Effective role of CaO/P2O5 ratio on SiO2-CaO-P2O5 glass system

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P. Kiran

2017-05-01

Full Text Available In the present work, the effect of the CaO/P2O5 ratio on the composition of sol-gel synthesized 58SiO2-(19 − xP2O5–(23 + xCaO (x = 0, 5, 10 and 15 mol% glass samples was studied. Further, the effect of NBO/BO ratio on hydroxy carbonated apatite layer (HCA forming ability based on dissolution behavior in simulated body fluid (SBF solution was also investigated. CaO/P2O5 ratios of synthesized glass samples were 1.2, 2, 3.6, and 9.5, respectively. NBO/BO ratios were obtained using Raman spectroscopic analysis as 0.58, 1.20, 1.46, and 1.78, respectively. All samples were soaked in the SBF solution for 7 days. The calculated weight losses of these samples were 58%, 64%, 83%, and 89% for corresponding NBO/BO ratios. The increase in CaO/P2O5 ratio increases the NBO/BO ratios. However, the increase in NBO/BO ratio increases HCA forming ability of SBF treated samples. The HCA crystalline layer formation was confirmed through X-ray Diffraction (XRD, Transmission Electron Microscopy (TEM, Scanning Electron Microscopy (SEM, Raman and Infrared spectroscopic analysis. Higher CaO/P2O5 ratio favors the increase in HCA formation for SBF treated calcium phospho silicate glasses.

Effect of ZrO(2) additions on the crystallization, mechanical and biological properties of MgO-CaO-SiO(2)-P(2)O(5)-CaF(2) bioactive glass-ceramics.

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Li, H C; Wang, D G; Meng, X G; Chen, C Z

2014-06-01

A series of ZrO(2) doped MgO-CaO-SiO(2)-P(2)O(5)-CaF(2) bioactive glass-ceramics were obtained by sintering method. The crystallization behavior, phase composition, morphology and structure of glass-ceramics were characterized. The bending strength, elastic modulus, fracture toughness, micro-hardness and thermal expansion coefficient (TEC) of glass-ceramics were investigated. The in vitro bioactivity and cytotoxicity tests were used to evaluate the bioactivity and biocompatibility of glass-ceramics. The sedimentation mechanism and growth process of apatites on sample surface were discussed. The results showed that the mainly crystalline phases of glass-ceramics were Ca(5)(PO4)3F (fluorapatite) and β-CaSiO(3). (β-wollastonite). m-ZrO(2) (monoclinic zirconia) declined the crystallization temperatures of glasses. t-ZrO(2) (tetragonal zirconia) increased the crystallization temperature of Ca(5)(PO4)(3)F and declined the crystallization temperature of β-CaSiO(3). t-ZrO(2) greatly increased the fracture toughness, bending strength and micro-hardness of glass-ceramics. The nanometer apatites were induced on the surface of glass-ceramic after soaking 28 days in SBF (simulated body fluid), indicating the glass-ceramic has good bioactivity. The in vitro cytotoxicity test demonstrated the glass-ceramic has no toxicity to cell. Copyright © 2014 Elsevier B.V. All rights reserved.

Structural aspects of B2O3-substituted (PbO)0.5(SiO2)0.5 glasses

International Nuclear Information System (INIS)

Sudarsan, V.; Kulshreshtha, S.K.; Shrikhande, V.K.; Kothiyal, G.P.

2002-01-01

Lead borosilicate glasses having general formulae (PbO) 0.5-x (SiO 2 ) 0.5 (B 2 O 3 ) x with 0.0≤x≤0.4 and (PbO) 0.5 (SiO 2 ) 0.5-y (B 2 O 3 ) y with 0.0≤y≤0.5 have been prepared by a conventional melt-quench method and characterized by 29 Si, 11 B magic angle spinning (MAS) NMR techniques and infrared spectroscopy, as regards their structural features. From 29 Si NMR results, it has been inferred that with increasing concentration of boron oxide, (PbO) 0.5-x (SiO 2 ) 0.5 (B 2 O 3 )x glasses exhibit a systematic increase in the number of Q 4 structural units of Si at the expense of Q 2 structural units, along with the formation of Si-O-B linkages. On the other hand, for (PbO) 0.5 (SiO 2 ) 0.5-y (B 2 O 3 ) y glasses, there is no direct interaction between SiO 2 and B 2 O 3 in the glass network, as revealed by the 29 Si MAS NMR studies. Boron exists in both trigonal and tetrahedral configurations for these two series of glasses and for the (PbO) 0.5 (SiO 2 ) 0.5-y (B 2 O 3 ) y series of glasses; the relative concentration of these two structural units remains almost constant with increasing B 2 O 3 concentration. In contrast, for (PbO) 0.5-x (SiO 2 ) 0.5 (B 2 O 3 ) x glasses, there is a slight increase in the number of BO 3 structural units above x = 0.2, as there is a competition between SiO 2 and B 2 O 3 for interaction with Pb 2+ , thereby leading to the formation of BO 3 structural units. For both series of glasses, the thermal expansion coefficient is found to decrease with increasing B 2 O 3 concentration, the effect being more pronounced for the (PbO) 0.5-x (SiO 2 ) 0.5 (B 2 O 3 ) x series of glasses due to the increased concentration of Q 4 structural units of silicon and better cross-linking as a result of the formation of Si-O-B-type linkages. (author)

40 CFR 721.10018 - Calcium hydroxide oxide silicate (Ca6(OH)2O2(Si2O5)3).

Science.gov (United States)

2010-07-01

... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Calcium hydroxide oxide silicate (Ca6... New Uses for Specific Chemical Substances § 721.10018 Calcium hydroxide oxide silicate (Ca6(OH)2O2... substance identified as calcium hydroxide oxide silicate (Ca6(OH)2O2(Si2O5)3) (PMN P-01-442; CAS No. 13169...

High pressure study of low compressibility tetracalcium aluminum carbonate hydrates 3CaO·Al2O3·CaCO3·11H2O

KAUST Repository

Moon, Juhyuk; Oh, Jae Eun; Balonis, Magdalena; Glasser, Fredrik P.; Clark, Simon M.; Monteiro, Paulo J.M.

2012-01-01

Synchrotron X-ray diffraction data was collected from a sample of monocarboaluminate 3CaO•Al2O3•CaCO 3•11H2O from ambient pressure to 4.3 GPa. The refined crystal structure at ambient pressure is triclinic with parameters a = 5.77(2) Å, b = 8

A molecular dynamics study of the atomic structure of (CaO)x(SiO2)1-x glasses.

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Mead, Robert N; Mountjoy, Gavin

2006-07-27

The local atomic environment of Ca in (CaO)x(SiO2)1-x glasses is of interest because of the role of Ca in soda-lime glass, the application of calcium silicate glasses as biomaterials, and the previous experimental measurement of the Ca-Ca correlation in CaSiO(3) glass. Molecular dynamics has been used to obtain models of (CaO)x(SiO2)1-x glasses with x = 0, 0.1, 0.2, 0.3, 0.4, and 0.5, and with approximately 1000 atoms and size approximately 25 A. As expected, the models contain a tetrahedral silica network, the connectivity of which decreases as x increases. In the glass-forming region, i.e., x = 0.4 and 0.5, Ca has a mixture of 6- and 7-fold coordination. Bridging oxygen makes an important contribution to the coordination of Ca, with most bridging oxygens coordinated to 2 Si plus 1 Ca. The x = 0.5 model is in reasonable agreement with previous experimental studies, and does not substantiate the previous theory of cation ordering, which predicted Ca arranged in sheets. In the phase-separated region, i.e., x = 0.1 and 0.2, there is marked clustering of Ca.

Investigation of thermoluminescence and kinetic parameters of CaMgB{sub 2}O{sub 5}: Dy{sup 3+} nanophosphor

Energy Technology Data Exchange (ETDEWEB)

Manhas, M. [School of Physics, Shri Mata Vaishno Devi University, Katra-182320 J& K (India); Kumar, Vinay, E-mail: vinaykumar@smvdu.ac.in [School of Physics, Shri Mata Vaishno Devi University, Katra-182320 J& K (India); Department of Physics, University of the Free State, P.O. Box 339, Bloemfontein ZA9300 (South Africa); Ntwaeaborwa, O. M.; Swart, H. C. [Department of Physics, University of the Free State, P.O. Box 339, Bloemfontein ZA9300 (South Africa)

2016-05-06

In this paper, thermoluminescence (TL) properties of Dy{sup 3+} (1.5 mol %) doped CaMgB{sub 2}O{sub 5} nanophosphor after being exposed to ultraviolet (UV) radiations (λ=254nm) were investigated. In UV exposed samples, the thermoluminescence glow curve consists of a broad glow peak located at 380 K with a small shoulder at 507 K. A shift in glow peak temperature from 367 K to 380 K after the UV exposure for 80 min was observed, which clearly shows that glow peaks follow the second order kinetics. The TL intensity of the peaks increases with an increase in the exposure time of UV rays (10-180 min). The TL Anal program was used to analyze the glow curve. The kinetic parameters such as activation energy (E), the frequency factor (s) and the order of kinetics (b) were calculated for CaMgB{sub 2}O{sub 5}: Dy{sup 3+} nanophosphors.

Fabrication and evaluation of osteoblastic differentiation of human mesenchymal stem cells on novel CaO-SiO2-P2O5-B2O3 glass-ceramics.

Science.gov (United States)

Lee, Jae Hyup; Seo, Jun-Hyuk; Lee, Kyung Mee; Ryu, Hyun-Seung; Baek, Hae-Ri

2013-07-01

Apatite-wollastonite glass-ceramics have high mechanical strength, and CaO-SiO2 -B2 O3 glass-ceramics showed excellent bioactivity and high biodegradability. A new type of CaO-SiO2 -P2 O5 -B2 O3 system of bioactive glass-ceramics (BGS-7) was fabricated, and the effect and usefulness was evaluated via bioactivity using simulated body fluid and human mesenchymal stem cells (hMSCs). The purpose of this study was to compare BGS-7 and hydroxyapatite (HA) using hMSCs in order to evaluate the bioactivity of BGS-7 and its possibility as a bone graft extender. Alkaline phosphatase (ALP) staining, ALP activity, cell proliferation 3-(4,5-dimethylthiazol-2-yl)-5-(3-carboxymethoxyphenyl)-2-(4-sulfophenyl)-2H-tetrazolium, inner salt (MTS) assay, Alizarin Red-S (AR-S) staining, calcium levels, the mRNA expression of ALP, osteocalcin, osteopontin, and runt-related transcription factor 2 (runx-2) using reverse-transcription polymerase chain reaction (RT-PCR) and the protein expression of osteocalcin and runx-2 using Western blot were measured by transplanting hMSC onto a tissue culture plate, HA, and BGS-7. The ALP staining and AR-S staining of BGS-7 was greater than that of HA and control. The ALP value of BGS-7 was significantly higher than that of HA and control. The MTS results showed that BGS-7 had a higher value than the groups transplanted onto HA and control on day 15. The calcium level was higher than the control in both HA and BGS-7, and was especially high in BGS-7. There were more mineral products on BGS-7 than on the HA when analyzed by scanning electron microscopy. The mRNA expression of ALP, osteopontin, osteocalcin, and runx-2 were higher on BGS-7 than on HA and the control when analyzed by RT-PCR. The relative gene expression of osteopontin and runx-2 were found to be higher on BGS-7 than on HA and the control by Western blot. Accordingly, it is predicted that BGS-7 would have high biocompatibility and good osteoconductivity, and presents a possibility as a new

First investigations on the quaternary system Na2O-K2O-CaO-SiO2: synthesis and crystal structure of the mixed alkali calcium silicate K1.08Na0.92Ca6Si4O15

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Kahlenberg, Volker; Mayerl, Michael Jean-Philippe; Schmidmair, Daniela; Krüger, Hannes; Tribus, Martina

2018-04-01

In the course of an exploratory study on the quaternary system Na2O-K2O-CaO-SiO2 single crystals of the first anhydrous sodium potassium calcium silicate have been obtained from slow cooling of a melt in the range between 1250 and 1050 °C. Electron probe micro analysis suggested the following idealized molar ratios of the oxides for the novel compound: K2O:Na2O:CaO:SiO2 = 1:1:12:8 (or KNaCa6Si4O15). Single-crystal diffraction measurements on a crystal with chemical composition K1.08Na0.92Ca6Si4O15 resulted in the following basic crystallographic data: monoclinic symmetry, space group P 21/ c, a = 8.9618(9) Å, b = 7.3594(6) Å, c = 11.2453(11) Å, β= 107.54(1)°, V = 707.2(1) Å3, Z = 2. Structure solution was performed using direct methods. The final least-squares refinement converged at a residual of R(|F|) = 0.0346 for 1288 independent reflections and 125 parameters. From a structural point of view, K1.08Na0.92Ca6Si4O15 belongs to the group of mixed-anion silicates containing [Si2O7]- and [SiO4]-units in the ratio 1:2. The mono- and divalent cations occupy a total of four crystallographically independent positions located in voids between the tetrahedra. Three of these sites are exclusively occupied by calcium. The fourth site is occupied by 54(1)% K and 46%(1) Na, respectively. Alternatively, the structure can be described as a heteropolyhedral framework based on corner-sharing silicate tetrahedra and [CaO6]-octahedra. The network can build up from kröhnkite-like [Ca(SiO4)2O2]-chains running along [001]. A detailed comparison with other A2B6Si4O15-compounds including topological and group-theoretical aspects is presented.

Are the phosphorus-rich Na2O–CaO–B2O3–SiO2–P2O5 glasses bioactive and what is an influence of doping with manganese oxide?

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Bragiel P.

2018-03-01

Full Text Available A series of glasses of the composition 20Na2-O-15CaO-5B2O3-5SiO2-(55 - x P2O5:xMnO2, was prepared and characterized by XRD, DSC, SEM, and Raman techniques. The samples were later immersed in simulated body fluid (SBF for checking the potential growth of hydroxyapatite layer (HA. Experiments confirmed that addition of manganese oxide leads to structural changes of the glasses. With increasing content of MnO2, the surface of the samples became more congenial for improving the growth of HA. The formation of HA layer on the surface of the samples was confirmed just after seven days of immersion. The growth rate of HA has gradually increased with the increase of MnO2 content.

Study of phase equilibria and glass formation in the CaO-WO3-P2O5 system

International Nuclear Information System (INIS)

Bielis, I.Ya.

