Crystal Structure and Chemical Composition of BIMEVOX (ME=Mn)

2010 ◽  
Vol 177 ◽  
pp. 66-69 ◽  
Author(s):  
Xiao Hua Yu ◽  
Hong Xing Gu ◽  
Gang Qin Shao ◽  
Bo Lin Wu ◽  
Shi Xi Ouyang ◽  
...  

The Bi2MnxV1-xO5.5- powders were synthesized by high temperature melting method. The effect of Mn dopant concentration on the crystal structure and chemical composition was studied. The crystal structure was determined by X-ray powder diffraction. The chemical composition was tested by X-ray fluorescence (XRF) and Energy Disperse Spectroscopy (EDS). When x < 0.2 the Aurivillius structure solid solution coexisted with few BiVO4. When 0.2 ≤ x ≤ 0.3 the γ-phase Bi2MnxV1-xO5.5- solid solution with tetragonal structure formed and the maximum Mn atomic content was 2.14%. When x ≥ 0.4 the manganese oxide secondary phase appeared. And when x = 0.8 the Bi7VO13 structure solid solution formed while the Aurivillius structure disappeared.

2018 ◽  
Vol 15 (29) ◽  
pp. 228-233
Author(s):  
J. A. FLORES-CRUZ ◽  
G. E. DELGADO ◽  
J. E. CONTRERAS ◽  
M. QUINTERO ◽  
L. NIEVES ◽  
...  

The chalcogenide compound CuNbGaSe3, belonging to the system I-II-III-VI3, has been investigated by means of X-ray powder diffraction and its crystal structure has been refined by the Rietveld method.This is a material of the semiconductor type, which improves the properties of a simple semiconductor like CuGaSe2 because it ads spintronic applications due to its magnetic behavior. The powder pattern was composed by 94.2% of the principal phase CuNbGaSe3 and 5.8% of the secondary phase Cu0.667NbSe2. This material crystallizes with a CuFeInSe3-type structure in the tetragonal space group P4 2c (Nº 112), unit cell parameters a = 5.6199(4) Å, c = 11.0275(2) Å, V = 348.28(4) Å3, with a normal adamantane-structure where occurs a degradation of symmetry from the chalcopyrite structure I4 2d to a related structure P4 2c.


2006 ◽  
Vol 980 ◽  
Author(s):  
Kazuhiro Ishikawa ◽  
Naoshi Kasagami ◽  
Tomoyuki Takano ◽  
Kiyoshi Aoki

AbstractIn order to develop non-Pd based high performance hydrogen permeation alloys, microstructure, crystal structure and hydrogen permeability of duplex phase M-ZrNi (M=V and Ta) alloys were investigated using a scanning electron microscope, an X-ray diffractometer and a gas flow meter. These results were compared with those of Nb-ZrNi ones which have been previously published. The hydrogen permeation was impossible in the V-ZrNi alloys, because they were brittle in the as-cast state. On the other hand, duplex phase alloys consisting of the bcc-(Ta, Zr) solid solution and the orthorhombic ZrNi (Cmcm) intermetallic compound were formed and hydrogen permeable in the Ta-ZrNi system. The Ta40Zr30Ni30 alloy shows the highest value of hydrogen permeability of 4.1×10-8 [molH2m-1s-1Pa-0.5] at 673 K, which is three times higher than that of pure Pd.


