On the Rare-Earth Pnigochalcogenides LnAsSe

1981 ◽  
Vol 36 (4) ◽  
pp. 463-469 ◽  
Author(s):  
R. Schmelczer ◽  
D. Schwarzenbach ◽  
F. Hulliger

Abstract The structures of GdAsSe and NdAsSe were determined from single crystal data. GdAsSe crystallizes in the monoclinic CeAsS-type structure. The deviations from the parent tetragonal ZrSiS-type structure are smaller than in the corresponding sulphides. The As-As distances in the infinite arsenic chains appear to be too large to warrant non-metallic properties. The structure of NdAsSe is isopuntal with the CeAsS-type; however, only As pairs can be identified. The CeAsS-type structure was also found in the LnAsSe compounds with Ln = Pr, Sm, Tb, . . ., Tm, Lu, Y. The distortions of the ZrSiS-type substructure become more pronounced on going to smaller cations. The stoichiometry of the samples depends strongly upon the preparation.

2011 ◽  
Vol 66 (7) ◽  
pp. 671-676 ◽  
Author(s):  
Trinath Mishra ◽  
Rainer Pöttgen

The equiatomic rare earth compounds REPtZn (RE = Y, Pr, Nd, Gd-Tm) were synthesized from the elements in sealed tantalum tubes by high-frequency melting at 1500 K followed by annealing at 1120 K and quenching. The samples were characterized by powder X-ray diffraction. The structures of four crystals were refined from single-crystal diffractometer data: TiNiSi type, Pnma, a = 707.1(1), b = 430.0(1), c = 812.4(1) pm, wR2 = 0.066, 602 F2, 21 variables for PrPt1.056Zn0.944; a = 695.2(1), b = 419.9(1), c = 804.8(1) pm, wR2 = 0.041, 522 F2, 21 variables for GdPt0.941Zn1.059; a = 688.2(1), b = 408.1(1), c = 812.5(1) pm, wR2 = 0.041, 497 F2, 22 variables for HoPt1.055Zn0.945; a = 686.9(1), b = 407.8(1), c = 810.4(1) pm, wR2 = 0.061, 779 F2, 20 variables for ErPtZn. The single-crystal data indicate small homogeneity ranges REPt1±xZn1±x. The platinum and zinc atoms build up three-dimensional [PtZn] networks (265 - 269 pm Pt-Zn in ErPtZn) in which the erbium atoms fill cages with coordination number 16 (6 Pt + 6 Zn + 4 Er). Bonding of the erbium atoms to the [PtZn] network proceeds via shorter RE-Pt distances, i. e. 288 - 293 pm in ErPtZn.


2013 ◽  
Vol 68 (5-6) ◽  
pp. 625-634 ◽  
Author(s):  
Bastian Reker ◽  
Samir F. Matar ◽  
Ute Ch. Rodewald ◽  
Rolf-Dieter Hoffmann ◽  
Rainer Pöttgen

Small single crystals of the Sm5Ge4-type (space group Pnma) germanides RE2Nb3Ge4 (RE = Sc, Y, Gd-Er, Lu) and Sc2Ta3Ge4 were synthesized by arc-melting of the respective elements. The samples were characterized by powder and single-crystal X-ray diffraction. In all structures, except for Sc2.04Nb2.96Ge4 and Sc2.19Ta2.81Ge4, the rare earth and niobium atoms show full ordering on the three crystallographically independent samarium sites of the Sm5Ge4 type. Two sites with coordination number 6 are occupied by niobium, while the slightly larger site with coordination number 7 is filled with the rare earth element. Small homogeneity ranges with RE=Nb and RE=Ta mixing can be expected for all compounds. The ordered substitution of two rare earth sites by niobium or tantalum has drastic effects on the coordination number and chemical bonding. This was studied for the pair Y5Ge4/Y2Nb3Ge4. Electronic structure calculations show larger charge transfer from yttrium to germanium for Y5Ge4, contrary to Y2Nb3Ge4 which shows stronger covalent bonding due to the presence of Nb replacing Y at two sites


1997 ◽  
Vol 52 (5) ◽  
pp. 560-564 ◽  
Author(s):  
Andre T. Nientiedt ◽  
Wolfgang Jeitschko ◽  
Peter G. Pollmeier ◽  
Markus Brylak

Abstract The 24 title compounds were prepared in well crystallized form by reaction of the rare earth elements (or uranium, respectively), manganese, the pnictide components, and MnO2 in a NaCl/KCl flux. They crystallize with the tetragonal ZrCuSiAs type structure (P4/nmm, Z = 2), which has been refined from single-crystal X-ray data of NdMnPO (a = 398.9(1), c = 867.4(1) pm, R = 0.026), NdMnAsO (a = 404,9(2), c = 889.3(4) pm, R = 0.025), and NdMnSbO (a = 416.5(1), c = 946.2(2) pm, R = 0.021) for 107, 190, and 124 structure factors, respectively, and 11 variable parameters each. Chemical bonding in these compounds is briefly discussed.