1980-01-01

The method of quenching has been used to investigate the liquidus surface of a portion of the CaO-WO 3 -P 2 O 5 system limited by the Ca(PO 3 ) 2 -W 2 O 3 (PO 4 ) 2 and CaWO 4 -Ca 2 P 2 O 7 cross-sections. The primary crystallization fields on the compounds: WO 3 , W 2 O 3 (PO 4 ) 2 , CaWO 4 , Ca 2 P 7 O 7 , Ca(PO 3 ) 2 are separated. The liquidus surface isotherms at 900, 1000, 1100 and 1200 deg C have been plotted on the concentration triangle plane. It has been found that the cross-sections of W 2 O 3 (PO 4 ) 2 -Ca(PO 3 ) 2 , WO 3 -Ca(PO 3 ) 2 , WO 3 -Ca 2 P 2 O 7 and CaWO 4 -Ca 2 P 2 O 7 are eutectic-type quasi-binary systems. The position of the glass transition region in the CaO-WO 3 -P 2 O 5 system has been determined for the treatment temperatures of 1100, 1200 and 1300 deg C and a correlation between the configuration of the glass transition region and the phase diagram of the system has been demonstrated [ru

Ca doping of TSMTG-YBa2Cu3O7-δ/Y2BaCuO5 composites

International Nuclear Information System (INIS)

Delorme, F.; Harnois, C.; Monot-Laffez, I.; Marinel, S.

2002-01-01

Calcium doped YBa 2 Cu 3 O 7-δ /Y 2 BaCuO 5 bulk samples have been synthesised by the top-seeding-melt-texture growth (TSMTG) process up to 1 wt.% of CaCO 3 . Calcium additions up to 0.25 wt.% of CaCO 3 do not change the decomposition temperature whereas additions of 1 wt.% of CaCO 3 lead to an increase of the decomposition temperature of about 10 deg. C. This difference is not important enough to change the thermal cycle used to process YBa 2 Cu 3 O 7-δ undoped bulk samples. Microstructure studies show that no precursor or secondary phases containing calcium are present in the samples. Energy dispersive spectroscopy analyses have shown that Ca is present both in the YBa 2 Cu 3 O 7-δ matrix and the Y 2 BaCuO 5 particles. The position of the calcium atoms in the superconducting matrix is discussed. The calcium doped samples present slightly depressed critical temperatures but drastically depressed critical current densities

Quantitative analysis of crystalline and remaining glass phases in CaO-B2O3-SiO2 ternary system glass ceramics

International Nuclear Information System (INIS)

He Ming; Wu Mengqiang; Zhang Shuren; Zhou Xiaohua; Zhang Ting; Chen Song

2010-01-01

Research highlights: → As for CBS ternary system glass ceramics, due to the complex phase compositions, many methods could be difficult to determine quantitatively the absolute amounts of crystalline and remaining oxides. In this study, an available method based on the Rietveld method was used to quantitatively analyze the relative weight fraction and densities of crystalline phases. These above data are used to obtain a table of both relative weight fraction of crystalline phases and densities of all phases including CBS LTCC. Using volume additivity rule, it is possible to analysis quantitatively the absolute weight fraction of crystalline phases and also the oxides molar content in the remaining glass. - Abstract: Based on Rietveld method of X-ray techniques and volume additivity rule, a new method was developed to quantitatively analyze the phase composition of CaO-B 2 O 3 -SiO 2 ternary system glass ceramics. Lattice parameters, densities and relative weight fractions of crystalline phases in CaO-B 2 O 3 -SiO 2 ternary system were obtained by X-ray diffraction (XRD) refinement. According to the relative weight fraction of crystalline phases and densities of various components, the volume additivity rule was revealed by calculating the absolute weight fraction of crystalline phases of CaO-B 2 O 3 -SiO 2 glass ceramics. In addition, molar contents of the oxides in the remaining glass can also be determined by this method. Comparing this method with internal standard method, it is found that the maximum deviations of the crystallinity and the absolute weight fraction of crystalline phases are less than 2.6% and 2.9%, respectively. As a result, quantitative evaluation of CaO-B 2 O 3 -SiO 2 ternary system glass ceramics can be achieved using this method.

Structure determinations for Ca3Ti2O7, Ca4Ti3O10, Ca3.6Sr0.4Ti3O10 and a refinement of Sr3Ti2O7

International Nuclear Information System (INIS)

Elcombe, M.M.; Kisi, E.H.; Hawkins, K.D.; White, T.J.; Goodman, P.; Matheson, S.

1991-01-01

The structures of the orthorhombic Ruddlesden-Popper (A n+1 B n X 3n+1 ) phases Ca 3 Ti 2 O 7 (n=2) refined from neutron powder diffraction data at λ=1.893 A. They consist of coherent intergrowths of perovskite (CaTiO 3 ) blocks, n TiO 6 octahedra thick, with single layers of CaO having a distorted NaCl configuration. TiO 6 octahedra are tilted and distorted in a very similar fashion to those in CaTiO 3 (n=∞). This fact was used to determine the space groups of the layered structures. Convergent-beam electron diffraction patterns are best matched by calculations in the above space groups which are thus confirmed. Octahedral tilt angles increase slightly in the sequence n=2, 3, ∞. Strontium addition reduces the octahedral tilt angles because of preferential substitution of Sr on the Ca sites within the perovskite blocks of Ca 4 Ti 3 O 10 . The algorithm used to produce starting models for structure refinements is thought to be generally applicable to Ruddlesden-Popper and possibly other layered perovskite structures. It furnishes the predictions: (a) all n-even compounds in the Ca n+1 Ti n O 3n+1 series will have space group Ccm2 1 , (b) all n-odd compounds in this series will have space group Pcab, (c) all A n+1 B n X 3n+1 series for which the n=∞ end member (ABX 3 ) is isostructural with CaTiO 3 will be isostructural with the compounds reported above (e.g. Ca n+1 Zr n O 3n+1 ). (orig./WL)

Biodiesel production from soybean and Jatropha oils by magnetic CaFe2O4–Ca2Fe2O5-based catalyst

International Nuclear Information System (INIS)

Xue, Bao-jin; Luo, Jia; Zhang, Fan; Fang, Zhen

2014-01-01

Heterogeneous CaFe 2 O 4 –Ca 2 Fe 2 O 5 -based catalyst with weak magnetism was prepared by co-precipitation and calcination. It was characterized by various techniques including X-ray diffraction, X-ray photoelectron spectroscopy and temperature programmed desorption method. Its active components were identified as mainly Ca–Fe composite oxides such as CaFe 2 O 4 for transesterification. The magnetism was further strengthened by reducing its component of Fe 2 O 3 to Fe 3 O 4 –Fe under H 2 atmosphere for better magnetic separation. Both catalysts were used for the catalytic transesterification of soybean and Jatropha oils to biodiesel. The highest biodiesel yields for soybean oil of 85.4% and 83.5% were obtained over the weak and strong magnetic catalysts, respectively under the optimized conditions (373 K, 30 min, 15/1 methanol/oil molar ratio and 4 wt% catalyst). The catalysts could be recycled three times. Biodiesel production from pretreated Jatropha oil was tested with the magnetic CaFe 2 O 4 –Ca 2 Fe 2 O 5 –Fe 3 O 4 –Fe catalyst, and 78.2% biodiesel yield was obtained. The magnetic CaFe 2 O 4 –Ca 2 Fe 2 O 5 -based catalyst shows a potential application for the green production of biodiesel. - Highlights: • Magnetic catalyst was prepared by co-precipitation, calcination and reduction. • The catalyst was composed of CaFe 2 O 4 –Ca 2 Fe 2 O 5 –Fe 3 O 4 –Fe. • Biodiesel yields of 83.5% and 78.2% were achieved for soybean and Jatropha oils. • The catalyst was easily separated by a magnet and used for three cycles

The Vaporization of B2O3(l) to B2O3(g) and B2O2(g)

Science.gov (United States)

Jacobson, Nathan S.; Myers, Dwight L.

2011-01-01

The vaporization of B2O3 in a reducing environment leads to formation of both B2O3(g) and B2O2(g). While formation of B2O3(g) is well understood, many questions about the formation of B2O2(g) remain. Previous studies using B(s) + B2O3(l) have led to inconsistent thermodynamic data. In this study, it was found that after heating, B(s) and B2O3(l) appear to separate and variations in contact area likely led to the inconsistent vapor pressures of B2O2(g). To circumvent this problem, an activity of boron is fixed with a two-phase mixture of FeB and Fe2B. Both second and third law enthalpies of formation were measured for B2O2(g) and B2O3(g). From these the enthalpies of formation at 298.15 K are calculated to be -479.9 +/- 41.5 kJ/mol for B2O2(g) and -833.4 +/- 13.1 kJ/mol for B2O3(g). Ab initio calculations to determine the enthalpies of formation of B2O2(g) and B2O3(g) were conducted using the W1BD composite method and show good agreement with the experimental values.

Structure analysis of mutually incommensurate composite crystal (Ca0.5Y0.5)0.8CuO2

International Nuclear Information System (INIS)

Gotoh, Y.; Yamaguchi, I.; Takeya, S.; Fujihisa, H.; Honda, K.; Ito, T.; Oka, K.; Yamaguchi, H.

2006-01-01

Single-crystal X-ray structure analysis of mutually incommensurate (Ca 0.5 Y 0.5 ) 0.8 CuO 2 , 'Ca 2 Y 2 Cu 5 O 1 ' has been performed by the composite approach which leads to average substructures and their relative arrangement. The composite crystal structure of (Ca 0.5 Y 0.5 ) 0.8 CuO 2 has the CuO 2 substructure and the Ca 0.5 Y 0.5 substructure. The CuO 2 substructure with a 1 = 10.598(2) A, b = 6.189(2) A, c 1 = 2.825(2) A, β 1 = 90.19(4) o , V 1 = 185.4(1) A 3 , Z = 4 and space group F2/m has the plane of edge-shared one-dimensional CuO 2 chains along the c-axis. The Ca 0.5 Y 0.5 substructure with a 2 = 10.629(2) A, b = 6.189(2) A, c 2 3.517(1) A, β 2 = 94.36(3) o , V 2 = 230.7(1) A 3 , Z = 4 and space group F2/m forms the sheet of (Ca, Y) atoms in the ac-plane. By considering (3 + 1)-dimensional superspace group symmetry, it is concluded that the incommensurate composite crystal structure of (Ca 0.5 Y 0.5 ) 0.8 CuO 2 should be described by the combination of F2/m for the CuO 2 substructure and F2/c for the Ca 0.5 Y 0.5 substructure. The composite approach has made clear that the plane of CuO 2 chains and the sheet of (Ca, Y) atoms stack alternately to form a mutually incommensurate composite crystal with layered substructures

Properties and Crystallization Phenomena in Li2Si2O5–Ca5(PO4)3F and Li2Si2O5–Sr5(PO4)3F Glass–Ceramics Via Twofold Internal Crystallization

Science.gov (United States)

Rampf, Markus; Dittmer, Marc; Ritzberger, Christian; Schweiger, Marcel; Höland, Wolfram

2015-01-01

The combination of specific mechanical, esthetic, and chemical properties is decisive for the application of materials in prosthodontics. Controlled twofold crystallization provides a powerful tool to produce special property combinations for glass–ceramic materials. The present study outlines the potential of precipitating Ca5(PO4)3F as well as Sr5(PO4)3F as minor crystal phases in Li2Si2O5 glass–ceramics. Base glasses with different contents of CaO/SrO, P2O5, and F− were prepared within the glasses of the SiO2–Li2O–K2O–CaO/SrO–Al2O3–P2O5–F system. Preliminary studies of nucleation by means of XRD and scanning electron microscopy (SEM) of the nucleated base glasses revealed X-ray amorphous phase separation phenomena. Qualitative and quantitative crystal phase analyses after crystallization were conducted using XRD in combination with Rietveld refinement. As a main result, a direct proportional relationship between the content of apatite-forming components in the base glasses and the content of apatite in the glass–ceramics was established. The microstructures of the glass–ceramics were investigated using SEM. Microstructural and mechanical properties were found to be dominated by Li2Si2O5 crystals and quite independent of the content of the apatite present in the glass–ceramics. Biaxial strengths of up to 540 MPa were detected. Ca5(PO4)3F and Sr5(PO4)3F influence the translucency of the glass–ceramics and, hence, help to precisely tailor the properties of Li2Si2O5 glass–ceramics. The authors conclude that the twofold crystallization of Li2Si2O5–Ca5(PO4)3F or Li2Si2O5–Sr5(PO4)3F glass–ceramics involves independent solid-state reactions, which can be controlled via the chemical composition of the base glasses. The influence of the minor apatite phase on the optical properties helps to achieve new combinations of features of the glass–ceramics and, hence, displays new potential for dental applications. PMID:26389112

Investigations on FCAM-III (Ca2.38Mg2.09Fe3+10.61Fe2+1.59Al9.33O36): A new homologue of the aenigmatite structure-type in the system CaO-MgO-Fe2O3-Al2O3

Science.gov (United States)

Zöll, Klaus; Kahlenberg, Volker; Krüger, Hannes; Tropper, Peter

2018-02-01

In the course of a systematic study of a part of the quaternary system Fe2O3-CaO-Al2O3-MgO (FCAM) the previously unknown compound Ca2.38Mg2.09Fe3+10.61Fe2+1.59Al9.33O36 (FCAM-III) has been synthesized. By analogy with the so-called SFCA series [1-5], our investigation in the system of FCAM shows the existence of a stoichiometric homologous series M14+6nO20+8n, where M = Fe, Ca, Al, Mg and n = 1 or 2. In air, we can prove the formation of coexisting FCAM-III and FCAM-I solid solutions at 1400 °C. By increasing the temperature up to 1425 °C FCAM-I disappears completely and FCAM-III co-exists with magnesiumferrite and a variety of calcium iron oxides. At 1450 °C FCAM-III breaks down to a mixture of FCAM-I again as well as magnesioferrite and melt. Small single-crystals of FCAM-III up to 35 μm in size could be retrieved from the 1425 °C experiment and were subsequently characterized using electron microprobe analysis and synchroton X-ray single-crystal diffraction. Finally the Fe2+/Fetot ratio was calculated from the total iron content based on the crystal-chemical formula obtained from EMPA measurements and charge balance considerations. FCAM-III or Ca2.38Mg2.09Fe3+10.61Fe2+1.59Al9.33O36 has a triclinic crystal structure (space group P 1 ̅). The basic crystallographic data are: a = 10.223(22) Å, b = 10.316(21) Å, c = 14.203(15) Å, α = 93.473(50)°, β = 107.418(67)°, γ = 109.646(60)°, V = 1323.85(2) ų, Z = 1. Using Schreinemaker's technique to analyze the phase relations in the system Fe2O3-CaO-Al2O3-MgO it was possible to obtain the semi-quantitative stability relations between the participating phases and construct a topologically correct phase sequence as a function of T and fO2. The analysis shows that Ca2Al0.5Fe1.5O5 (C2A0.25F0.75) and CaAl1.5Fe2.5O7 (CA0.75F1.25) with higher calculated Fe2+ contents are preferably formed at lower oxygen fugacity and react to CaAl0.5Fe1.5O4 (CA0.25F0.75) by increasing fO2. Spinel-type magnesium

In vivo evaluation of CaO-SiO2-P2O5-B2O3 glass-ceramics coating on Steinman pins.

