scholarly journals Chalkogenides of the Transition Elements. VIII. An X-Ray and Neutron Diffraction Study of the Spinel CoNi2S4

1971 ◽  
Vol 49 (4) ◽  
pp. 598-602 ◽  
Author(s):  
Chung-Hsi Huang ◽  
Osvald Knop
Keyword(s):  
Crystal Structure ◽  
Neutron Diffraction ◽  
Sulfur Atom ◽  
Room Temperature ◽  
Lattice Parameter ◽  
Neutron Diffraction Study ◽  
Transition Elements ◽  
Inverse Spinel ◽  
X Ray ◽  
Neutron Powder Diffractometer

The crystal structure of the spinel CoNi2S4 was refined from X-ray and neutron powder-diffractometer data. The lattice parameter at room temperature and the positional parameter of the sulfur atom were determined as 9.424(1) Å and 0.2591(3). The neutron intensities show clearly that CoNi2S4 is an inverse spinel, Ni[CoNi]S4.

X-ray and neutron diffraction study of the defect crystal structure of the as-grown nonstoichiometric phase Y0.715Ca0.285F2.715

2013 ◽  
Vol 58 (4) ◽  
pp. 575-585 ◽  
Author(s):  
N. B. Bolotina ◽  
A. I. Kalyukanov ◽  
T. S. Chernaya ◽  
I. A. Verin ◽  
I. I. Buchinskaya ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Neutron Diffraction ◽  
Diffraction Study ◽  
Neutron Diffraction Study ◽  
Nonstoichiometric Phase ◽  
X Ray ◽  
Defect Crystal

Neutron diffraction study of the crystal structure of TlInSe2 at high pressure

2019 ◽  
Vol 33 (15) ◽  
pp. 1950149 ◽  
Author(s):  
N. T. Mamedov ◽  
S. H. Jabarov ◽  
D. P. Kozlenko ◽  
N. A. Ismayilova ◽  
M. Yu. Seyidov ◽  
...  
Keyword(s):  
Crystal Structure ◽  
High Pressure ◽  
Neutron Diffraction ◽  
Tetragonal Phase ◽  
Unit Cell Volume ◽  
Diffraction Method ◽  
Lattice Parameter ◽  
Neutron Diffraction Study ◽  
Pressure Derivative ◽  
Neutron Diffraction Method

We have investigated the crystal structure of strongly anisotropic semiconductor TlInSe2 by neutron diffraction method under high pressure upto P = 3.3 GPa. It was shown that the tetragonal phase of TlInSe2 crystal (the space group I4/mcm) is stable in the whole investigated range of pressure. The lattice parameters dependence of the pressure and the unit cell volume are obtained, the linear coefficients of compressibility and the bulk moduli are calculated. At the low pressure, obtained value of compressibility for the lattice parameter a is k[Formula: see text] = 14.23 × 10[Formula: see text] GPa[Formula: see text] and for c is k[Formula: see text] = 5.93 × 10[Formula: see text] GPa[Formula: see text]. Obtained values for bulk modulus B0 and its pressure derivative B[Formula: see text] in tetragonal phase are 30(7) GPa and 4(1), respectively.

X-Ray and neutron diffraction study of alums

1981 ◽  
Vol 157 (3-4) ◽  
Author(s):  
A. M. Abdeen ◽  
G. Will ◽  
W. Schäfer ◽  
A. Kirfel ◽  
M. O. Bargouth ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Neutron Diffraction ◽  
Diffraction Study ◽  
Neutron Diffraction Study ◽  
X Ray

AbstractThe crystal structure of the alums, (NHThe atoms of the cation groups (NH

NEUTRON DIFFRACTION STUDY ON (Bi−Pb)2Sr2Ca2Cu3O10

1990 ◽  
Vol 04 (12) ◽  
pp. 791-794 ◽  
Author(s):  
YANG JI-LIAN ◽  
YE CHUN-TANG ◽  
ZHANG BAI-SHENG ◽  
LI JI-ZHOU ◽  
KANG JIAN ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Neutron Diffraction ◽  
Diffraction Study ◽  
Single Phase ◽  
Polycrystalline Sample ◽  
Neutron Diffraction Study ◽  
Structure Study ◽  
X Ray Diffraction ◽  
Space Group ◽  
X Ray

The polycrystalline sample of (Bi–Pb)2Sr2Ca2Cu3O10 with Tc=107 K was prepared. The X-ray diffraction proved that the sample is single phase. The crystal structure study on the sample has been carried out by neutron diffraction. The result shows that its structure is tetragonal body-centre structure with space group of I4/mmm, containing a few oxygen atoms at 4e site in Bi–Pb layers.

