
Author(s):  
Francesco Paolo La Mantia ◽  
Maria Chiara Mistretta ◽  
Vincenzo Titone
Keyword(s):  
Experimental Data ◽  
Mechanical Properties ◽  
Additive Model ◽  
Industrial Process ◽  
Theoretical Predictions ◽  
Experimental Values ◽  
Polypropylene Blends ◽  
Polypropylene Sample

In this work, an additive model for the prediction of the rheological and mechanical properties of monopolymer blends made by virgin and reprocessed components is proposed. A polypropylene sample has been reprocessed more times in an extruder and monopolymer blends have been prepared by simulating an industrial process. The scraps are exposed to regrinding and are melt reprocessed before mixing with the virgin polymer. The reprocessed polymer is, then, subjected to some thermomechanical degradation. Rheological and mechanical experimental data have been compared with the theoretical predictions. The results obtained showed that the values of this simple additive model are a very good fit for the experimental values of both rheological and mechanical properties.

Intergrowth of niobium tungsten oxides of the tetragonal tungsten bronze type

2020 ◽  
Vol 75 (11) ◽  
pp. 913-919
Author(s):  
Frank Krumeich
Keyword(s):  
Electron Microscopy ◽  
Transmission Electron Microscopy ◽  
Tungsten Bronze ◽  
Structural Complexity ◽  
Dark Field ◽  
Tetragonal Tungsten Bronze ◽  
Tungsten Oxides ◽  
Transmission Electron ◽  
Scanning Transmission

AbstractSince the 1970s, high-resolution transmission electron microscopy (HRTEM) is well established as the most appropriate method to explore the structural complexity of niobium tungsten oxides. Today, scanning transmission electron microscopy (STEM) represents an important alternative for performing the structural characterization of such oxides. STEM images recorded with a high-angle annular dark field (HAADF) detector provide not only information about the cation positions but also about the distribution of niobium and tungsten as the intensity is directly correlated to the local scattering potential. The applicability of this method is demonstrated here for the characterization of the real structure of Nb7W10O47.5. This sample contains well-ordered domains of Nb8W9O47 and Nb4W7O31 besides little ordered areas according to HRTEM results. Structural models for Nb4W7O31 and twinning occurring in this phase have been derived from the interpretation of HAADF-STEM images. A remarkable grain boundary between well-ordered domains of Nb4W7O31 and Nb8W9O47 has been found that contains one-dimensionally periodic features. Furthermore, short-range order observed in less ordered areas could be attributed to an intimate intergrowth of small sections of different tetragonal tungsten bronze (TTB) based structures.

A Technique for the Laboratory Determination of Recirculation in Single Needle Dialysis

1993 ◽  
Vol 16 (2) ◽  
pp. 63-70 ◽  
Author(s):  
N.A. Hoenich ◽  
P.T. Smirthwaite ◽  
C. Woffindin ◽  
P. Lancaster ◽  
T.H. Frost ◽  
...  
Keyword(s):  
Experimental Data ◽  
Flow Rate ◽  
Experimental Results ◽  
New Technique ◽  
Treatment Efficiency ◽  
Single Lumen ◽  
Theoretical Predictions ◽  
Lumen Catheter ◽  
A New Technique

Recirculation is an important factor in single needle dialysis and, if high, can compromise treatment efficiency. To provide information regarding recirculation characteristics of access devices used in single needle dialysis, we have developed a new technique to characterise recirculation and have used this to measure the recirculation of a Terumo 15G fistula needle and a VasCath SC2300 single lumen catheter. The experimentally obtained results agreed well with those established clinically (8.5 ± 2.4% and 18.4 ± 3.4%). The experimental results have also demonstrated a dependence on access type, pump speeds and fistula flow rate. A comparison of experimental data with theoretical predictions showed that the latter exceeded those measured with the largest contribution being due to the experimental fistula.

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