Science.gov (United States)

Lee, Jae Hyup; Hong, Kug Sun; Baek, Hae-Ri; Seo, Jun-Hyuk; Lee, Kyung Mee; Ryu, Hyun-Seung; Lee, Hyun-Kyung

2013-07-01

Surface coating using ceramics improves the bone bonding strength of an implant. We questioned whether a new type of glass-ceramics (BGS-7) coating (CaO-SiO2 -P2 O5 -B2 O3 ) would improve the osseointegration of Steinman pins (S-pins) both biomechanically and histomorphometrically. An in vivo study was performed using rabbits by inserting three S-pins into each iliac bone. The pins were 2.2-mm S-pins with a coating of 30-μm-thick BGS-7 and 550-nm-thick hydroxyapatite (HA), as opposed to an S-pin without coating. A tensile strength test and histomorphometrical evaluation was performed. In the 2-week group, the BGS-7 implant showed a significantly higher tensile strength than the S-pin. In the 4- and 8-week groups, the BGS-7 implants had significantly higher tensile strengths than the S-pins and HA implants. The histomorphometrical study revealed that the BGS-7 implant had a significantly higher contact ratio than the S-pin and HA implants in the 4-week group. The biomechanical and histomorphometrical tests showed that the BGS-7 coating had superior bone bonding properties than the groups without the coating from the initial stage of insertion. The BGS-7 coating of an S-pin will enhance the bone bonding strength, and there might also be an advantage in human bone bonding. © 2013, Copyright the Authors. Artificial Organs © 2013, International Center for Artificial Organs and Transplantation and Wiley Periodicals, Inc.

Photoinduced structural transformation of SrFeO3 and Ca2Fe2O5 during photodegradation of methyl orange

International Nuclear Information System (INIS)

Yang Yang; Cao Zhengquan; Jiang Yinshan; Liu Lihua; Sun Yanbin

2006-01-01

Photodegradation of methyl orange solution under UV light irradiation have been studied over photocatalyst perovskite SrFeO 3 and brownmillerite Ca 2 Fe 2 O 5 . XRD and FTIR analysis show that both SrFeO 3 and Ca 2 Fe 2 O 5 transform to carbonates during the photodegradation process of methyl orange. This result indicates that UV light irradiation induce a photochemical reaction between photocatalysts and CO 2 released from the photodegradation of methyl orange. The photochemical reaction between photocatalysts and CO 2 is responsible for the transformation of the structures. The fact that SrFeO 3 has better photocatalytic property and endures serious transformation than Ca 2 Fe 2 O 5 is due to existence of unstable Fe (IV) in the perovskite structure of SrFeO 3. Such kind of Fe (IV) makes perovskite structure unstable and sensitive to ambient (especially sensitive to UV light irradiation)

Activity of RE/sub 2/O/sub 3/ in liquid La/sub 2/O/sub 3/-Al/sub 2/O/sub 3/-CaF/sub 2/ and Ce/sub 2/O/sub 3/-CaO-CaF/sub 2/ slags

International Nuclear Information System (INIS)

Changzhen, W.; Shuqing, Y.; Qieng, D.

1985-01-01

In the course of electro-slag refining, if the slag contains rare earth oxides, the amount of rare earth introduced to the steel depends on the composition of the slag and other conditions. The main aim of this investigation is to study the activity of RE/sub 2/O/sub 3/ in the electro-slags of various compositions. One is the La/sub 2/O/sub 3/-CaO-CaF/sub 2/ ternary slag system and the other is the Ce/sub 2/O/sub 3/-CaO-CaF/sub 2/ slag system. The iso-activity diagram for RE/sub 2/O/sub 3/ and the liquid boundary for slags system were estimated

A common behaviour of thermoelectric layered cobaltites: incommensurate spin density wave states in [Ca2Co4/3Cu2/3O4]0.62[CoO2] and [Ca2CoO3]0.62[CoO2

International Nuclear Information System (INIS)

Sugiyama, J; Brewer, J H; Ansaldo, E J; Itahara, H; Dohmae, K; Xia, C; Seno, Y; Hitti, B; Tani, T

2003-01-01

Magnetism of a misfit layered cobaltite [Ca 2 Co 4/3 Cu 2/3 O 4 ] x RS [CoO 2 ] (x ∼ 0.62, RS denotes a rocksalt-type block) was investigated by a positive muon spin rotation and relaxation (μ + SR) experiment. A transition to an incommensurate (IC) spin density wave (SDW) state was found below 180 K (= T C on ); and a clear oscillation due to a static internal magnetic field was observed below 140 K(= T C ). Furthermore, an anisotropic behaviour of the zero-field μ + SR experiment indicated that the IC-SDW lies in the a-b plane, with oscillating moments directed along the c axis. These results were quite similar to those for the related compound [Ca 2 CoO 3 ] 0.62 RS [CoO 2 ], i.e., Ca 3 Co 4 O 9 . Since the IC-SDW field in [Ca 2 Co 4/3 Cu 2/3 O 4 ] 0.62 RS [CoO 2 ] was approximately the same as those in pure and doped [Ca 2 CoO 3 ] 0.62 RS [CoO 2 ], it was concluded that the IC-SDW exists in the [CoO 2 ] planes

Ca2Cr0.5Ga1.5O5—An extremely redox-stable brownmillerite phase

International Nuclear Information System (INIS)

Luo, Kun; Amano Patino, Midori; Hayward, Michael A.

2015-01-01

Investigation of the Ca 2 Cr x Ga 2−x O 5 compositional series reveals a maximum chromium solubility of 25%. The most chromium rich composition, Ca 2 Cr 0.5 Ga 1.5 O 5 , adopts a brownmillerite-type anion deficient perovskite structure described in space group Pnma (a=5.368 Å, b=14.547 Å, c=5.593 Å). Neutron powder diffraction data reveals rigorous B-site cation order, with all of the tetrahedral coordination sites occupied exclusively by gallium and the octahedral coordination sites occupied by gallium or chromium. Annealing studies reveals Ca 2 Cr 0.5 Ga 1.5 O 5 is stable in both oxidizing (100% O 2 ) and reducing (5% H 2 in N 2 ) conditions up to 800 °C, suggesting it could find application as a stable host lattice for fuel cell electrodes or electrolytes with suitable doping to enhance catalytic behaviour and/or anionic conductivity. - Graphical abstract: Ca 2 Cr 0.5 Ga 1.5 O 5 , adopts a brownmillerite-type anion deficient perovskite structure yet it is stable in both oxidizing (100% O 2 ) and reducing (5% H 2 in N 2 ) conditions up to 800 °C. - Highlights: • Anion deficient oxide stable to both oxidation and reduction up to 800 °C. • Cation-ordered brownmillerite structure determined by powder neutron diffraction. • Low solubility of Cr 3+ in framework due to spherical d 3 electron configuration

THE THERMODYNAMIC PROPERTIES OF MELTS OF DOUBLE SYSTEM MgO – Al2O3, MgO – SiO2, MgO – CaF2, Al2O3 – SiO2, Al2O3 – CaF2, SiO2 – CaF2

Directory of Open Access Journals (Sweden)

В. Судавцова

2012-04-01

Full Text Available Methodology of prognostication of thermodynamics properties of melts is presented from the coordinatesof liquidus of diagram of the state in area of equilibria a hard component is solution, on which energies ofmixing of Gibbs are expected in the double border systems of MgO – Al2O3, MgO – SiO2, MgO – CaF2,Al2O3 – SiO2, Al2O3 - CaF2, SiO2 - CaF2. For the areas of equilibrium there is quasibinary connection(MgAl2O4, Mg2SiO4, Al6Si2O13 – a grout at calculations was used equalization of Hauffe-Wagner. Theobtained data comport with literary

Raman, FTIR, thermal and optical properties of TeO2-Nb2O5-B2O3-V2O5 quaternary glass system

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Swapna

2017-07-01

Full Text Available A series of quaternary glass systems with the composition 79TeO2-(20−xNb2O5-xB2O3-1V2O5 was prepared using the melt quench technique. Such studies as optical absorption, Raman, FTIR spectroscopy, EPR and DSC were carried out on the glass system. The physical properties, such as density (ρ and molar volume (VM, were determined. The Urbach energy (ΔE, optical band gap (Eopt, optical basicity (Λ, refractive index (n and electron polarizability (α of the glasses were determined from optical absorption data. Spin-Hamiltonian parameters of VO2+ ions were calculated from the EPR data. With the gradual substitution of B2O3 at the expense of Nb2O5, the density and optical band gap of the glasses decreased, and the electronic polarizability increased. EPR spectra revealed that VO2+ occupies an octahedral site with tetrahedral compression. Spin-Hamiltonian parameters g|| and g⊥ increased as B2O3 content increased in the glass. The glass transition temperature (Tg also decreased as the B2O3 content in the glass increased.

Development and characterization of glass-ceramic sealants in the (CaO-Al2O3-SiO2-B2O3) system for Solid Oxide Electrolyzer Cells

International Nuclear Information System (INIS)

Khedim, Hichem; Nonnet, Helene; Mear, Francois O.

2012-01-01

The efficiency of glass-ceramic sealants plays a crucial role in Solid Oxide Electrolyzer Cell performance and durability. In order to develop suitable sealants, operating around 800 degrees C, two parent glass compositions, CAS1B and CAS2B, from the CaO-Al 2 O 3 -SiO 2 -B 2 O 3 system were prepared and explored. The thermal and physicochemical properties of the glass ceramics and their crystallization behavior were investigated by HSM. DTA and XRD analyses. The microstructure and chemical compositions of the crystalline phases were investigated by microprobe analysis. Bonding characteristic as well as chemical interactions of the parent glass with yttria-stabilized zirconia (YSZ) electrolyte and ferritic steel-based interconnect (Crofere (R)) were also investigated. The preliminary results revealed the superiority of CAS2B glass for sealing application in SOECs. The effect of minor additions of V 2 O 5 , K 2 O and TiO 2 on the thermal properties was also studied and again demonstrated the advantages of the CAS2B glass composition. Examining the influence of heat treatment on the seal behavior showed that the choice of the heating rate is a compromise between delaying the crystallization process and delaying the viscosity drop. The thermal Expansion Coefficients (TEC) obtained for the selected glass ceramic are within the desired range after the heat treatment of crystallization. The crystallization kinetic parameters of the selected glass composition were also determined under non-isothermal conditions by means of differential thermal analysis (DTA) and using the formal theory of transformations for heterogeneous nucleation. (authors)

Temperature compensation effects of TiO2 on Ca[(Li1/3Nb2/3)0.8Sn0.2]O3-δ microwave dielectric ceramic

Science.gov (United States)

Hu, Mingzhe; Wei, Huanghe; Xiao, Lihua; Zhang, Kesheng; Hao, Yongde

2017-10-01

The crystal structure and dielectric properties of TiO2-modified Ca[(Li1/3Nb2/3)0.8Sn0.2]O3-δ microwave ceramics are investigated in the present paper. The crystal structure is probed by XRD patterns and their Rietveld refinement, results show that a single perovskite phase is formed in TiO2-modified Ca[(Li1/3Nb2/3)0.8Sn0.2]O3-δ ceramics with the crystal structure belonging to the orthorhombic Pbnm 62 space group. Raman spectra results indicate that the B-site order-disorder structure transition is a key point to the dielectric loss of TiO2-modified Ca[(Li1/3Nb2/3)0.8Sn0.2]O3-δ ceramics at microwave frequencies. After properly modified by TiO2, the large negative temperature coefficient of Ca[(Li1/3Nb2/3)0.8Sn0.2]O3-δ ceramic can be compensated and the optimal microwave dielectric properties can reach 𝜀r = 25.66, Qf = 18,894 GHz and TCF = -6.3 ppm/∘C when sintered at 1170∘C for 2.5 h, which manifests itself for potential use in microwave dielectric devices for modern wireless communication.

Effects of Y2O3 on crystallization kinetics of SiO2-Al2O3-CaO-CaF2 oxy-fluoride glass-ceramic system

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M. Soleymani Zarabad

Full Text Available Differential thermal analysis (DTA patterns of SiO2-Al2O3-CaO-CaF2 oxy-fluoride glass system with adding different amounts of Y2O3 from 0.5 (wt% to 1.5 (wt% have been studied under isochronal circumstances. It is concluded that, the crystallization of the glasses is a process controlled by Avrami nucleation, three dimensional diffusion controlled growth and anisotropic growth impingement mode. Afterwards, the effective activation energy Qp, growth exponent, nucleation activation energy QN, and growth activation energy QG, have been determined and were in the range of 283–321 kJ mol−1, 2.05–2.25, 190–249 kJ mol−1 and 325–349 kJ mol−1, respectively. Qp, QN, QG and np are increased with increase of Y2O3 amount, which is related to the network forming role of Y2O3 in these systems. Keywords: Oxy-fluoride glass-ceramics, Activation energy, Crystallization mechanism, Growth exponent

Thermoluminescence and optically stimulated luminescence properties of Dy{sup 3+}-doped CaO–Al{sub 2}O{sub 3}–B{sub 2}O{sub 3}-based glasses

Energy Technology Data Exchange (ETDEWEB)

Yahaba, T., E-mail: takuma.yahaba.s1@dc.tohoku.ac.jp [Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-07 Aramaki Aza Aoba, Aoba-ku, Sendai 980-8579 (Japan); Fujimoto, Y. [Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-07 Aramaki Aza Aoba, Aoba-ku, Sendai 980-8579 (Japan); Yanagida, T. [Nara Institute of Science and Technology (NAIST), 8916-5 Takayama, Ikoma 630-0192 (Japan); Koshimizu, M.; Tanaka, H.; Saeki, K.; Asai, K. [Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-07 Aramaki Aza Aoba, Aoba-ku, Sendai 980-8579 (Japan)

2017-02-01

We developed Dy{sup 3+}-doped CaO–Al{sub 2}O{sub 3}–B{sub 2}O{sub 3} based glasses with Dy concentrations of 0.5, 1.0, and 2.0 mol% using a melt-quenching technique. The as-synthesized glasses were applicable as materials exhibiting thermoluminescence (TL) and optically stimulated luminescence (OSL). The optical and radiation response properties of the glasses were characterized. In the photoluminescence (PL) spectra, two emission bands due to the {sup 4}F{sub 9/2} → {sup 6}H{sub 15/2} and {sup 4}F{sub 9/2} → {sup 6}H{sub 13/2} transitions of Dy{sup 3+} were observed at 480 and 580 nm. In the OSL spectra, the emission band due to the {sup 4}F{sub 9/2} → {sup 6}H{sub 15/2} transition of Dy{sup 3+} was observed. Excellent TL and OSL responses were observed for dose ranges of 0.1–90 Gy. In addition, TL fading behavior was better than that of OSL in term of the long-time storage. These results indicate that the Dy{sup 3+}-doped CaO–Al{sub 2}O{sub 3}–B{sub 2}O{sub 3}-based glasses are applicable as TL materials.

