Crystal Structure of the Dy3Ni11.83Si3.98 Compound

2019 ◽  
Vol 289 ◽  
pp. 77-81
Author(s):  
Bohdana Belan ◽  
Mykola Manyako ◽  
Katarzyna Pasinska ◽  
Marta Demchyna ◽  
Roman E. Gladyshevskii

The new ternary silicide Dy3Ni11.83(1)Si3.98(1)was synthesized from the elements by arc-melting and its crystal structure was determined by X-ray single-crystal diffraction. The compound crystallizes in a Sc3Ni11Ge4-type structure: Pearson symbolhP38, space groupP63/mmc(No. 194),a= 8.1990(7),c= 8.6840(7) Å,Z= 2;R= 0.0222, wR= 0.0284 for 365 reflections. The structure belongs to a large family of structures related to the EuMg5.2type, with representatives among ternary aluminides, silicides, germanides,etc.

2020 ◽  
Vol 86 (5) ◽  
pp. 3-12
Author(s):  
Bohdana Belan ◽  
Mykola Manyako ◽  
Mariya Dzevenko ◽  
Dorota Kowalska ◽  
Roman Gladyshevskii

The new ternary silicide Lu3Ni11.74(2)Si4 was synthesized from the elements by arc-melting and its crystal structure was determined by the single-crystal X-ray diffraction. The compound crystallizes in the Sc3Ni11Ge4-type: Pearson symbol hP37.2, space group P63/mmc (No. 194), a = 8.0985(16), c = 8.550(2) Å, Z = 2; R = 0.0244, wR = 0.0430 for 244 reflections. The silicide Lu3Ni11.74(2)Si4 is new member of the EuMg5.2-type structure family.


2006 ◽  
Vol 61 (6) ◽  
pp. 727-732 ◽  
Author(s):  
Volodymyr Babizhetskyy ◽  
Constantin Hoch ◽  
Hansjürgen Mattausch ◽  
Arndt Simon

The title compound was prepared from the elements by arc-melting followed by annealing in silica tubes at 1270 K for one week. The crystal structure was investigated by means of X-ray single crystal diffraction: space group P4/mbm, a = 5.366(1), c = 3.690(1) Å , Z = 2, R1 = 0.010, wR2 = 0.022 for 245 unique reflections with Io > 2σ (Io) and 12 refined parameters. Group-subgroup relationships of MB6 and MB2C2 structure models are discussed


2007 ◽  
Vol 62 (2) ◽  
pp. 143-147 ◽  
Author(s):  
Hansjürgen Mattausch ◽  
Constantin Hoch ◽  
Arndt Simon

Monophasic La6C2Br9 was prepared by heating a mixture of LaBr3, lanthanum metal and carbon in a molar ratio of 3 : 3 : 2 at 840 °C for 5 d. The crystal structure was investigated by X-ray single crystal diffraction (space group C2/c, a = 14.234(3), b = 10.858(2), c = 14.588(3) Å , β = 106.80(3) °). In the structure the La atoms form edge-sharing double tetrahedra. The La tetrahedra are centered by single carbon atoms. The yellow crystals of La6C2Br9 are transparent and electrically insulating.


2006 ◽  
Vol 62 (4) ◽  
pp. i103-i105 ◽  
Author(s):  
Akihiko Nakatsuka ◽  
Osamu Ohtaka ◽  
Hiroshi Arima ◽  
Noriaki Nakayama ◽  
Tadato Mizota

The crystal structure of the low-temperature (LT) modification of LaBO3 has been redetermined from single-crystal X-ray data; the resulting structure confirms the previous study [Abdullaev, Dzhafarov & Mamedov (1976). Azerbaidzhanskii Khim. Zh. pp. 117–120], but with improved precision. LT-LaBO3 crystallizes in space group Pnma and adopts the aragonite-type structure. Except for one O atom, which is situated on a general position, all other atoms (one La, one B and a second O atom) lie on mirror planes. The structure is composed of LaO9 polyhedra with an average La—O distance of 2.593 Å and trigonal BO3 groups with an average B—O distance of 1.373 Å. Slight anisotropies of the thermal vibrations of La and B atoms suggest that the electrostatic La...La and La...B interactions across the shared edges are weak.


1994 ◽  
Vol 49 (11) ◽  
pp. 1525-1530 ◽  
Author(s):  
Rainer Pöttgen

The new ternary stannides RE2Au2Sn (RE = Gd, Tb) and indides RE2Au2In (RE = Y, Gd-Tm, Lu) were synthesized by arc-melting of the elemental components and subsequent annealing at 800 °C. While Gd2Au2Sn, Tb2Au2Sn and the indides with RE = Y, Gd-Er crystallize in the ordered U3Si2 structure, Tm2Au2In and Lu2Au2In adopt the ordered Zr3Al2 structure, respectively. The crystal structure of Dy2Au2In was refined from single-crystal X- ray data: P4/mbm, Z = 2, a = 784.1(1) pm, c = 373.9(1) pm, V = 0.2299 nm3 and R = 0.028 for 342 F2 values and 12 variables. The tin (indium) atoms in these compounds occupy [RE8] square prisms and the gold atoms are surrounded by [RE6] trigonal prisms. These fragments are derived from the AlB2 and CsCl-type structures. The crystal chemistry of these com­pounds is briefly discussed.