1981 ◽  
Vol 36 (8) ◽  
pp. 917-921 ◽  
Author(s):  
Hans-Otto Cullmann ◽  
Heinz-Walter Hinterkeuser ◽  
Hans-Uwe Schuster

Abstract The ternary compound β-Li2ZnGe was prepared and its structure determined from powder and single crystal data. The compound crystallizes in a modified Na3As type structure, space group Ṗ̇̇̇̇̇̇̇̇̇̇̇̇̇̇3̄m 1 - D33d.The cell parameters are: a = 432.6 pm, c = 1647.0 pm, c/a= 3.83.A phase transition between a-and β-Li2ZnGe was found and the reaction of the elements lithium, zinc and germanium to a-Li2ZnGe was followed by differential thermal analysis. The temperatures and the enthalpies of transition and fusion were determined.


2009 ◽  
Vol 64 (11-12) ◽  
pp. 1345-1352 ◽  
Author(s):  
Stefan Linsinger ◽  
Matthias Eul ◽  
Wilfried Hermes ◽  
Rolf-Dieter Hoffmann ◽  
Rainer Pöttgen

The rare earth-rich magnesium compounds RE23Ru7Mg4 (RE = La, Ce, Pr, Nd) were synthesized from the elements in sealed tantalum ampoules in an induction furnace. They crystallize with the hexagonal non-centrosymmetric Pr23Ir7Mg4-type structure, space group P63mc. The structures of La23Ru6.88(1)Mg4 (a = 1017.7(4), c = 2286.5(5) pm, wR2 = 0.0277, 2708 F2, 71 variables), Ce23Ru7Mg4 (a = 993.5(3), c = 2243.9(8) pm, wR2 = 0.0573, 2268 F2, 70 variables), and Pr23Ru7Mg4 (a = 996.8(3), c = 2241.5(6) pm, wR2 = 0.0492, 2565 F2, 70 variables) have been refined from single-crystal diffractometer data. The structures are built up from complex threedimensional networks of edge- and corner-sharing RE6Ru trigonal prisms. Cavities within these networks are filled by slightly elongated Mg4 tetrahedra (311 - 315 pm in Pr23Ru7Mg4) and RE6 octahedra. The cerium compound has an a parameter which is even smaller than that of Nd23 Ru7Mg4, indicating intermediate-valent cerium. This was confirmed by magnetic susceptibility measurements. Ce23Ru7Mg4 shows an average, reduced magnetic moment of 2.01 μB/Ce atom. Pr23Ru7Mg4 contains stable trivalent praseodymium (3.64 μB/Pr atom)


1979 ◽  
Vol 34 (8) ◽  
pp. 1057-1058 ◽  
Author(s):  
Axel Czybulka ◽  
Günter Steinberg ◽  
Hans-Uwe Schuster

In the systems Li-M-X = (M = Y, Gd; X = Si, Ge) the compounds LiYSi, LiYGe and LiGdGe were prepared. Their crystal structures were determined by X-ray investigations. They crystallize hexagonally (space group P 6̄2m), and a C22-(Fe2P-type) lattice was found


2008 ◽  
Vol 63 (9) ◽  
pp. 1127-1130 ◽  
Author(s):  
Falko M. Schappacher ◽  
Ute Ch. Rodewald ◽  
Rainer Pöttgen

New intermetallic compounds RE4TCd (RE = Y, La-Nd, Sm, Gd-Tm, Lu; T = Ni, Pd, Ir, Pt) were synthesized by melting of the elements in sealed tantalum tubes in a highfrequency furnace. They crystallize with the Gd4RhIn-type structure, space group F 4̄3m, Z = 16. The four gadolinium compounds were characterized by single crystal X-ray diffractometer data: a = 1361.7(1) pm, wR2 = 0.062, 456 F2 values, 19 variables for Gd4NiCd; a = 1382.1(2) pm, wR2 = 0.077, 451 F2 values, 19 variables for Gd4PdCd; a = 1363.6(2) pm, wR2 = 0.045, 494 F2 values, 19 variables for Gd4IrCd; a = 1379.0(1) pm, wR2 = 0.045, 448 F2 values, 19 variables for Gd4PtCd. The rare earth atoms build up transition metal-centered trigonal prisms which are condensed via common corners and edges, leading to three-dimensional adamantane-related networks. The cadmium atoms form Cd4 tetrahedra which fill voids left in the prisms’ network.