A novel high color purity blue-emitting phosphor: CaBi{sub 2}B{sub 2}O{sub 7}:Tm{sup 3+}

Energy Technology Data Exchange (ETDEWEB)

Li, Jiangong, E-mail: lijiangong01@gmail.com [Department of Electronic Science and Engineering, Huanghuai University, Zhumadian 463000 (China); Yan, Huifang [Department of Foreign Languages and Literature, Huanghuai University, Zhumadian 463000 (China); Yan, Fengmei [Department of Chemistry and Chemical Engineering, Huanghuai University, Zhumadian 463000 (China)

2016-07-15

Graphical abstract: - Highlights: • A series of Tm{sup 3+}-doped CaBi{sub 2}B{sub 2}O{sub 7} blue-emitting phosphors were prepared. • The optimum doping content of Tm{sup 3+} ions was found. • The critical distance and concentration quenching mechanism was discussed. • The color purity of as prepared sample was analyzed and compared. - Abstract: A series of Tm{sup 3+}-doped CaBi{sub 2−x}B{sub 2}O{sub 7}:xTm{sup 3+} (0.02 ≤ x ≤ 0.12) blue-emitting phosphors with high color purity were prepared by solid-state reaction method. The crystal structure and luminescence properties of the as-prepared phosphors were studied. This phosphor shows a satisfactory blue performance (peak at 453 nm) due to the {sup 1}D{sub 2} → {sup 3}F{sub 4} transition of Tm{sup 3+} excited by 357 nm light. Investigation of Tm{sup 3+} content dependent emission spectra indicates that x = 0.04 is the optimum doping content of Tm{sup 3+} ions in the CaBi{sub 2}B{sub 2}O{sub 7} host. The critical distance and the concentration quenching mechanism were also investigated. In particular, the color purity of as prepared sample was analyzed and the result shows that the color purity of CaBi{sub 2}B{sub 2}O{sub 7}:Tm{sup 3+} is higher than the commercial blue phosphor BaMgAl{sub 10}O{sub 17}:Eu{sup 2+} (BAM:Eu{sup 2+}) and the latest reported Tm{sup 3+} doped blue phosphors. The present work suggests that the CaBi{sub 2}B{sub 2}O{sub 7}:Tm{sup 3+} phosphor is a potential blue-emitting candidate for the application in the near-UV WLEDs.

Solid Phase Equilibrium Relations in the CaO-SiO2-Nb2O5-La2O3 System at 1273 K

Science.gov (United States)

Qiu, Jiyu; Liu, Chengjun

2018-02-01

Silicate slag system with additions Nb and RE formed in the utilization of REE-Nb-Fe ore deposit resources in China has industrial uses as a metallurgical slag system. The lack of a phase diagram, theoretical, and thermodynamic information for the multi-component system restrict the comprehensive utilization process. In the current work, solid phase equilibrium relations in the CaO-SiO2-Nb2O5-La2O3 quaternary system at 1273 K (1000 °C) were investigated experimentally by the high-temperature equilibrium experiment followed by X-ray diffraction, scanning electron microscope, and energy dispersive spectrometer. Six spatial independent tetrahedron fields in the CaO-SiO2-Nb2O5-La2O3 system phase diagram were determined by the Gibbs Phase Rule. The current work combines the mass fraction of equilibrium phase and corresponding geometric relation. A determinant method was deduced to calculate the mass fraction of equilibrium phase in quaternary system according to the Mass Conservation Law, the Gibbs Phase Rule, the Lever's Rule, and the Cramer Law.

Thermal and electrical properties of 60V2O5–5P2O5–(35− x) B2O3 ...

Indian Academy of Sciences (India)

The samples of composition 60V2O5–5P2O5–(35−)B2O3–CeO2, = 1, 2, 3, 4 and 5 mol% were prepared by the melt-quench method. The prepared samples were characterized by X-ray diffraction, thermogravimetric-differential thermal analysis and impedance spectroscopy. The activation energies were evaluated ...

Research of the lime rich portions of the CaO-SiO2-P2O5 system

Directory of Open Access Journals (Sweden)

Puertas, F.

1995-03-01

Full Text Available A detailed study has been carried out to explain the influence of Pp^ in silicate phases and in industrial raw meals upon their mineralogical compositions. Some compositions in the lime rich portion of the CaO-SiO2-P2O5 system are studied using laboratory reactants. The results showed that the compositions lying in the range of CaO = 69,5-70,1; P2O5= 16,2-19,5; SiO2 = 11,1-13,6 (wt% give, at 1000 °C, the mineralogical composition (HAp, β-C2S, C5PS which can develop a high strength in chemically bonded ceramics. At high temperature (1400 ºC these compositions give a large amount of silicocarnotite (C5PS and 2C2.C3P phase. A selected composition of the industrial raw meal with added phosphate: CaO = 62,66; SiO2 -= 17,33; Al2O3 = 4,88; Fe2O3 = 4,29; P2O5 = 8,73; MgO = 2,09 (wt% forms at 1350 ºC a clinker containing high amount of α-C2S to replace C3S. Such a clinker may have good applications in the synthesis of active belite cement.Se estudia con detalle la influencia del P2O5 sobre las composiciones mineralógicas en fases silicato y en un crudo industrial. Asimismo se estudian algunas composiciones de la zona rica en cal del sistema CaO-SiO2-P2O5 utilizando reactivos químicos. Los resultados demuestran que, a presión atmosférica y recinto abierto, las composiciones dentro de los límites CaO = 69,5-70,1; P2O5= 16,2-19,5; SiO2 = 11,1-13,6 (% en peso dan a 1000ºC la composición mineralógica siguiente: HAp, β-C2S, C5PS; pueden desarrollar una alta resistencia química en "chemically bonded ceramics". A altas temperaturas (1400°C producen una elevada proporción de silicocarnotita (C5PS S y la fase 2C2.C3P. Con la adición de fosfato a una determinada dosificación de crudo industrial (CaO = 62,66; SiO2 = 17,33; Al2O3 = 4,88; Fe2O3 = 4,29; P2O5 = 8,73; MgO = 2,09 -% en peso- se forma, a 1350°C, un clinker que contiene una alta proporción de α-C2S que reemplaza al C3S. Este clinker puede tener buenas aplicaciones en la obtención de

Synthesis, crystal structure refinement, and nonlinear-optical properties of CaB3O5(OH): Comparative crystal chemistry of calcium triborates

International Nuclear Information System (INIS)

Yamnova, N. A.; Aksenov, S. M.; Stefanovich, S. Yu.; Volkov, A. S.; Dimitrova, O. V.

2015-01-01

Calcium triborate CaB 3 O5(OH) obtained by hydrothermal synthesis in the Ca(OH) 2 –H 3 BO 3 –Na 2 CO 3 –KCl system is studied by single-crystal X-ray diffraction. The parameters of the orthorhombic unit cell are as follows: a = 13.490(1), b = 6.9576(3), and c = 4.3930(2) Å; V = 412.32(3) Å 3 and space group Pna2 1 . The structure is refined in the anisotropic approximation of the atomic displacement parameters to R = 4.28% using 972 vertical bar F vertical bar > 4σ(F). It is confirmed that the crystal structure of Ca triborate CaB 3 O 5 (OH) is identical to that described earlier. The hydrogen atom is localized. An SHG signal stronger than that of the quartz standard is registered. The phase transition of calcium triborate into calciborite is found on heating. The comparative crystal-chemical analysis of a series of borates with the general chemical formula 2CaO · 3B 2 O 3 · nH 2 O (n = 0–13) with the constant CaO: B 2 O 3 = 2: 3 ratio and variable content of water is performed

Synthesis, cytotoxicity, and hydroxyapatite formation in 27-Tris-SBF for sol-gel based CaO-P2O5-SiO2-B2O3-ZnO bioactive glasses.

Science.gov (United States)

Kaur, Gurbinder; Pickrell, G; Kimsawatde, G; Homa, D; Allbee, H A; Sriranganathan, N

2014-03-18

CaO-P2O5-SiO2-B2O3-ZnO bioactive glasses were prepared via an optimized sol-gel method. The current investigation was focused on producing novel zinc based calcium phosphoborosilicate glasses and to evaluate their mechanical, rheological, and biocompatible properties. The morphology and composition of these glasses were studied using X-ray diffraction (XRD) and scanning electron microscopy (SEM). The particle size, mechanical and flexural strength was also determined. Furthermore, the zeta potential of all the glasses were determined to estimate their flocculation tendency. The thermal analysis and weight loss measurements were carried out using differential scanning calorimetry (DSC) and thermogravimetric analysis (TGA) respectively. For assessing the in-vitro bioactive character of synthesized glasses, the ability for apatite formation on their surface upon their immersion in simulated body fluid (SBF) was checked using SEM and pH measurements. MTS assay cytotoxicity assay and live-dead cell viability test were conducted on J774A.1 cells murine macrophage cells for different glass concentrations.

Bending strength of glass-ceramics based on 3CaO.P2O5-SiO2-MgO glass system

International Nuclear Information System (INIS)

Daguano, J.K.M.F.; Suzuki, P.A.; Santos, C.; Fernandes, M.H.V.; Elias, C.N.

2009-01-01

In this work, the Modulus of Rupture of bioactive glass-ceramic based on 3CaO.P 2 O 5 -SiO 2 -MgO system was investigated, aiming its use in bone-restorations. The mechanical property was correlated with microstructural and crystallographic features of this material. High-purity starting-powders, CaCO 3 , SiO 2 , MgO, Ca (H 2 PO 4 ).H 2 O, were used in this study. The powders were mixed in a stoichiometric ratio, using planetary ball-mill. The suspensions were dried, sieved and melted at 1600 deg C, for 4h. The casting ones were cooled quickly until annealing temperature 700 deg C, in which remained for 2h, with controlled cooling-rate until ambient temperature. Bulks of glass were heat-treated with temperatures varying between 700 deg C and 1100 deg C, for 4h, being after that, cooled at 3 deg C/min. Bioactive glass and glass-ceramic were characterized by HRXRD (high resolution X-ray diffraction), where whitlockite was main phase. The microstructure was analyzed by scanning electronic microscopy. Modulus of Rupture was determined by four-point bending testing using specimens of 1.5 x 2 x 25 mm and glasses presented strength near to 70MPa, while glass ceramics treated at 975 deg C-4h, presented bending strength of 120MPa. (author)

Enrichment of W2B5 from WO3 and B2O3 by Double SHS Method

Directory of Open Access Journals (Sweden)

Bora DERIN

2018-02-01

Full Text Available A second self-propagating high-temperature synthesis (SHS was carried out to enrich the W2B5 content in the SHS product containing a mixture of various tungsten boride compounds. In the experiment, the process called Double-SHS (D-SHS was conducted in two steps. In the first SHS reaction, an initial molar composition ratio of WO3:B2O3:Mg mixture was selected as 1:3:8. The product was then hot-leached with hydrochloric acid to eliminate MgO and Mg3B2O6 phases. The leached product, consisting of 72.6 wt.% W2B5, 16.1 wt.% WB, 8.4 wt.% W2B, and 2.9 wt.% W, was again reacted with the Mg and B2O3 mixture by second SHS. After another acid leaching step, W2B5 content in the D-SHS product was found to be 98.2 wt.%. The study showed that D-SHS is an effective method for boron enrichment in the tungsten compounds.DOI: http://dx.doi.org/10.5755/j01.ms.24.1.17834

Bending strength of glass-ceramics based on 3CaO.P{sub 2}O{sub 5}-SiO{sub 2}-MgO glass system; Resistencia a fratura de vitroceramicos do sistema 3CaO.P{sub 2}O{sub 5}-SiO{sub 2}-MgO

Energy Technology Data Exchange (ETDEWEB)

Daguano, J.K.M.F.; Suzuki, P.A.; Santos, C. [Universidade de Sao Paulo (EEL/USP), Lorena, SP (Brazil). Escola de Engenharia de Lorena. Dept. de Engenharia de Materiais; Fernandes, M.H.V. [Universidade de Aveiro (UAveiro/CECICO), Aveiro (Portugal). Centro de Investigacao em Materiais Ceramicos e Compositos. Dept. de Engenharia Ceramica e do Vidro; Elias, C.N. [Instituto Militar de Engenharia (IME), Rio de Janeiro, RJ (Brazil). Lab. de Biomateriais

2009-07-01

In this work, the Modulus of Rupture of bioactive glass-ceramic based on 3CaO.P{sub 2}O{sub 5}-SiO{sub 2}-MgO system was investigated, aiming its use in bone-restorations. The mechanical property was correlated with microstructural and crystallographic features of this material. High-purity starting-powders, CaCO{sub 3}, SiO{sub 2}, MgO, Ca (H{sub 2}PO{sub 4}).H{sub 2}O, were used in this study. The powders were mixed in a stoichiometric ratio, using planetary ball-mill. The suspensions were dried, sieved and melted at 1600 deg C, for 4h. The casting ones were cooled quickly until annealing temperature 700 deg C, in which remained for 2h, with controlled cooling-rate until ambient temperature. Bulks of glass were heat-treated with temperatures varying between 700 deg C and 1100 deg C, for 4h, being after that, cooled at 3 deg C/min. Bioactive glass and glass-ceramic were characterized by HRXRD (high resolution X-ray diffraction), where whitlockite was main phase. The microstructure was analyzed by scanning electronic microscopy. Modulus of Rupture was determined by four-point bending testing using specimens of 1.5 x 2 x 25 mm and glasses presented strength near to 70MPa, while glass ceramics treated at 975 deg C-4h, presented bending strength of 120MPa. (author)

Glass formation in AgI:Ag2O:V2O5 and AgI:Ag2O:(V2O5+B2O3) systems

International Nuclear Information System (INIS)

Kaushik, R.; Hariharan, K.

