Three-dimensional visualization of the inner structure of single crystals by step-scanning white X-ray section topography

2006 ◽  
Vol 13 (6) ◽  
pp. 484-488 ◽  
Author(s):  
Taihei Mukaide ◽  
Kentaro Kajiwara ◽  
Takashi Noma ◽  
Kazuhiro Takada
2019 ◽  
Vol 74 (5) ◽  
pp. 443-449 ◽  
Author(s):  
Birgit Heying ◽  
Jutta Kösters ◽  
Rainer Pöttgen

AbstractRod-shaped single crystals of Sr4Pt10In21were prepared from the elements in glassy-carbon crucibles in a high-frequency furnace. The structure of Sr4Pt10In21was refined from single-crystal X-ray diffractometer data:C2/m, Ho4Ni10Ga21type,a = 2322.62(7),b = 450.27(2),c = 1958.09(7) pm,β = 133.191(3)°,wR = 0.0464, 3200F2values and 107 variables. The three-dimensional [Pt10In21]δ−polyanionic network is stabilized through substantial Pt–In (269–313 pm Pt–In) and In–In (294–362 pm In–In) bonding. All platinum atoms have slightly distorted tri-capped trigonal prismatic coordination and the two crystallographically independent strontium atoms are located in penta-capped pentagonal prisms.


1995 ◽  
Vol 50 (4) ◽  
pp. 577-580 ◽  
Author(s):  
H. Szillat ◽  
Hk. Müller-Buschbaum

Single crystals of (Cu0.22Mg0.78)BaNd2Mo4O16 have been prepared by crystallization from melts and investigated by X-ray methods. The compound crystallizes monoclinically, space group C62h - C12/c1, Z = 4, a = 5.351(1), b = 12.891(2), c = 19.391(4) Å,β = 90.899(14)° and is isotypic to CuKHo2Mo4O16. The crystal structure is dominated by BaO10 and NdO8 polyhedra forming a three-dimensional polyhedra network, which is filled by axially distorted (Cu,Mg)O6 octahedra and MoO4 tetrahedra.


2006 ◽  
Vol 985 ◽  
Author(s):  
Tori Z. Forbes ◽  
Peter C. Burns ◽  
L. Soderholm ◽  
S. Skanthakumar

AbstractSingle crystals of Np2O5 have been synthesized by low-temperature hydrothermal reaction of a Np5+ stock solution with natural calcite crystals. The structure of Np2O5 was solved by direct methods and refined on the basis of F2 for all unique data collected on a Bruker X-ray diffractometer equipped with an APEX II CCD detector. Np2O5 is monoclinic, space group P2/c, with a = 8.168(2) Å, b = 6.584(1) Å, c = 9.3130(2) Å, β = 116.01(1)˚, V = 449.8(2) Å3, and Z = 1. The structure contains chains of edge-sharing neptunyl pentagonal bipyramids linked into sheets through cation-cation interactions with distorted neptunyl square bipyramids. Additional cation-cation interactions connect the sheets into a three-dimensional framework. The formation of Np2O5 on the surface of calcite crystals has important implications for the precipitation of isolated neptunyl phases in natural aqueous systems.


2006 ◽  
Vol 61 (2) ◽  
pp. 159-163 ◽  
Author(s):  
Rainer Kraft ◽  
Sudhindra Rayaprol ◽  
C. Peter Sebastian ◽  
Rainer Pöttgen

AbstractThe new thallide EuPdTl2, synthesized from the elements in a sealed tantalum tube in a highfrequency furnace, was investigated by X-ray diffraction on powders and single crystals: MgCuAl2 type, Cmcm, Z = 4, a = 446.6(1), b = 1076.7(2), c = 812.0(2) pm, wR2 = 0.0632, 336 F2 values, 16 variables. The structure can be considered as an orthorhombically distorted, palladium-filled variant of the binary Zintl phase EuTl2. The palladium and thallium atoms build up a three-dimensional [PdTl2] polyanion with significant Pd-Tl (286 - 287 pm) and Tl-Tl (323 - 329 pm) interactions. The europium atoms fill distorted hexagonal channels of the [PdTl2] polyanion. Susceptibility measurements show a magnetic moment of 7.46(5) μB/Eu atom, indicative of divalent europium. EuPdTl2 is a soft ferromagnet with a Curie temperature of TC = 12.5(5) K.


1993 ◽  
Vol 307 ◽  
Author(s):  
S. Wang ◽  
M. Dudley ◽  
L. K. Cheng ◽  
J. D. Bierlein

ABSTRACTDefect structures in large, high quality flux-grown KTP single crystals have been studied by using synchrotron white beam X-ray topography. Growth dislocations, inclusions, growth sector boundaries, growth bands and surface micro-scratches were imaged. A number of planar defects in the dislocation-free region are imaged and determined to be inversion twin lamellae (lamellar ferroelectric domains) which have never been previously reported in KTP crystals. These inversion twin lamellae were also studied by section topography. Detailed analysis of observed contrast revealed that the domain walls bounding the lamellae are faulted with a fault vector of ½[0±1±1]. This fault vector seems to be consistent with the atomic structure of KTP. A detailed analysis is presented and discussed.


