Further Investigation of the Basic Structure of Metastable Mn3Bi by High Resolution Electron Microscopy and Its Computer Simulation

1988 ◽  
Vol 02 (06) ◽  
pp. 835-839 ◽  
Author(s):  
M. HERVIEU ◽  
B. DOMENGES ◽  
C. MICHEL ◽  
B. RAVEAU

The new superconductor Bi 2 Sr 2 CaCu 2 O 8+δ with T c ranging from 80 to 105K, was studied by electron microscopy. The electron diffraction study shows a pseudo-tetragonal symmetry with a≈b≈5.4 Å and c≈30.7 Å and satellites along a, which settle in an incommensurate way. The high resolution images agree with the proposed basic structure. The stacking of the ( BiO y)2 and [ Sr 2 CaCu 2 O 6] layers is quite regular, with only some defects corresponding to c≈24 Å. The lamellar character of the oxide results in splitting and bending of the crystals.


Author(s):  
R. Csencsits

High resolution electron microscopy (HREM) is a valuable technique for studying catalytic zeolite systems because it gives direct information about the structure and defects present in the structure. The difficulty with doing an HREM study on zeolites is that they become amorphous under electron irradiation. This work is a systematic investigation of the damage of Y zeolites in the transmission electron microscope (TEM); the goals of this study are to determine the mechanism for electron damage and to access the effects of damage in Y zeolites on their HREM images using computer simulation.


2001 ◽  
Vol 16 (6) ◽  
pp. 1806-1813 ◽  
Author(s):  
J. C. Rao ◽  
Y. Zhou ◽  
D. X. Li

Y0.25Zr0.75O2−x and Y0.5Zr0.5O2−y phases, with L12- and L10- like cation-ordered structures, respectively, have been found in ZrO2–Y2O3 ceramics in both the sintered and annealed states. High-resolution electron microscopy, energy-dispersive x-ray spectroscopy and computer simulation have been used to reveal the presence of the phases. The formation of Y0.25Zr0.75O2−x and Y0.5Zr0.5O2−y phases was initiated during the sintering procedure and developed with the increase in annealing temperature and time. Segregation of yttrium, which was prevalent in different regions even within one grain, induced the formation of Y0.25Zr0.75O2−x and Y0.5Zr0.5O2−y phases.


1994 ◽  
Vol 357 ◽  
Author(s):  
Yaping Liu ◽  
Imtiaz Majid ◽  
John B. Vander Sande

AbstractThe atomic structure of [001] tilt grain boundaries of Σ25 (210), Σ5 (310), Σ213 (320) and Σ217 (410) in TiO2 (rutile) were studied using high resolution electron microscopy and computer simulation. Regularly separated small steps (1/2 [120] high) and big steps (3/2 [120] high) which contain secondary dislocations were found in the (210) boundary as a result of deviation from the exact Σ5 misorientation and (210) symmetric plane. Similar steps were also found in (310) and (320) boundaries. Flat segments between the steps were found to have very accurate misorientation of their, Σ's and a nearly symmetric boundary plane. Their rigid body translation, volume expansion and relaxed structures were determined by comparing HRTEM images with computer calculated structures and simulated images. An irregular core structure was found in the (410) boundary when its misorientation deviated 2° from the exact Σ17 misorientation.


Author(s):  
Yimei Zhu ◽  
M. Pan ◽  
Z.G. Li ◽  
M. Suenaga ◽  
D. Welch

A shear displacement at the twin boundary in YBa2Cu3O7 superconductor has been observed by means of High Resolution Electron Microscopy. It was found that the a and b planes across the twin boundary are shifted along the boundary by a distance of (1/3 ∼ 1/2) · 2d110. In order to confirm our observation and give an optimum interpretation of the HREM image, computer simulation of the twin structure in YBa2Cu3O7 was carried out.A large supercell, 81.72×21.72×11.70 Å, with a total of 1492 atoms was constructed to simulate the twin structure. The twin boundary is modeled not only by a rotation of the planes in one domain with respect to the adjacent domain by an angle of 90° - ϕ (ϕ≈0.967°) but also by a translation (R= 1/3•2d110) along the boundary. In addition, in order to simulate the diffused boundary, boundary steps in and directions as shown in Fig.1(d) were introduced.


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