1988-01-01

Transport properties of glasses in the system AgI:Ag 2 O: V 2 O 5 and AgI:Ag 2 O: (V 2 O 5 +B 2 O 3 ) have ben investigated. It was found that, at high AgI concentrations, the addition of another glass former (B 2 O 3 ) did not improve the conduction characteristics of the pure vanadate glasses, the best conducting composition of which had ambient temperature, ionic conductivity comparable to that of conventional liquid electrolytes. The highest conducting composition was used as an electrolyte in the study of silver solid state cells. The discharge characteristics of different cells fabricated with the glassy electrolyte, have been compared with those having the best conducting polycrystalline ompositions as electrolytes. 11 refs.; 4 figs.; 1 table

Formation pathways in the synthesis and properties of (Tl0.5Pb0.5)(Sr0.9Ba0.1)2Ca2Cu3Oz and (Tl0.5Pb0.5)(Sr0.8Ba0.2)2Ca2Cu3Oz-1223 superconductors

International Nuclear Information System (INIS)

Auinger, M; Gritzner, G; Bertrand, Ch; Galez, Ph; Soubeyroux, J-L

2007-01-01

The formation pathway of (Tl 0.5 Pb 0.5 )(Sr 0.9 Ba 0.1 ) 2 Ca 2 Cu 3 O z and (Tl 0.5 Pb 0.5 )(Sr 0.8 Ba 0.2 ) 2 Ca 2 Cu 3 O z was studied by neutron and x-ray diffraction. The following reaction pathway was proposed: thallium oxide and lead oxide react with Sr-rich (Sr 1-x Ca x )CuO 2 and Ca-rich (Ca x Sr 1-x )O to form Sr 4 Tl 2 O 7 and (Ca x Sr 1-x )PbO 3 , respectively. The thallate and the plumbate compounds then form the (Tl 0.5 Pb 0.5 )-1212 phase starting at a temperature of 600 deg. C. Finally, between 850 and 900 deg. C, the 1223 phase is formed from (Tl 0.5 Pb 0.5 )-1212 (Ca x Sr 1-x ) 2 CuO 3 and CuO. Parallel experiments to fabricate the (Tl, Pb)-1223 superconductor resulted in specimens with critical temperatures of 117.5 K and 116 K, respectively, and transition widths of 2 K. Differences between the pathways for the formation of Pb-doped, Sr-rich and Pb-free, Ba-rich Tl-1223 superconductors are discussed

Ca 3d unoccupied states in Bi2Sr2CaCu2O8 investigated by Ca L2,3 x-ray-absorption near-edge structure

International Nuclear Information System (INIS)

Borg, A.; King, P.L.; Pianetta, P.; Lindau, I.; Mitzi, D.B.; Kapitulnik, A.; Soldatov, A.V.; Della Longa, S.; Bianconi, A.

1992-01-01

The high-resolution Ca L 2,3 x-ray-absorption near-edge-structure (XANES) spectrum of a Bi 2 Sr 2 CaCu 2 O 8 single crystal has been measured by use of a magnetic-projection x-ray microscope probing a surface area of 200x200 μm 2 . The Ca L 2,3 XANES spectrum is analyzed by performing a multiple-scattering XANES calculation in real space and comparing the results with the spectrum of CaF 2 . Good agreement between the calculated and experimental crystal-field splitting Δ f of the Ca 3d final states is found and the splitting is shown to be smaller by 0.5 eV than in the initial state. The Ca 3d partial density of states is found to be close to the Fermi level in the initial state. The Ca-O(in plane) distance is shown to be a critical parameter associated with the shift of the Ca 3d states relative to the Fermi level; in particular, we have studied the effect of the out-of-plane dimpling mode of the in-plane oxygen atoms O(in plane) that will move the Ca 3d states on or off the Fermi level. This mode can therefore play a role in modulating the charge transfer between the two CuO 2 planes separated by the Ca ions

Bioactivity of gel-glass powders in the CaO-SiO2 system: a comparison with ternary (CaO-P2O5-SiO2) and quaternary glasses (SiO2-CaO-P2O5-Na2O).

Science.gov (United States)

Saravanapavan, Priya; Jones, Julian R; Pryce, Russell S; Hench, Larry L

2003-07-01

Bioactive glasses react chemically with body fluids in a manner that is compatible with the repair processes of the tissues. This results in the formation of an interfacial bond between the glasses and living tissue. Bioactive glasses also stimulate bone-cell proliferation. This behavior is dependent on the chemical composition as well as the surface texture of the glasses. It has been recently reported that gel-derived monolith specimens in the binary SiO2 - CaO are bioactive over a similar molar range of SiO2 content as the previously studied ternary CaO-P2O5-SiO2 system. In this report, the preparation and bioactivity of the binary gel-glass powder with 70 mol % SiO2 is discussed and its bioactivity is compared with the melt-derived 45S5 (quaternary) Bioglass and sol-gel-derived 58S (ternary) bioactive gel-glass compositions. Dissolution kinetic parameters K(1) and K(2) were also computed based on the silicon release for all glass powders. It was shown that the simple two-component SiO2-CaO gel-glass powder is bioactive with comparable dissolution rates as the clinically used melt-derived 45S5 Bioglass powder and extensively studied sol-gel-derived 58S gel-glass powder. Copyright 2003 Wiley Periodicals, Inc.

The Application of Oxygen Concentration Cells with the Solid Electrolyte ZrO{sub 2} * CaO to Thermodynamic Research; Emploi des Cellules a Concentration d'Oxygene avec Electrolyte Soude de ZrO{sub 2} * CaO, Dans les Recherches en Thermodynamique; Primenenie kislorodnykh kontsentratsionnykh kamer s tverdym ehlektrolitom ZrO{sub 2} * CaO dlya issledovanij po termodinamike; Aplicacion de las Celdas de Concentracion de Oxigeno con Electrolito Solido de ZrO{sub 2} * CaO a las Investigaciones Termodinamicas

Energy Technology Data Exchange (ETDEWEB)

Matsushita, Y.; Goto, K. [University of Tokyo (Japan)

1966-01-15

este metodo podria utilizarse para determinar el contenido de oxigeno en hierro liquido a 1500 Degree-Sign - 1600 Degree-Sign C. Ademas, se sugieren posibilidades de aplicar las celdas de concentracion de oxigeno al estudio basico de procesos metalurgicos, y se analizan diversas aplicaciones industriales. (author) [Russian] Obsuzhdajutsja shest' jeksperimental'nyh issledovatel'skih rabot, svjazannyh s primeneniem kislorodnyh koncent- racionnyh kamer jelektrolita ZrO{sub 2} * CaO (kotoryj obespechivaet chistuju anionnuju provo- dimost' v vide migracii kislorodnyh defektov) dlja provedenija, osnovnyh issledovanij po tehnologii metallov: 1) Standartnye svobodnye jenergii obrazovanija FeO, Fe{sub 3}O{sub 4}, SnO, PbO, Cu{sub 2}O, CuO i Ta{sub 2}O{sub 5} byli izmereny i vyrazheny v vide funkcij temperatury v diapazone 500 - 1300 Degree-Sign C. 2) Davlenie kisloroda v zhidkom rastvore PbO - SiO{sub 2}, nahodjashhemsja v ravnovesii s zhid- kim svincom, izmerjalos' pri temperature 1100 Degree-Sign C. Byli rasschitany himicheskie aktivnosti Pb i SiO{sub 2} i termodinamicheskie svojstva rastvora PbO - SiO{sub 2}. 3) Odin iz avtorov, izmeril himicheskuju aktivnost' olova v zhidkom binarnom rastvo- re Pb - Sn pri temperaturah ot 700 do 900 Degree-Sign C. Byli vychisleny takzhe termodinamicheskie svojstva splavov Pb - Sn. 4) Jetot avtor takzhe razrabotal manometr dlja izmerenija parcial'nogo davlenija kisloro- da v vysokotemperaturnyh gazah v diapazone P(O{sub 2}) = 10{sup -1} - 10{sup -20} atm i pri temperature 500 Degree-Sign - 1300 Degree-Sign C. Byli polucheny samosoglasovannye i vosproizvodimye je.d.s. po razlichnomu sostavu smesej gazov. 5) Skorost' reakcij okislenija ili vosstanovlenija chistogo zheleza i okislov zheleza gazovoj smes'ju CO - CO{sub 2} rasschityvalis' na osnovanii rezul'tatov, poluchennyh s pomoshh'ju manometra pri temperature 900 Degree-Sign - 1000 Degree-Sign C. 6) Davlenie kisloroda v zhidkom zheleze, soderzhashhem razlichnye kolichestva uglero- da vplot

Ca 3d unoccupied states in Bi2Sr2CaCu2O8 investigated by Ca L2,3 x-ray-absorption near-edge structure

Energy Technology Data Exchange (ETDEWEB)

Borg, A; King, P L; Pianetta, P; Lindau, I; Mitzi, D B

1992-01-01

The high-resolution Ca L(2,3) x-ray-absorption near-edge-structure (XANES) spectrum of a Bi2Sr2CaCu2O8 single crystal has been measured by use of a magnetic-projection x-ray microscope probing a surface area of 200x200 micrometers square. The Ca L(2,3) XANES spectrum is analyzed by performing a multiple-scattering XANES calculation in real space and comparing the results with the spectrum of CaF2. Good agreement between the calculated and experimental crystal-field splitting Delta f of the Ca 3d final states is found and the splitting is shown to be smaller by 0.5 eV than in the initial state. The Ca 3d partial density of states is found to be close to the Fermi level in the initial state. The Ca-O (in plane) distance is shown to be a critical parameter associated with the shift of the Ca 3d states relative to the Fermi level; in particular, the authors have studied the effect of the out-of-plane dimpling mode of the in-plane oxygen atoms O(in plane) that will move the Ca 3d states on or off the Fermi level. This mode can therefore play a role in modulating the charge transfer between the two CuO2 planes separated by the Ca ions.

Cellulose acetate-based SiO2/TiO2 hybrid microsphere composite aerogel films for water-in-oil emulsion separation

Science.gov (United States)

Yang, Xue; Ma, Jianjun; Ling, Jing; Li, Na; Wang, Di; Yue, Fan; Xu, Shimei

2018-03-01

The cellulose acetate (CA)/SiO2-TiO2 hybrid microsphere composite aerogel films were successfully fabricated via water vapor-induced phase inversion of CA solution and simultaneous hydrolysis/condensation of 3-aminopropyltrimethoxysilane (APTMS) and tetrabutyl titanate (TBT) at room temperature. Micro-nano hierarchical structure was constructed on the surface of the film. The film could separate nano-sized surfactant-stabilized water-in-oil emulsions only under gravity. The flux of the film for the emulsion separation was up to 667 L m-2 h-1, while the separation efficiency was up to 99.99 wt%. Meanwhile, the film exhibited excellent stability during multiple cycles. Moreover, the film performed excellent photo-degradation performance under UV light due to the photocatalytic ability of TiO2. Facile preparation, good separation and potential biodegradation maked the CA/SiO2-TiO2 hybrid microsphere composite aerogel films a candidate in oil/water separation application.

Non-isothermal crystallization kinetics of Fe{sub 2}O{sub 3}–CaO–SiO{sub 2} glass containing nucleation agent P{sub 2}O{sub 5}/TiO{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Li, Bin, E-mail: stra-ceo@163.com; Wang, Yongya; Luo, Wenqin; Li, Jingfen [Huzhou University, Department of Material Chemistry (China); Li, Jianyou [Huzhou Central Hospital, Orthopedic Department (China)

2017-03-15

Fe{sub 2}O{sub 3}–CaO–SiO{sub 2} glass ceramics containing nucleation agent P{sub 2}O{sub 5}/TiO{sub 2} were prepared by sol-gel method. The samples were characterized by X-ray diffraction (XRD) and differential scanning calorimetry (DSC). The activation energy and kinetic parameters for crystallization of the samples were calculated by the Johnson-Mehi-Avrami (JMA) model and Augis-Bennett method according to the results of DSC. The results showed that the crystallization mechanism of Fe{sub 2}O{sub 3}–CaO–SiO{sub 2} glass, whose non-isothermal kinetic parameter n = 2.3, was consistent with surface crystallization of the JMA model. The kinetics model function of Fe{sub 2}O{sub 3}–CaO–SiO{sub 2} glass, f(α) = 2.3(1–α)[–ln(1–α)]{sup 0.57}, was also obtained. The addition of nucleation agent P{sub 2}O{sub 5}/TiO{sub 2} could reduce the activation energy, which made the crystal growth modes change from onedimensional to three-dimensional.

Electron radiation damages to dicalcium (Ca{sub 2}SiO{sub 4}) and tricalcium (Ca{sub 3}SiO{sub 5}) orthosilicates

Energy Technology Data Exchange (ETDEWEB)

Noirfontaine, Marie-Noëlle de; Dunstetter, Frédéric [Laboratoire des Solides Irradiés, UMR CNRS 7642, Ecole Polytechnique, Université Paris-Saclay, F-91128 Palaiseau Cedex (France); Courtial, Mireille [Laboratoire des Solides Irradiés, UMR CNRS 7642, Ecole Polytechnique, Université Paris-Saclay, F-91128 Palaiseau Cedex (France); Université d’Artois, 1230 Rue de l’Université, CS 20819, F-62408 Béthune (France); Signes-Frehel, Marcel [Laboratoire des Solides Irradiés, UMR CNRS 7642, Ecole Polytechnique, Université Paris-Saclay, F-91128 Palaiseau Cedex (France); Wang, Guillaume [Laboratoire Matériaux et Phénomènes Quantiques, UMR CNRS 7162, Université Paris Diderot, F-75205 Paris Cedex 13 (France); Gorse - Pomonti, Dominique [Laboratoire des Solides Irradiés, UMR CNRS 7642, Ecole Polytechnique, Université Paris-Saclay, F-91128 Palaiseau Cedex (France)

2016-05-01

Electron radiation damages to dicalcium silicate (Ca{sub 2}SiO{sub 4}) and tricalcium silicate (Ca{sub 3}SiO{sub 5}) are reported for the first time in this paper. With increasing flux, between 2.7 × 10{sup 17} and 2.2 × 10{sup 22} e{sup −} cm{sup −2} s{sup −1}, decomposition into nanodomains of crystalline CaO plus an amorphous silica rich phase is first observed for both silicates, then amorphization at higher flux always for both silicates, and finally hole drilling but only for Ca{sub 3}SiO{sub 5}. These structural modifications are accompanied by a net reduction of Ca content under the electron beam depending on the silicate species. These radiation effects occur for values of flux and dose larger than in previously studied orthosilicates (like olivines), and much larger than in all tectosilicates.