Author(s):  
H. Catherine W. Skinner ◽  
Malcolm Ross ◽  
Clifford Frondel

A mineral is a naturally occurring, crystalline inorganic compound with a specific chemical composition and crystal structure. Minerals are commonly named to honor a person, to indicate the geographic area where the mineral was discovered, or to highlight some distinctive chemical, crystallographic, or physical characteristic of the substance. Each mineral sample has some obvious properties: color, shape, texture, and perhaps odor or taste. However, to determine the precise composition and crystal structure necessary to accurately identify the species, one or several of the following techniques must be employed: optical, x-ray diffraction, transmission electron microscopy and diffraction, and chemical and spectral analyses. The long history of bestowing names on minerals has provided some confusing legacies. Many mineral names end with the suffix “ite,” although not most of the common species; no standard naming practice has ever been adopted. Occasionally different names have been applied to samples of the same mineral that differ only in color or shape, but are identical to each other in chemical composition and crystal structure. These names, usually of the common rock-forming minerals, are often encountered and are therefore accepted as synonyms or as varieties of bona fide mineral species. The Fibrous Minerals list (Appendix 1) includes synonyms. A formal description of a mineral presents all the physical and chemical properties of the species. In particular, distinctive attributes that might facilitate identification are noted, and usually a chemical analysis of the first or “type” specimen on which the name was originally bestowed is included. As an example, the complete description of the mineral brucite (Mg(OH)2), as it appears in Dana’s System of Mineralogy, is presented as Appendix 3. Note the complexity of this chemically simple species and the range of information available. In the section on Habit (meaning shape or morphology) both acicular and fibrous forms are noted. The fibrous variety, which has the same composition as brucite, is commonly encountered (see Fig. 1.1D) and is known by a separate name, “nemalite.” Tables to assist in the systematic determination of a mineral species are usually based on quantitative measurements of optical properties (using either transmitted or reflected light, as appropriate) or on x-ray diffraction data.


Author(s):  
Endel Aruja

Antigorite is a lamellar variety of serpentine, and is supposed to be a dimorphous form of chrysotile, which is finely fibrous. Its chemical composition is approximately H4Mg3Si2O9, which is taken as the basis of calculations here.This study was undertaken primarily because it was hoped that knowledge of the structure of antigorite would throw some light on that of chrysotile. Certain similarities between the two structures have been established, namely in the c(7·3kX or 14·6kX), and b(9·2kX) directions. There are two main differences, however. Firstly, imperfections which cause line broadening in the X-ray pattern of chrysotile, are absent in antigorite (apart from certain ‘streaks’). Secondly, the a(43·4kX) axis of antigorite is approximately eight times longer than the corresponding axis in chrysotile. A complete determination of the structure has not been achieved, but the X-ray pattern has been described, and some suggestions made as to the explanation of the peculiarities observed. A further study of the outstanding questions is in progress.


1985 ◽  
Vol 49 (353) ◽  
pp. 547-554 ◽  
Author(s):  
M. Shahmiri ◽  
S. Murphy ◽  
D. J. Vaughan

AbstractThe crystal structure and compositional limits of the ternary compound Pt2FeCu (tulameenite), formed either by quenching from above the critical temperature of 1178°C or by slow cooling, have been investigated using X-ray diffraction, transmission electron microscopy, differential thermal analysis and electron probe microanalysis.The crystal structure of Pt2FeCu, established using electron density maps constructed from the measured and calculated intensities of X-ray diffraction patterns of powdered specimens, has the (000) and (½½0) lattice sites occupied by Pt atoms and the (½0½) and (0½½) sites occupied by either Cu or Fe atoms in a random manner. The resulting face-centred tetragonal structure undergoes a disordering transformation at the critical temperature to a postulated non-quenchable face-centred cubic structure. Stresses on quenching, arising from the ordering reaction, are relieved by twinning along {101} planes or by recrystallization along with deformation twinning; always involving grain boundary fracturing.Phase relations in the system Pt-Fe-Cu have been investigated through the construction of isothermal sections at 1000 and 600°C. At 1000°C there is an extensive single phase region of solid solution around Pt2FeCu and extending to the binary composition PtFe. At 600°C the composition Pt2FeCu lies just outside this now reduced area of solid solution in a two-phase field. Comparison of the experimental results with data for tulameenite suggests that some observed compositions may be metastably preserved. The occurrence of fine veinlets of silicate or other gangue minerals in tulameenite is suggested to result from grain boundary fracturing on cooling below the critical temperature of 1178°C and to be evidence of a magmatic origin.


2008 ◽  
Vol 368-372 ◽  
pp. 1665-1667
Author(s):  
M.M. Wu ◽  
X.L. Xiao ◽  
Y.Z. Cheng ◽  
J. Peng ◽  
D.F. Chen ◽  
...  

A new series of solid solutions Dy2-xGdxMo4O15 (x = 0.0-0.9) were prepared. These compounds all crystallize in monoclinic structure with space group P21/c. The lattice parameters a, b, c and unit cell volumes V increase almost linearly with increasing gadolinium content. The intrinsic thermal expansion coefficients of Dy2-xGdxMo4O15 (x = 0.0 and 0.25) were obtained in the temperature range of 25 to 500°C with high-temperature X-ray diffraction. The correlation between thermal expansion and crystal structure was discussed.