2016 ◽  
Vol 49 (6) ◽  
pp. 2053-2062 ◽  
Author(s):  
Harsh Yadav ◽  
Nidhi Sinha ◽  
Sahil Goel ◽  
Abid Hussain ◽  
Binay Kumar

Large single crystals of the promising molecular organic ferroelectric diisopropylammonium bromide (DIPAB) have been grown by the solution technique. A structural study was performed using single-crystal X-ray diffraction analysis. The twin element of a selected DIPAB crystal was identified by a morphological study. Intermolecular interactions present in the grown crystal were explored by Hirshfeld surface (three-dimensional) and fingerprint plot (two-dimensional) studies. In UV–vis spectroscopy, the DIPAB crystal has shown high transparency with a wide direct band gap of 5.65 eV. In the photoluminescence spectrum, sharp UV and blue emissions were observed at 370, 392, 417 and 432 nm. The electrical properties were investigated by measuring the dielectric constant (∊) and loss (tanδ) of the grown crystal. The DIPAB crystal exhibits a promising piezoelectric charge coefficient (d33) value of 18 pC N−1, which makes it suitable for transducer applications. A high ferroelectric Curie temperature (Tc≃ 425 K) with high remnant polarization (20.52 µC cm−2) and high coercive field (12.25 kV cm−1) were observed in the as-grown crystal. Vickers microhardness analysis shows that the value of Meyer's index (n= 7.27) belongs to the soft material range, which was also confirmed by void analysis along three crystallographic axes. It is shown that the DIPAB crystal has potential for optical, ferroelectric and piezoelectric applications.


2000 ◽  
Vol 14 (29n31) ◽  
pp. 3656-3661 ◽  
Author(s):  
N. L. SAINI ◽  
A. LANZARA ◽  
K. B. GARG ◽  
A. BIANCONI ◽  
T. ITO ◽  
...  

Cu K-edge XANES spectroscopy has been used to study local structure around the Cu-site in three-dimensional oxygen deficient perovkite La 8- x Sr x Cu 8 O 20 system. The combination of E//ab and E//c polarization and high resolution XANES spectra on high quality single crystals has allowed us to distinguish the various features associated with the complex Cu-O networks in the system which have then been compared with those of the La 2- x Sr x CuO 4 system.


1996 ◽  
Vol 51 (6) ◽  
pp. 806-810 ◽  
Author(s):  
Rainer Pöttgen

Abstract EuPdSn and EuPtSn were prepared from the elements in tantalum tubes at 1070 K and investigated by X-ray diffraction on both powder as well as single crystals. They crystallize with the TiNiSi type structure of space group Pnma and with Z = 4 formula units per cell. Both structures were refined from single-crystal diffractometer data: a = 751.24(9), b = 469.15(6), c = 804.31(9) pm, V = 0.2835(1) nm3 for EuPdSn, and a = 753.38(7), b = 467.72(4), c = 793.08(7) pm, V = 0.2795(1) nnr for EuPtSn. The structures consist of three-dimensional [PdSn] and [PtSn] polyanionic networks in which the europium atoms are embedded. The crystal chemistry of these stannides is briefly discussed


2020 ◽  
Vol 76 (8) ◽  
pp. 1369-1372
Author(s):  
Abdessalem Badri ◽  
Inmaculada Alvarez-Serrano ◽  
María Luisa López ◽  
Mongi Ben Amara

Na2.22Mn0.87In1.68(PO4)3, sodium manganese indium tris(phosphate) (2.22/0.87/1.68), was obtained in the form of single crystals by a flux method and was structurally characterized by single-crystal X-ray diffraction. The compound belongs to the alluaudite structure type (space group C2/c) with general formula X(2)X(1)M(1)M(2)2(PO4)3. The X(2) and X(1) sites are partially occupied by sodium [occupancy 0.7676 (17) and 1/2] while the M(1) and M(2) sites are fully occupied within a mixed distribution of sodium/manganese(II) and manganese(II)/indium, respectively. The three-dimensional anionic framework is built up on the basis of M(2)2O10 dimers that share opposite edges with M(1)O6 octahedra, thus forming infinite chains extending parallel to [10\overline{1}]. The linkage between these chains is ensured by PO4 tetrahedra through common vertices. The three-dimensional network thus constructed delimits two types of hexagonal channels, resulting from the catenation of M(2)2O10 dimers, M(1)O6 octahedra and PO4 tetrahedra through edge- and corner-sharing. The channels are occupied by Na+ cations with coordination numbers of seven and eight.


1983 ◽  
Vol 2 (3) ◽  
pp. 111-114
Author(s):  
K. Naukkarinen ◽  
M. Blomberg

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