A study of low threshold and high gain Nd3+ ions doped SiO2-B2O3-Na2CO3-NaF-CaF2 glasses for NIR laser applications

Science.gov (United States)

Megala, Rajesh; Gowthami, T.; John Sushma, N.; Kamala, S.; Deva Prasad Raju, B.

2018-05-01

Fluoroborosilicate glasses of composition 35SiO2-25B2O3-10Na2CO3-15NaF-15CaF2-xNd2O3 (where x = 0.1, 0.5. 1.0, 2.0 mol%) were prepared by melt quenching technique and various physical properties have been calculated. From the absorption spectra J-O Intensity parameters Ωλ (λ = 2, 4, 6) and radiative properties are evaluated by using J-O theory. The high values of Ω2 = 4.213 × 10-20 cm2, Ω4 = 5.345 × 10-20 cm2, Ω6 = 5.526 × 10-20 cm2 suggest that among the prepared glasses 0.5 mol% Nd glass is more asymmetric, more covalent and rigid in nature. The emission spectra were recorded with 808 nm laser as excitation source. The strong NIR emissions were observed at 876 nm, 1056 nm, 1328 nm corresponding to the transitions 4F3/2 → 4I9/2, 4F3/2 → 4I11/2, 4F3/2 → 4I13/2 respectively. Stimulated emission cross -section (σemi) and Gain bandwidth (σemi × Δλeff) were calculated. For 0.5 mol% Nd these values are found to be 3.30 × 10-20 cm2, 11 × 10-26 cm2. From the decay curve analysis the lifetime values for 4F3/2 level have been determined and these values are decreased with increase in Nd3+ ions concentration. These results may suggest that the prepared SBNCNd05 (Nd = 0.5 mol%) glass could be useful for 1056 nm laser applications.

Effect of B2O3 and P2O5 on fluorosilicic mica glass-ceramic sintering process

Directory of Open Access Journals (Sweden)

Wu S.

2010-01-01

Full Text Available To study the effect of B2O3 and P2O5 on fluorosilicic mica glass-ceramic sintering process, six sets of K2O-MgO-SiO2-F glasses were prepared by using B2O3 and P2O5 as sintering aid, respectively. Green bodies of the glass powder were formed by gel casting and sintered at 800, 850, 900, 950, 1000oC for 6 hours, resectively. The sintering and crystallization behavior were studied by thermal shrinkage , X-ray diffraction and SEM. The results showed that the shrinkage rate of the glass with 2wt% B2O3 and P2O5 was highest, while the rate of the glass with 5wt% P2O5 was lowest. An additional crystal other than fluorosilicic mica was precipitated in the glass ceramics generated by sintering of glass powder. The present results confirmed that the glass powder of pure K2O-MgO-SiO2-Fsystem had poor sinterability, while glass powder with minor addition of P2O5 and/or B2O3 showed good sinterability. This result was also verified by SEM.

Structural influence of aluminium, gallium and indium metal oxides by means of dielectric and spectroscopic properties of CaO-Sb{sub 2}O{sub 3}-B{sub 2}O{sub 3} glass system

Energy Technology Data Exchange (ETDEWEB)

Srinivasa Reddy, M. [Department of Physics, Acharya Nagarjuna University P.G. Centre, Nuzvid 521 201, AP (India); Naga Raju, G. [Department of Physics, Acharya Nagarjuna University P.G. Centre, Nuzvid 521 201, AP (India); Nagarjuna, G. [Department of Chemistry, Acharya Nagarjuna University, Nagarjunanagar, AP (India); Veeraiah, N. [Department of Physics, Acharya Nagarjuna University P.G. Centre, Nuzvid 521 201, AP (India)]. E-mail: nvr8@rediffmail.com

2007-07-12

Dielectric constant ({epsilon}'), loss (tan {delta}), ac conductivity ({sigma}) of CaO-Sb{sub 2}O{sub 3}-B{sub 2}O{sub 3}:M{sub 2}O{sub 3} (Al{sub 2}O{sub 3}, Ga{sub 2}O{sub 3} and In{sub 2}O{sub 3}) glasses with varying concentrations of M{sub 2}O{sub 3} (0-5 mol%), were measured as a function of frequency and temperature over moderately wide ranges. The analysis of results of these studies along with IR, Raman and optical absorption spectra and also DTA studies indicated that in the concentration ranges, 0 {<=} Al{sub 2}O{sub 3} {<=} 4, 0 {<=} Ga{sub 2}O{sub 3} {<=} 2 and 1 {<=} In{sub 2}O{sub 3} {<=} 5, Al{sup 3+}, Ga{sup 3+} ions occupy tetrahedral positions whereas In{sup 3+} ions take up octahedral substitutional positions, cross-link with the other structural units in the glass network and increase the rigidity of the glass network.

The crystal structure of galgenbergite-(Ce), CaCe2(CO3)4•H2O

Science.gov (United States)

Walter, Franz; Bojar, Hans-Peter; Hollerer, Christine E.; Mereiter, Kurt

2013-04-01

Galgenbergite-(Ce) from the type locality, the railroad tunnel Galgenberg between Leoben and St. Michael, Styria, Austria, was investigated. There it occurs in small fissures of an albite-chlorite schist as very thin tabular crystals building rosette-shaped aggregates associated with siderite, ancylite-(Ce), pyrite and calcite. Electron microprobe analyses gave CaO 9.49, Ce2O3 28.95, La2O3 11.70, Nd2O3 11.86, Pr2O3 3.48, CO2 30.00, H2O 3.07, total 98.55 wt.%. CO2 and H2O calculated by stoichiometry. The empirical formula (based on Ca + REE ∑3.0) is C{{a}_{1.00 }}{{( {C{{e}_{1.04 }}L{{a}_{0.42 }}N{{d}_{0.42 }}P{{r}_{0.12 }}} )}_{2.00 }}{{( {C{{O}_3}} )}_4}\\cdot {{H}_2}O , and the simplified formula is CaC{{e}_2}{{( {C{{O}_3}} )}_4}\\cdot {{H}_2}O . According to X-ray single crystal diffraction galgenbergite-(Ce) is triclinic, space group Poverline{1},a=6.3916(5) , b = 6.4005(4), c = 12.3898(9) Å, α = 100.884(4), β = 96.525(4), γ = 100.492(4)°, V = 483.64(6) Å3, Z = 2. The eight strongest lines in the powder X-ray diffraction pattern are [ d calc in Å/( I)/ hkl]: 5.052/(100)/011; 3.011/(70)/0-22; 3.006/(66)/004; 5.899/(59)/-101; 3.900/(51)/1-12; 3.125/(46)/-201; 2.526/(42)/022; 4.694/(38)/-102. The infrared absorption spectrum reveals H2O (OH-stretching mode at 3,489 cm-1, HOH bending mode at 1,607 cm-1) and indicates the presence of distinctly non-equivalent CO3-groups by double and quadruple peaks of their ν1, ν2, ν3 and ν4 modes. The crystal structure of galgenbergite-(Ce) was refined with X-ray single crystal data to R1 = 0.019 for 2,448 unique reflections ( I > 2 σ( I)) and 193 parameters. The three cation sites of the structure Ca(1), Ce(2) and Ce(3) have a modest mixed site occupation by Ca and small amount of REE (Ce, La, Pr, Nd) and vice versa. The structure is based on double layers parallel to (001), which are composed of Ca(1)Ce(2)(CO3)2 single layers with an ordered chessboard like arrangement of Ca and Ce, and with a roof tile

Variable dimensionality and new uranium oxide topologies in the alkaline-earth metal uranyl selenites AE[UO2)(SeO3)2] (AE=Ca, Ba) and Sr[UO2)(SeO3)2] · 2H2O

International Nuclear Information System (INIS)

Almond, Philip M.; Peper, Shane M.; Bakker, Eric; Albrecht-Schmitt, Thomas E.

2002-01-01

Three new alkaline-earth metal uranyl selenites, Ca[UO 2 )(SeO 3 ) 2 ] (1), Sr[UO 2 )(SeO 3 ) 2 ] · 2H 2 O (2), and Ba[UO 2 )(SeO 3 ) 2 ] (3), have been prepared from the reactions of CaCO 3 and Ca(OH) 2 , SrCl 2 and Sr(OH) 2 , or BaCl 2 and Ba(OH) 2 with UO 3 and SeO 2 under mild hydrothermal conditions. Single-crystal X-ray diffraction experiments reveal that the structures of 1-3 differ in both connectivity and dimensionality even though all contain the same fundamental building unit, namely [UO 2 (SeO 3 ) 4 ]. This polyhedron consists of a linear uranyl unit that is bound by one chelating and three bridging selenite anions creating a pentagonal bipyramidal environment around the U(VI) center. The crystal structure of 1 contains one-dimensional ribbons where the edges are terminated by monodentate selenite anions. The interior of the ribbons are constructed from edge-sharing pentagonal bipyramidal UO 7 units. The structure of 2 is also one-dimensional; however, here there are chains of edge-sharing pentagonal bipyramidal UO 7 dimers that are connected by bridging selenite anions. Ba[(UO 2 )(SeO 3 ) 2 ] (3) is two-dimensional, and the highly ruffled anionic sheets present in this structure are formed from both bridging and chelating/bridging selenite anions bound to uranyl moieties. The anionic substructures in 1-3 are separated by Ca 2+ , Sr 2+ , or Ba 2+ cations. Crystallographic data (193 K, MoKα, λ=0.71073): 1, triclinic, space group P1-bar, a=5.5502(6) A, b=6.6415(7) A, c=11.013(1) A, α=104.055(2) deg., β=93.342(2) deg., γ=110.589(2) deg. , Z=2, R(F)=4.56% for 100 parameters with 1530 reflections with I>2σ(I); 2, triclinic, space group P1-bar, a=7.0545(5) A, b=7.4656(5) A, c=10.0484(6) A, α=106.995(1) deg., β=108.028(1) deg., γ=98.875(1) deg., Z=2, R(F)= 2.43% for 128 parameters with 2187 reflections with I>2σ(I); 3, monoclinic, space group P2 1 /c, a=7.3067(6) A, b=8.1239(7) A, c=13.651(1) A, β=100.375(2) deg., Z=4, R(F)=4.31% for 105 parameters

Synthesis, crystal structure refinement, and nonlinear-optical properties of CaB{sub 3}O{sub 5}(OH): Comparative crystal chemistry of calcium triborates

Energy Technology Data Exchange (ETDEWEB)

Yamnova, N. A., E-mail: aks.crys@gmail.com; Aksenov, S. M. [Moscow State University, Faculty of Geology (Russian Federation); Stefanovich, S. Yu. [Moscow State University, Faculty of Chemistry (Russian Federation); Volkov, A. S.; Dimitrova, O. V. [Moscow State University, Faculty of Geology (Russian Federation)

2015-09-15

Calcium triborate CaB{sub 3}O5(OH) obtained by hydrothermal synthesis in the Ca(OH){sub 2}–H{sub 3}BO{sub 3}–Na{sub 2}CO{sub 3}–KCl system is studied by single-crystal X-ray diffraction. The parameters of the orthorhombic unit cell are as follows: a = 13.490(1), b = 6.9576(3), and c = 4.3930(2) Å; V = 412.32(3) Å{sup 3} and space group Pna2{sub 1}. The structure is refined in the anisotropic approximation of the atomic displacement parameters to R = 4.28% using 972 vertical bar F vertical bar > 4σ(F). It is confirmed that the crystal structure of Ca triborate CaB{sub 3}O{sub 5}(OH) is identical to that described earlier. The hydrogen atom is localized. An SHG signal stronger than that of the quartz standard is registered. The phase transition of calcium triborate into calciborite is found on heating. The comparative crystal-chemical analysis of a series of borates with the general chemical formula 2CaO · 3B{sub 2}O{sub 3} · nH{sub 2}O (n = 0–13) with the constant CaO: B{sub 2}O{sub 3}= 2: 3 ratio and variable content of water is performed.

High pressure study of low compressibility tetracalcium aluminum carbonate hydrates 3CaO·Al2O3·CaCO3·11H2O

KAUST Repository

Moon, Juhyuk

2012-01-01

Synchrotron X-ray diffraction data was collected from a sample of monocarboaluminate 3CaO•Al2O3•CaCO 3•11H2O from ambient pressure to 4.3 GPa. The refined crystal structure at ambient pressure is triclinic with parameters a = 5.77(2) Å, b = 8.47(5) Å, c = 9.93(4) Å, α = 64.6(2)°, β = 82.8(3)°, γ = 81.4(4)°, and space group of P1 or P1̄. It showed some degree of perfectly reversible pressure-induced dehydration with a non-hygroscopic pressure-transmitting medium. However the dehydration effect does not critically affect a bulk modulus due to its strong framework. The isothermal bulk modulus of monocarboaluminate was found to be 53(5) GPa and 54(4) GPa with 3rd order and 2nd order Birch-Murnaghan Equation of state, respectively. That value is higher than for any other reported AFm or AFt phase. The pressure-volume behavior of the monocarboaluminate was compared with that of previous studied hemicarboaluminate. © 2011 Elsevier Ltd. All rights reserved.

Comparative Study of Electronic Structure and Magnetic Properties of Osmate Double Perovskites: Ca2FeOsO6 versus Ca2Co(Ni)OsO6

Science.gov (United States)

Samanta, Kartik; Saha-Dasgupta, Tanusri

2018-04-01

Employing density functional theory, we study the trend in the electronic and magnetic properties of 3d-5d double perovskites, upon varying the 3d element for a fixed choice of 5d element, namely Ca2BOsO6 (B = Fe/Co/Ni). While all three compounds are reported to be ferrimagnets, the magnetic transition temperature of Ca2FeOsO6 is reported to be 2-2.4 times larger than that of Ca2CoOsO6 or Ca2NiOsO6. Our first-principles study provides microscopic insight into this trend. This trend is found to be caused by the downward shift in the position of d level energies of the B site element with respect to that of the Os t2g level upon moving across the 3d series from Fe to Co and Ni. This in turn changes the nominal valence of the Os ion from 5+ in Ca2FeOsO6 to 6+ in Ca2CoOsO6 and Ca2NiOsO6, resulting in differing superexchange paths between Ca2FeOsO6 and Ca2Co(Ni)OsO6, and additionally enabling the hybridization-mechanism-driven magnetism in Ca2FeOsO6. These together significantly enhance the magnetic transition temperature in Ca2FeOsO6 compared with that in Ca2Co(Ni)OsO6.