2014 ◽  
Vol 78 (7) ◽  
pp. 1647-1659 ◽  
Author(s):  
Marcin Stachowicz ◽  
Bogusław Bagiński ◽  
Ray Macdonald ◽  
Pavel M. Kartashov ◽  
Artur OzięBło ◽  
...  

AbstractSr- and Zr-bearing perrierite-(Ce) occurring in aegirinized syenite pegmatites of the Burpala massif, Russia, is compositionally intermediate between perrierite-(Ce) and hezuolinite and occupies a compositional gap in minerals of the chevkinite group. Its crystal structure has been determined using a single-crystal diffractometer fitted with a CCD detector and MoKα X-ray radiation. The mineral is monoclinic; a = 13.815(1), b = 5.668(1), c = 11.842(1) Å , β = 113.843(3)º, V = 848.18(4) Å3, space group C2/m, Z = 2. The crystal structure was refined with the occupancies [(Ce1.2La1.0Nd0.15) (Sr1.0Ca0.5Na0.15)]4(Zr0.5Fe0.3Mn0.2)(Ti1.3Fe0.7)2Ti2(Si2O7)2O8 on the basis of chemical composition although the allocation of cations to particular sites was performed on the basis of the number of refined electrons in each unique site. The dominance of Zr in the B site links the Burpala perrierite-(Ce) to more Sr-Zr-rich members of the chevkinite group, such as hezuolinite and rengeite. As in all of the perrierite members, there is a distortion of the D site octahedra, which is interpreted as due to the packing of the REE ions.


2020 ◽  
Vol 105 (1) ◽  
pp. 132-135 ◽  
Author(s):  
Luca Bindi ◽  
Aleksandra Bendeliani ◽  
Andrey Bobrov ◽  
Ekaterina Matrosova ◽  
Tetsuo Irifune

Abstract The crystal structure and chemical composition of a crystal of Mg-bearing phase Egg with a general formula M1−x3+Mx2+SiO4H1+x (M3+ = Al, Cr; M2+ = Mg, Fe), where x = 0.35, produced by subsolidus reaction at 24 GPa and 1400 °C of components of subducted oceanic slabs (peridotite, basalt, and sediment), was analyzed by electron microprobe and single-crystal X-ray diffraction. Neglecting the enlarged unit cell and the consequent expansion of the coordination polyhedra (as expected for Mg substitution for Al), the compound was found to be topologically identical to phase Egg, AlSiO3OH, space group P21/n, with lattice parameters a = 7.2681(8), b = 4.3723(5), c = 7.1229(7) Å, β = 99.123(8)°, V = 223.49(4) Å3, and Z = 4. Bond-valence considerations lead to hypothesize the presence of hydroxyl groups only, thereby excluding the presence of the molecular water that would be present in the hypothetical end-member MgSiO3·H2O. We thus demonstrate that phase Egg, considered as one of the main players in the water cycle of the mantle, can incorporate large amounts of Mg in its structure and that there exists a solid solution with a new hypothetical MgSiH2O4 end-member, according to the substitution Al3+ ↔ Mg2+ + H+. The new hypothetical MgSiH2O4 end-member would be a polymorph of phase H, a leading candidate for delivering significant water into the deepest part of the lower mantle.


2001 ◽  
Vol 7 (S2) ◽  
pp. 358-359
Author(s):  
János L. Lábár ◽  
Lajos Tόth ◽  
István Dόdony ◽  
Jerzy Morgiel

Garnets were one of the first materials in which an occupation of separate lattice sites by different atomic species was determined with an ALCHEMI technique proposed by Spence and Tafto in l982. The reason of so much interest in this material was twofold, i.e. first its known high sensitivity of X-ray generation depending on orientation especially in the axial orientation and second its complicated crystal structure allowing different atomic arrangements in the unit cell depending on its chemical composition. The dodecahedral (X), octahedral (Y) and tetrahedral (Z) sites between the relatively large oxygen atoms can be filled with a variety of small cations in accordance with the formula X3Y2Z3O12. Partial substitution of one cation with another is common in this structure. The results presented in the previous literature indicated that ALCHEMI can only separate the Y-sites from the sum of the other two (X+Z), while the latter has to remain unresolved.


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