X-ray and neutron diffraction study of the crystal structure ofα-P4S3

1983 ◽  
Vol 165 (1-4) ◽  
pp. 47-64 ◽  
Author(s):  
Tapan Kumar Chattopadhyay ◽  
Wolfgang May ◽  
Hans Georg von Schnering ◽  
G. Stuart Pawley
Keyword(s):  
Crystal Structure ◽  
Neutron Diffraction ◽  
Diffraction Study ◽  
Neutron Diffraction Study ◽  
X Ray

CRYSTAL STRUCTURE, ELECTRICAL CONDUCTIVITY AND THERMAL EXPANSION OF Pr1-xSrxFeO3-δ(0 ≤ x ≤ 0.6)

2012 ◽  
Vol 26 (32) ◽  
pp. 1250174 ◽  
Author(s):  
V. PRASHANTH KUMAR ◽  
Y. S. REDDY ◽  
P. KISTAIAH ◽  
C. VISHNUVARDHAN REDDY
Keyword(s):  
Crystal Structure ◽  
Electrical Conductivity ◽  
Thermal Expansion ◽  
Room Temperature ◽  
Small Polaron ◽  
Linear Thermal Expansion ◽  
Lattice Parameter ◽  
Polaron Hopping ◽  
X Ray ◽  
Perovskite Type

The crystal structure at room temperature (RT), thermal expansion from RT to 1000°C and electrical conductivity, from RT to 600°C, of the perovskite-type oxides in the system Pr 1-x Sr x FeO 3(x = 0, 0.2, 0.4, 0.6) were studied. All the compounds have the orthorhombic perovskite GdFeO 3-type structure with space group Pbnm. The lattice parameters were determined by X-ray powder diffraction. The Pseudo cubic lattice parameter decreases with an increase in x, while the coefficient of linear thermal expansion increases. The thermal expansion is almost linear for x = 0 and 0.2. The electrical conductivity increases with increasing x while the activation energy decreases. The electrical conductivity can be described by the small polaron hopping conductivity model.

Polymorphism of naphthazarin and its relation to solid-state proton transfer. Neutron and X-ray diffraction studies on naphthazarin C

1985 ◽  
Vol 399 (1817) ◽  
pp. 295-319 ◽  
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Solid State ◽  
Neutron Diffraction ◽  
Room Temperature ◽  
Model Comparison ◽  
Molecular Model ◽  
Molecular Formula ◽  
X Ray Diffraction ◽  
X Ray

The crystal structure of naphthazarin C has been determined by neutron diffraction at 60 and 300 K (λ ═ 0.895 Å; 1 Å ═ 10 -10 m ═ 10 -1 nm) and X-ray diffraction at 300 K. The space group is Pc at 60 K, but P 2 1 /c at 300 K. There are small but significant differences in cell dimensions at the two temperatures: a ═ 7.664 (7.915), b ═ 7.304 (7.262), c ═ 15.16 (15.284) Å; β ═ 114.60 (114.20)°; Z ═ 4; U ═ 771.6 (801.3) Å 3 (values at 300 K in parentheses). Neutron diffraction shows that the Pc and P 2 1 /c structures are related by an order-disorder transition at 110±1 K. Structure analysis (1771 reflections; R F ═ 0.035; R W ═ 0.036) showed that the hydroxyl hydrogens are largely ordered at 60 K, the appropriate molecular formula being 5, 8-dihydroxy-1, 4-naphthadione. Neutron diffraction measurements at 300 K (1769 reflections; R F ═ 0.052) indicated a disordered molecular model with one-half of an hydrogen atom attached to each oxygen. X -ray diffraction measurements on naphthazarin C at 300 K (two independent sets of intensity measurements, one with CuKα and the other with MoKα) support this disordered model. The molecular dimensions for naphthazarin A and B also fit this model. Comparison of the crystal structure of naphthazarin C with those of the A and B polymorphs shows that only the former has intermolecular O─H • • • O hydrogen bonding. The diffraction results combined with the available solid-state n. m. r. data show that there is at room temperature a rapid intramolecular exchange of hydroxylic protons between each pair of oxygen atoms in all three naphthazarin polymorphs. Many 1, 3-diketones exist in an enol form in the solid. These enol forms have been reported to be disordered for about twenty molecules at room temperature (this total includes one molecule studied at 108 K, and four amino-imino systems) and ordered systems have been reported for about fifteen molecules. Intermolecular hydrogen bonding occurs only in a few of these crystals.

X-ray powder diffraction study of cesium ammonium hexachlorotellurate [Cs0.86(NH4)0.14]2TeCl6

2006 ◽  
Vol 21 (3) ◽  
pp. 225-228 ◽  
Author(s):  
R. Karray ◽  
A. Kabadou ◽  
A. Ben Salah ◽  
A. van der Lee
Keyword(s):  
Crystal Structure ◽  
Powder Diffraction ◽  
Related Compound ◽  
Room Temperature ◽  
Diffraction Method ◽  
Large Family ◽  
Lattice Parameter ◽  
X Ray ◽  
Ammonium Group ◽  
Ir Spectroscopic

The crystal structure of cesium ammonium hexachlorotellurate [Cs0.86(NH4)0.14]2TeCl6, has been determined using X-ray powder diffraction techniques. At room temperature, the title compound crystallizes in the cubic space group Fm3m, with a lattice parameter a=10.470(17) Å. The Rietveld refinement of the structure led to final confidence factors Rp=0.0338 and Rwp=0.0487. The structure of [Cs0.86(NH4)0.14]2TeCl6 belongs to the large family of K2PtCl6-related structures. The H atoms of the ammonium group are orientated with its apex toward Te atoms as seen in the related compound (NH4)2SiF6. An IR spectroscopic study was performed to confirm the results of the diffraction method, notably concerning the presence of the ammonium group.

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