Kinetics of dissolution of sapphire in melts in the CaO-Al2O3-SiO2 system

Science.gov (United States)

Shaw, Cliff S. J.; Klausen, Kim B.; Mao, Huahai

2018-05-01

The dissolution rate of sapphire in melts in the CAS system of varying silica activity, viscosity and degree of alumina saturation has been determined at 1600 °C and 1.5 GPa. After an initiation period of up to 1800 s, dissolution is controlled by diffusion of cations through the boundary layer adjacent to the dissolving sapphire. The dissolution rate decreases with increasing silica activity, viscosity and molar Al2O3/CaO. The calculated diffusion matrix for each solvent melt shows that CAS 1 and 9 which have molar Al2O3/CaO of 0.33 and 0.6 and dissolution rate constants of 0.65 × 10-6 and 0.59 × 10-6 m/s0.5 have similar directions and magnitudes of diffusive coupling: DCaO-Al2O3 and DAl2O3-CaO are both negative are approximately equal. The solvent with the fastest dissolution rate: CAS 4, which has a rate constant of 1.5 × 10-6 m/s0.5 and Al2O3/CaO of 0.31 has positive DCaO-Al2O3 and negative DAl2O3-CaO and the absolute values vary by a factor of 4. Although many studies show that aluminium is added to the melts via the reaction: Si4+ =Al3+ + 0.5Ca2+ the compositional profiles show that this reaction is not the only one involved in accommodating the aluminium added during sapphire dissolution. Rather, aluminium is incorporated as both tetrahedrally coordinated Al charge balanced by Ca and as aluminium not charge balanced by Ca (termed Alxs). This reaction: AlIV -Ca =Alxs +CaNBO where CaNBO is a non-bridging oxygen associated with calcium, may involve the formation of aluminium triclusters. The shape of the compositional profiles and oxide-oxide composition paths is controlled by the aluminium addition reaction. When Alxs exceeds 2%, CaO diffusion becomes increasingly anomalous and since the bond strength of Alxs correlates with CaO/CaO + Al2O3, the presence of more than 2% Alxs leads to significantly slower dissolution than when Alxs is absent or at low concentration. Thus, dissolution is controlled by diffusion of cations through the boundary layer, but this

Effect of ZnO, ZrO2 and B2O3 on clinkerization process. Part I. Clinkerization reactions and clinker composition

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Palacios, M.

2008-12-01

Full Text Available The use of clay-based product waste as an alternative prime material in Portland cement raw mixes raises the ZnO, ZrO2 and B2O3 content in the clinker. These compounds are found in the enamelled surface of the tile added to the raw mix. The present study explores the effect of adding 0.5 and 2% ZnO, ZrO2 and B2O3 to the raw mix, separately and jointly, on clinkerization and the distribution and morphology of the mineral phases in the clinker. The findings showed that while ZnO and ZrO2 are fixed in the clinker, B2O3 is partially volatized. Zinc oxide acted as a flux, while neither ZrO2 nor B2O3 increased the molten phase. The addition of the oxides to the raw mix changed the content of the main mineral phases in the clinker. Zinc oxide lowered the C3S and C3A contents, ZrO2 reduced the ferritic phase and B2O3 stabilized C2S. New mineral phases, namely 3CaO·ZnO·2Al2O3 and CaZrO3, were identified in the clinkers obtained when 2% ZnO and ZrO2 were added to the raw mix.El empleo de residuos cerámicos como materia prima alternativa en la fabricación del crudo de cemento Portland, aumenta el contenido de ZnO, ZrO2 y B2O3 en el clinker. Estos elementos se encuentran en la capa esmaltada de los residuos cerámicos incorporados al crudo. Por ello el presente trabajo de investigación aborda el estudio del efecto que tiene la adición en el crudo de contenidos del 0,5 y 2% de ZnO, ZrO2 y B2O3 de manera individual y conjunta en los procesos de clinkerización, en la distribución y morfología de las fases mineralógicas del clinker.Los resultados obtenidos han demostrado que el ZnO y ZrO2 permanecen fijados en el clinker, sin embargo el B2O3 se volatiliza parcialmente. El ZnO actúa como fundente, mientras que el ZrO2 y el B2O3 no aumentan el contenido de fase fundida. La adición de estos óxidos al crudo modifica el contenido de las principales fases mineralógicas del clinker. El ZnO disminuye los contenidos de C3S y C3A, el ZrO2 disminuye

About LTCC materials in the substance system of CaO-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-B{sub 2}O{sub 3}; Ueber LTCC-Werkstoffe aus dem Stoffsystem CaO-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-B{sub 2}O{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Gemeinert, Marion

2009-09-01

Glass ceramic composites made of glassy and crystalline powders offer numerous possibilities for modifying materials properties e.g. sintering behaviour, thermal expansion coefficient, mechanical behaviour, chemical durability, dielectric properties and surface quality for special use. Glass ceramic composite powders can be used for the production of ceramic green tapes which are processed by LTCC (Low Temperature Co-fired Ceramics)- technology to form ceramic multilayers for electronic packaging in microsystems. During free sintering of LTCC-multilayers a lateral shrinkage occurs which is connected with a comparatively high shrinkage tolerance. Different sintering technologies are used to avoid the lateral shrinkage. A new possibility to achieve a zero lateral shrinkage is given by use of a self-constrained laminate. Therefore a multilayer is produced of two different materials for inner and outer layers, showing different sintering temperatures ({delta}T>50 K). Object of this dissertation was the development of LTCC-materials, which can be used for inner layers of a self-constrained laminate to reduce the lateral shrinkage nearly to zero. Therefore LTCC-materials in the field of CaO-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-B{sub 2}O{sub 3}, which can be sintered below 800 C, were investigated. Starting from the development of adapted glasses based on calcium lanthanium borate- and calcium lanthanium alumoborate glasses glass ceramic composites were produced by the addition of corundum powder. The composites crystallize during the sintering process almost completely. Lanthanum borate crystallizes from the glassy phase and calcium alumoborate and calcium alumoborate oxide respectively is formed by a chemical solid state reaction of the residual glassy phase, which is enriched by calcium borate, and the corundum. The proportional relation of the new crystalline phases determines the thermal and dielectric properties of the material. The most important formed new

B2O3/SiO2 substitution effect on structure and properties of Na2O-CaO-SrO-P2O5-SiO2 bioactive glasses from molecular dynamics simulations.

Science.gov (United States)

Ren, Mengguo; Lu, Xiaonan; Deng, Lu; Kuo, Po-Hsuen; Du, Jincheng

2018-05-23

The effect of B2O3/SiO2 substitution in SrO-containing 55S4.3 bioactive glasses on glass structure and properties, such as ionic diffusion and glass transition temperature, was investigated by combining experiments and molecular dynamics simulations with newly developed potentials. Both short-range (such as bond length and bond angle) and medium-range (such as polyhedral connection and ring size distribution) structures were determined as a function of glass composition. The simulation results were used to explain the experimental results for glass properties such as glass transition temperature and bioactivity. The fraction of bridging oxygen increased linearly with increasing B2O3 content, resulting in an increase in overall glass network connectivity. Ion diffusion behavior was found to be sensitive to changes in glass composition and the trend of the change with the level of substitution is also temperature dependent. The differential scanning calorimetry (DSC) results show a decrease in glass transition temperature (Tg) with increasing B2O3 content. This is explained by the increase in ion diffusion coefficient and decrease in ion diffusion energy barrier in glass melts, as suggested by high-temperature range (above Tg) ion diffusion calculations as B2O3/SiO2 substitution increases. In the low-temperature range (below Tg), the Ea for modifier ions increased with B2O3/SiO2 substitution, which can be explained by the increase in glass network connectivity. Vibrational density of states (VDOS) were calculated and show spectral feature changes as a result of the substitution. The change in bioactivity with B2O3/SiO2 substitution is discussed with the change in pH value and release of boric acid into the solution.

Thermal expansion behaviour in the oxygen deficient perovskites Sr2BSbO5.5 (B=Ca, Sr, Ba). Competing effects of water and oxygen ordering

International Nuclear Information System (INIS)

Zhou Qingdi; Kennedy, Brendan J.; Avdeev, Maxim

2011-01-01

Neutron diffractions studies reveal the presence of oxygen disorder in the oxygen deficient perovskites Sr 2 BSbO 5.5 (B=Ca, Sr, Ba). Synchrotron X-ray studies demonstrate that these oxides have a double perovskite-type structure with the cell size increasing as the size of the B cation increases from 8.2114(2) A for B=Ca to 8.4408(1) A for B=Ba. It is postulated that a combination of local clustering of the anions and vacancies together with water-water and water-host hydrogen bonds plays a role in defining the volume of the encapsulated water clusters and that changes in the local structure upon heating result in anomalous thermal expansion observed in variable temperature diffraction measurements. - Graphical abstract: The oxides Sr 2 BSbO 5.5 (B=Ca, Sr, Ba) have unusual anion disorder. There is a lag in the contraction in the cell size of Sr 2 CaSbO 5.5 nH 2 O established from X-ray diffraction measurements following the loss of water suggesting changes on the local structure are important. Highlights: → The average structures of the defect perovskites Sr 2 MSbO 5.5 established. → Anion and cation disorder quantified by neutron and synchrotron X-ray diffraction. → Anomalous thermal expansion due to local clustering of anions and vacancies observed.

Antiferromagnetism at the YBa2Cu3O7/La2/3Ca1/3MnO3 interface

International Nuclear Information System (INIS)

Haberkorn, N.; Guimpel, J.; Sirena, M.; Steren, L.B.; Saldarriaga, W.; Baca, E.; Gomez, M.E.

2004-01-01

The magnetic properties of a series of YBa 2 Cu 3 O 7-x /La 2/3 Ca 1/3 MnO 3 (YBCO/LC 1/3 MO) superlattices grown by dc sputtering at high oxygen pressures (3.5 mbar) show the expected ferromagnetic behavior. However, field-cooled hysteresis loops at a low temperatures show the unexpected existence of exchange bias effect associated with the existence of ferromagnetic/antiferromagnetic (AF) interfaces. The blocking temperature (T B ) is found to be thickness dependent and the exchange bias field (H EB ) is found to be inversely proportional to the ferromagnetic layer thickness, as expected. The presence of an AF material is probably associated with interface disorder and Mn valence shift toward Mn 4+

Siudaite, Na8(Mn2+ 2Na)Ca6Fe3+ 3Zr3NbSi25O74(OH)2Cl·5H2O: a new eudialyte-group mineral from the Khibiny alkaline massif, Kola Peninsula

Science.gov (United States)

Chukanov, Nikita V.; Rastsvetaeva, Ramiza K.; Kruszewski, Łukasz; Aksenov, Sergey M.; Rusakov, Vyacheslav S.; Britvin, Sergey N.; Vozchikova, Svetlana A.

2018-03-01

The new eudialyte-group mineral siudaite, ideally Na8(Mn2+ 2Na)Ca6Fe3+ 3Zr3NbSi25O74(OH)2Cl·5H2O, was discovered in a peralkaline pegmatite situated at the Eveslogchorr Mt., Khibiny alkaline massif, Kola Peninsula, Russia. The associated minerals are aegirine, albite, microcline, nepheline, astrophyllite, and loparite-(Ce). Siudaite forms yellow to brownish-yellow equant anhedral grains up to 1.5 cm across. Its lustre is vitreous, and the streak is white. Cleavage is none observed. The Mohs' hardness is 4½. Density measured by hydrostatic weighing is 2.96(1) g/cm3. Density calculated using the empirical formula is equal to 2.973 g/cm3. Siudaite is nonpleochroic, optically uniaxial, negative, with ω = 1.635(1) and ɛ = 1.626(1) (λ = 589 nm). The IR spectrum is given. The chemical composition of siudaite is (wt%; electron microprobe, H2O determined by HCN analysis): Na2O 8.40, K2O 0.62, CaO 9.81, La2O3 1.03, Ce2O3 1.62, Pr2O3 0.21, Nd2O3 0.29, MnO 6.45, Fe2O3 4.51. TiO2 0.54, ZrO2 11.67, HfO2 0.29, Nb2O5 2.76, SiO2 47.20, Cl 0.54, H2O 3.5, -O = Cl - 0.12, total 99.32. According to Mössbauer spectroscopy data, all iron is trivalent. The empirical formula (based on 24.5 Si atoms pfu, in accordance with structural data) is [Na7.57(H2O)1.43]Σ9(Mn1.11Na0.88Ce0.31La0.20Nd0.05Pr0.04K0.41)Σ3(H2O)1.8(Ca5.46Mn0.54)Σ6(Fe3+ 1.76Mn2+ 1.19)Σ2.95Nb0.65(Ti0.20Si0.50)Σ0.71(Zr2.95Hf0.04Ti0.01)Σ3Si24.00Cl0.47O70(OH)2Cl0.47·1.82H2O. The crystal structure was determined using single-crystal X-ray diffraction data. The new mineral is trigonal, space group R3m, with a = 14.1885(26) Å, c = 29.831(7) Å, V = 5200.8(23) Å3 and Z = 3. Siudaite is chemically related to georgbarsanovite and is its analogue with Fe3+-dominant M2 site. The strongest lines of the powder X-ray diffraction pattern [d, Å (I, %) (hkl)] are: 6.38 (60) (-114), 4.29 (55) (-225), 3.389 (47) (131), 3.191 (63) (-228). 2.963 (100) (4-15), 2.843 (99) (-444), 2.577 (49) (3-39). Siudaite is named after the Polish

Study of chromites YbMIICr2O5,5 (MII - Mg, Ca, Sr, Ba by X-ray diffraction

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B. Kasenov

2012-03-01

Full Text Available Compounds of composition YbMeMnFeO5,5 (Me – Mg, Ca, Sr, Ba are synthesized from Yb2O3, , Cr2O3 and MgCO3, CaCO3, SrCO3, BaCO3 by solid phase method. X-ray powder diffraction showed that the compound YbMgCr2O5,5, YbCaCr2O5,5, YbSrCr2O5,5, YbBaCr2O5,5 crystallizes in the tetragonal crystal system.