1996 ◽  
Vol 49 (9) ◽  
pp. 997 ◽  
Author(s):  
LI Semenova ◽  
BW Skelton ◽  
AH White

Adducts [( dmso )nLn(O2NO)3], obtained by the crystallizatior , of lanthanoid (III) nitrate ( Ln (NO3)3.-xH2O) with excess dimethyl sulfoxide (' dmso ') in methanol or ethanol, have been the subject of a series of room-temperature single-crystal X-ray studies, defining more clearly the manner in which stoichiometry and structure systematically vary with change in metal ion radius. All complexes studied are mononuclear, the metal ion being complexed by three bidentate nitrate ligands and a number of dmso ligands , four for La-Sm and three beyond. The array La- Sm is monoclinic C2/c, a ≈ 14.9, b ≈ 15.5, c ≈ 15.5 Ǻ, β ≈ 108.4°, Z = 4 f.u .; the metal atom is disposed on a crystallographic 2 axis, which also passes through one of the nitrate groups. The series Eu -Tm (inclusive also of Y) is monoclinic, P21/n, a ≈ 11.5, b ≈ 12.7, c ≈ 13.6 Ǻ, β ≈ 100°, Z = 4 f.u ., while Yb and Lu are also monoclinic, P21/c, a ≈ 10.0, b ≈ 12.6, c ≈ 16 Ǻ, β ≈ 100.6°, Z = 4 f.u.


2013 ◽  
Vol 114 (2) ◽  
pp. 024102 ◽  
Author(s):  
G. A. Komandin ◽  
E. S. Zhukova ◽  
V. I. Torgashev ◽  
A. V. Boris ◽  
A. A. Boris ◽  
...  

2006 ◽  
Vol 61 (1) ◽  
pp. 23-28 ◽  
Author(s):  
Vasyl’ I. Zaremba ◽  
Yaroslav M. Kalychak ◽  
Mariya V. Dzevenko ◽  
Ute Ch. Rodewald ◽  
Birgit Heying ◽  
...  

The rare earth-cobalt-indides RE14Co3In3 (RE = Y, Tb, Dy, Ho, Er) were prepared in polycrystalline form from the elements by arc-melting. Small single crystals were grown through a special annealing sequence. The compounds were investigated on the basis of X-ray powder and single crystal data: Lu14Co2In3 (Gd14Co3In2.7) type, P42/nmc, Z = 4, a = 959.0(1), c = 2319.1(5) pm, wR2 = 0.055, 2289 F2 values, 65 variables for Y13.90Co2.99In3.02, a = 953.8(1), c = 2315.8(5) pm, wR2 = 0.108, 2357 F2 values, 65 variables for Tb13.92Co3.01In2.92, a = 949.24(3), c=2296.5(1) pm, wR2= 0.129, 2518 F2 values, 65 variables for Dy13.90Co2.97In2.95, a=946.3(1), c = 2289.0(5) pm, wR2 = 0.099, 2297 F2 values, 64 variables for Ho14Co2.80In2.89, and a = 941.0(1), c = 2274.2(5) pm, wR2 = 0.140, 2450 F2 values, 65 variables for Er13.83Co2.88In3.10. All RE14Co3In3 indides show a small degree of In/Co mixing (between 7 and 16% Co) on the 4c In1 site and defects on the 8g Co1 positions (between 84 and 95% Co). Except for the holmium compound, the RE14Co3In3 intermetallics also reveal RE/In mixing on the 4c RE1 sites, leading to the refined compositions. The seven crystallographically independent RE sites have between 9 and 10 nearest RE neighbors. The RE14Co3In3 structures consist of a complex intergrowth of rare earth based polyhedra. Both cobalt sites have a distorted trigonal-prismatic rare earth coordination. An interesting feature is the In2-In2 dumb-bell with an In2-In2 distance of 300 pm (for Ho14Co2.80In2.89). The crystal chemistry of the RE14Co3In3 indides is discussed.


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