2009 ◽  
Vol 64 (4) ◽  
pp. 371-374 ◽  
Author(s):  
Hansjürgen Mattausch ◽  
Reinhard K. Kremer ◽  
Arndt Simon

Single-phase Pr2CBr was prepared by heating a mixture of PrBr3, Pr and C (1 : 5:3) to 1140 °C for 18 d. The crystal structure was investigated by X-ray single crystal diffraction (space group P63/mmc, a = 3.8071(3), c = 14.7787(12) Å). In the structure the Pr atoms form C-centered octahedra condensed into Pr2C sheets via common edges; these sheets are separated by the Br atoms which are in a trigonal prismatic environment of Pr atoms. Pr2CBr is a black shiny compound with metallic conductivity. It is a ferromagnet with Tc = 13.8(5) K.


1996 ◽  
Vol 51 (5) ◽  
pp. 751-753 ◽  
Author(s):  
Gabriele Weber ◽  
Klaus-Jürgen Range

The zircon-type structure of calcium chromate( VI), CaCrO4, has been confirmed and refined from single-crystal X-ray data. The compound crystallizes tetragonaly, space group I41/amd, with a = 7.222(2), c = 6.285(1) Å, c/a = 0.8703 and Z = 4. The structure comprises isolated, slightly distorted CrO4 tetrahedra ( C r-O = 1.646(3) Å ) which are connected with CaO8 dodecahedra (<Ca-O> = 2.556 Å) by edge- and corner-sharing. The three-dimensional framework thus created contains rather large holes which are, however, empty in the case of CaCrO4


2019 ◽  
Vol 74 (3) ◽  
pp. 289-295 ◽  
Author(s):  
Nataliya Gulay ◽  
Yuriy Tyvanchuk ◽  
Marek Daszkiewicz ◽  
Bohdan Stel’makhovych ◽  
Yaroslav Kalychak

AbstractTwo compounds in the Sc-Co-In system were obtained by arc-melting of the pure metals and their crystal structures have been determined using single crystal X-ray diffraction data. The structure of Sc3Co1.64In4 (space group P6̅, а=7.6702(5), c=3.3595(2) Å, Z=1, R1=0.0160, wR2=0.0301) belongs to the Lu3Co2−xIn4 type structure, which is closely related to the ZrNiAl and Lu3CoGa5 types. The structure of Sc10Co9In20 (space group P4/nmm, а=12.8331(1), c=9.0226(1) Å, Z=2, R1=0.0203, wR2=0.0465) belongs to the Ho10Ni9In20 type, which is closely related to HfNiGa2.


2021 ◽  
Vol 76 (3-4) ◽  
pp. 243-247
Author(s):  
Bohdana Belan ◽  
Tamara J. Bednarchuk ◽  
Vasyl Kinzhybalo ◽  
Mariya Dzevenko ◽  
Svitlana Pukas ◽  
...  

Abstract The intermetallic compound LaNi11.8–11.4Si1.2–1.6 was synthesized by arc-melting and its crystal structure was determined using powder and single-crystal X-ray diffraction data. The compound adopts the cubic CaCu6.5Al6.5-type structure (space group Fm 3 ‾ $\bar{3}$ c, Pearson code cF112, Z = 8), which is a partially ordered ternary derivative of the NaZn13 type: a = 11.256(4) Å, V = 1426.1(15) Å3, R = 0.0133, wR = 0.0285 for 93 reflections with I > 2 σ(I) for LaNi11.4Si1.6; a = 11.25486(8) Å, V = 1425.68(2) Å3, R p = 4.17%, R wp = 5.85%, R B = 3.44% for LaNi11.8Si1.2. One of its crystallographic positions (96i) is occupied by a mixture of Ni and Si atoms. The structure of this new silicide can be represented as a packing of Ni-centered icosahedra and La-centered snub cubes, which are packed in a CsCl-related manner.


2020 ◽  
Vol 75 (6-7) ◽  
pp. 709-713
Author(s):  
Nataliya Dominyuk ◽  
Vasyl’ I. Zaremba ◽  
Rainer Pöttgen

AbstractSingle crystals of La5Ir1.73In4.27 were grown from a sample of the starting composition 47La: 17Ir: 36 In by arc-melting, followed by a long annealing sequence in a muffle furnace. La5Ir1.73In4.27 crystallizes with the Lu5Ni2In4-type structure, space group Pbam, which was refined from single-crystal X-ray diffractometer data: a = 834.0(2), b = 1862.2(4), c = 385.31(8) pm, wR2 = 0.0278, 1165 F2 values and 37 variables. The 4h iridium site shows a small degree of Ir/In mixing. Geometrically one can describe the La5Ir1.73In4.27 structure as a simple 4:1 intergrowth variant of CsCl and AlB2-related slabs. The iridium and indium atoms form a one-dimensional meandering [Ir1.73In4.27]δ– polyanion (292 pm Ir–In and 327 pm In–In) which is embedded in a lanthanum matrix.


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