Redetermination of Ce[B5O8(OH(H2O]NO3·2H2O

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Ya-Xi Huang

2012-05-01

Full Text Available The crystal structure of Ce[B5O8(OH(H2O]NO3·2H2O, cerium(III aquahydroxidooctaoxidopentaborate nitrate dihydrate, has been redetermined from single-crystal X-ray diffraction data. In contrast to the previous determination [Li et al. (2003. Chem. Mater. 15, 2253–2260], the present study reveals the location of all H atoms, slightly different fundamental building blocks (FBBs of the polyborate anions, more reasonable displacement ellipsoids for all non-H atoms, as well as a model without disorder of the nitrate anion. The crystal structure is built from corrugated polyborate layers parallel to (010. These layers, consisting of [B5O8(OH(H2O]2− anions as FBBs, stack along [010] and are linked by Ce3+ ions, which exhibit a distorted CeO10 coordination sphere. The layers are additionally stabilized via O—H...O hydrogen bonds between water molecules and nitrate anions, located at the interlayer space. The [BO3(H2O]-group shows a [3 + 1] coordination and is considerably distorted from a tetrahedral configuration. Bond-valence-sum calculation shows that the valence sum of boron is only 2.63 valence units (v.u. when the contribution of the water molecule (0.49 v.u. is neglected.

Crystallization and thermo-mechanical properties of Li2O-ZnO-CaOSiO2 glass-ceramics with In2O3 and Fe2O3 additives

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Saad M. Salman

2015-12-01

Full Text Available Li2O-ZnO-CaO-SiO2 based glasses were prepared by the conventional melting technique and subsequently converted to glass-ceramics by controlled crystallization. The nucleation and crystallization temperatures were determined by differential thermal analysis (DTA. The effects of adding In2O3 and Fe2O3 addition on the crystallization behaviour and thermo-mechanical properties of the prepared glass-ceramics were investigated. A study on the microstructure, close to the internal phases of the resulting glass-ceramics, was followed by using scanning electron microscope (SEM. The dilatometric thermal expansion and Vickers’ microhardness of the crystalline products were also evaluated. The crystalline phases that can be found in the resulting glass-ceramics, identified by X-ray diffraction (XRD analysis, are α-quartz-[SiO2], lithium zinc silicate-[Li2ZnSiO4], lithium disilicate-[Li2Si2O5], wollastonite-[CaSiO3], wollastonite containing iron, ferrobustamite-[(Ca0.79Fe0.21SiO3], and lithium indium silicate of pyroxene type-[LiInSi2O6]. Average thermal expansion coefficient (in the temperature range 25–700 °C decreased from 191×10-7 1/°C to 115×10-7 1/°C and the Vickers’ microhardness increased from 3.56 to 5.44 GPa with the increase of In2O3 and Fe2O3 contents in the glass-ceramics. The changes in the obtained expansion coefficient and microhardness were due to the formation of different phases which in turn influenced the rigidity/bonding and microstructure in the resultant glass-ceramics.

Microstructural morphologies of slag based glass-ceramics nucleated with 5 wt% Cr{sub 2}O{sub 3} and 5 wt% Cr{sub 2}O{sub 3} + 5 wt% TiO{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Oevecoglu, M.L.; Oezkal, B. [Istanbul Technical Univ. (Turkey). Dept. of Metallurgical and Materials Enginering; Catakli, E. [Mimar Sinan Univ., Istanbul (Turkey). Faculty of Science and Literature; Erkmen, Z.E. [Istnabul Univ. (Turkey). Dept. of Metallurgical Engineering

2002-07-01

Glass-ceramic materials were developed from the blast-furnace slags by mixing 5 wt% Cr{sub 2}O{sub 3} and 5 wt% Cr{sub 2}O{sub 3} + 5 wt% TiO{sub 2}. The samples were nucleated for 18 h at 780 C and crystallized for 20 min. at 905 C, respectively. SEM and SEM/EDS investigations revealed the presence of clover-shaped TiO{sub 2} particles in the glassy matrix of the sample nucleated with 5 wt% Cr{sub 2}O{sub 3} + 5 wt% TiO{sub 2} and polygonal-shaped Cr{sub 2}O{sub 3} platelets for both samples. XRD scans revealed the presence of akermanite (2CaO.MgO.2SiO{sub 2}) and gehlenite (2CaO.Al{sub 2}O{sub 3}.SiO{sub 2}) peaks indicating the existence of the mellilite solid solution for the crystallized glass-ceramic samples. (orig.)

Description and crystal structure of albrechtschraufite, MgCa{sub 4}F{sub 2}[UO{sub 2}(CO{sub 3}){sub 3}]{sub 2}.17-18H{sub 2}O

Energy Technology Data Exchange (ETDEWEB)

Mereiter, K. [Vienna Univ. of Technology (Austria). Inst. of Chemical Technologies and Analytics

2013-04-15

Albrechtschraufite, MgCa{sub 4}F{sub 2}[UO{sub 2}(CO{sub 3}){sub 3}]{sub 2}.17-18H{sub 2}O, triclinic, space group P anti 1, a = 13.569(2), b = 13.419(2), c = 11.622(2) Aa, α = 115.82(1), β = 107.61(1), γ = 92.84(1) (structural unit cell, not reduced), V = 1774.6(5) Aa{sup 3}, Z = 2, Dc = 2.69 g/cm{sup 3} (for 17.5 H{sub 2}O), is a mineral that was found in small amounts with schroeckingerite, NaCa{sub 3}F[UO{sub 2}(CO{sub 3}){sub 3}](SO{sub 4}).10H{sub 2}O, on a museum specimen of uranium ore from Joachimsthal (Jachymov), Czech Republic. The mineral forms small grain-like subhedral crystals (= 0.2 mm) that resemble in appearance liebigite, Ca{sub 2}[UO{sub 2}(CO{sub 3}){sub 3}]. ∝ 11H{sub 2}O. Colour pale yellow-green, luster vitreous, transparent, pale bluish green fluorescence under ultraviolet light. Optical data: Biaxial negative, nX = 1.511(2), nY = 1.550(2), nZ = 1.566(2), 2V = 65(1) (λ = 589 nm), r < v weak. After qualitative tests had shown the presence of Ca, U, Mg, CO{sub 2} and H{sub 2}O, the chemical formula was determined by a crystal structure analysis based on X-ray four-circle diffractometer data. The structure was later on refined with data from a CCD diffractometer to R1 = 0.0206 and wR2 = 0.0429 for 9,236 independent observed reflections. The crystal structure contains two independent [UO{sub 2}(CO{sub 3}){sub 3}]{sup 4-} anions of which one is bonded to two Mg and six Ca while the second is bonded to only one Mg and three Ca. Magnesium forms a MgF{sub 2}(O{sub carbonate}){sub 3}(H{sub 2}O) octahedron that is linked via the F atoms with three Ca atoms so as to provide each F atom with a flat pyramidal coordination by one Mg and two Ca. Calcium is 7- and 8-coordinate forming CaFO{sub 6}, CaF{sub 2}O{sub 2}(H{sub 2}O){sub 4}, CaFO{sub 3}(H{sub 2}O){sub 4} and CaO{sub 2}(H{sub 2}O){sub 6} coordination polyhedra. The crystal structure is built up from MgCa{sub 3}F{sub 2}[UO{sub 2}(CO{sub 3}){sub 3}].8H{sub 2}O layers parallel to (001) which

Crystal and magnetic study of the disordered perovskites Ca(Mn0.5Sb0.5)O3 and Ca(Fe0.5Sb0.5)O3

International Nuclear Information System (INIS)

Retuerto, M.; Martinez-Lope, M.J.; Garcia-Hernandez, M.; Munoz, A.; Fernandez-Diaz, M.T.; Alonso, J.A.

2010-01-01

We have investigated the double perovskites Ca 2 MSbO 6 (M = Mn, Fe) that have been prepared by solid-state reaction (M = Fe) and wet chemistry procedures (M = Mn). The crystal and magnetic structures have been studied from X-ray (XRD) and neutron powder diffraction (NPD) data. Rietveld refinements show that the crystal structures are orthorhombic (space group Pbnm) with complete disorder of M and Sb cations, so the formula should be rewritten as Ca(M 0.5 Sb 0.5 )O 3 . Due to this disorder no evidences of Jahn-Teller distortion can be observed in the MnO 6 octahedra of Ca(Mn 0.5 Sb 0.5 )O 3 , in contrast with the ordered double perovskite Sr 2 MnSbO 6 . Ca(Fe 0.5 Sb 0.5 )O 3 behaves as an antiferromagnet with an ordered magnetic moment for Fe 3+ of 1.53(4)μ B and a propagation vector k = 0, as investigated by low-temperature NPD. The antiferromagnetic ordering is a result of the high degree of Fe/Sb anti-site disorder of the sample, which originates the spontaneous formation of Fe-rich islands, characterized by the presence of strong Fe-O-Fe antiferromagnetic couplings with enough long-range coherence to produce a magnetic contribution perceptible by NPD. By contrast, the magnetic structure of Ca(Mn 0.5 Sb 0.5 )O 3 cannot be observed by low-temperature NPD because the magnitude of the ordered magnetic moments is below the detection threshold for neutrons.

Solid-State Synthesis and Structure of the Enigmatic Ammonium Octaborate: (NH4)2[B7O9(OH)5]·3/4B(OH)3·5/4H2O.

Science.gov (United States)

Neiner, Doinita; Sevryugina, Yulia V; Schubert, David M

2016-09-06

The compound known since the 19th century as ammonium octaborate was structurally characterized revealing the ammonium salt of the ribbon isomer of the heptaborate anion, [B7O9(OH)5](2-), with boric acid and water molecules. Of composition (NH4)2B7.75O12.63·4.88H2O, it approximates the classical ammonium octaborate composition (NH4)2B8O13·6H2O and has the structural formula {(NH4)2[B7O9(OH)5]}4·3B(OH)3·5H2O. It spontaneously forms at room temperature in solid-state mixtures of ammonium tetraborate and ammonium pentaborate. It crystallizes in the monoclinic space group P21/c with a = 11.4137(2) Å, b = 11.8877(2) Å, c = 23.4459(3) Å, β = 90.092(1)°, V = 3181.19(8) Å(3), and Z = 2 and contains well-ordered ammonium cations and [B7O9(OH)5](2-) anions and disordered B(OH)3 and H2O molecules linked by extensive H bonding. Expeditious solid-state formation of the heptaborate anion under ambient conditions has important implications for development of practical syntheses of industrially useful borates.

Glass formation and properties of glasses in V/sub 2/O/sub 5/-B/sub 2/O/sub 3/-P/sub 2/O/sub 5/ system

Energy Technology Data Exchange (ETDEWEB)

Sedmale, G P; Vajvad, Ya A; Arkhipova, S E; Laukmanis, L A

1987-01-01

The glass formation in the system V/sub 2/O/sub 5/-B/sub 2/O/sub 3/-P/sub 2/O/sub 5/ and the properties of the obtained glasses have been studied by methods including that of the mathematical design and the treatment of the obtained data on ECM. The glass formation region is limited by the molar content of V/sub 2/O/sub 5/ 30-80%, B/sub 2/O/sub 3/ 0-45%, P/sub 2/O/sub 5/ 20-65%. The chemical stability data show that at the molar content of V/sub 2/O/sub 5/ 45-50% the transfer of vanadium from the state of the modificator to the glass-forming agent takes place. For the studied glasses the electron mechanism of conductivity is the dominating one.

Ca{sub 2}Cr{sub 0.5}Ga{sub 1.5}O{sub 5}—An extremely redox-stable brownmillerite phase

Energy Technology Data Exchange (ETDEWEB)

Luo, Kun; Amano Patino, Midori; Hayward, Michael A., E-mail: michael.hayward@chem.ox.ac.uk

2015-02-15

Investigation of the Ca{sub 2}Cr{sub x}Ga{sub 2−x}O{sub 5} compositional series reveals a maximum chromium solubility of 25%. The most chromium rich composition, Ca{sub 2}Cr{sub 0.5}Ga{sub 1.5}O{sub 5}, adopts a brownmillerite-type anion deficient perovskite structure described in space group Pnma (a=5.368 Å, b=14.547 Å, c=5.593 Å). Neutron powder diffraction data reveals rigorous B-site cation order, with all of the tetrahedral coordination sites occupied exclusively by gallium and the octahedral coordination sites occupied by gallium or chromium. Annealing studies reveals Ca{sub 2}Cr{sub 0.5}Ga{sub 1.5}O{sub 5} is stable in both oxidizing (100% O{sub 2}) and reducing (5% H{sub 2} in N{sub 2}) conditions up to 800 °C, suggesting it could find application as a stable host lattice for fuel cell electrodes or electrolytes with suitable doping to enhance catalytic behaviour and/or anionic conductivity. - Graphical abstract: Ca{sub 2}Cr{sub 0.5}Ga{sub 1.5}O{sub 5}, adopts a brownmillerite-type anion deficient perovskite structure yet it is stable in both oxidizing (100% O{sub 2}) and reducing (5% H{sub 2} in N{sub 2}) conditions up to 800 °C. - Highlights: • Anion deficient oxide stable to both oxidation and reduction up to 800 °C. • Cation-ordered brownmillerite structure determined by powder neutron diffraction. • Low solubility of Cr{sup 3+} in framework due to spherical d{sup 3} electron configuration.

Influence of heat treatments upon the mechanical properties and in vitro bioactivity of ZrO2-toughened MgO-CaO-SiO2-P2O5-CaF2 glass-ceramics.

Science.gov (United States)

Li, Huan-Cai; Wang, Dian-Gang; Meng, Xiang-Guo; Chen, Chuan-Zhong

2014-09-01

Zirconia-toughened MgO-CaO-SiO2-P2O5-CaF2 glass-ceramics are prepared using sintering techniques, and a series of heat treatment procedures are designed to obtain a glass-ceramic with improved properties. The crystallization behavior, phase composition, and morphology of the glass-ceramics are characterized. The bending strength, elastic modulus, fracture toughness, and microhardness of the glass-ceramics are investigated, and the effect mechanism of heat treatments upon the mechanical properties is discussed. The bioactivity of glass-ceramics is then evaluated using the in vitro simulated body fluid (SBF) soaking test, and the mechanism whereby apatite forms on the glass-ceramic surfaces in the SBF solution is discussed. The results indicate that the main crystal phase of the G-24 sample undergoing two heat treatment procedures is Ca5(PO4)3F (fluorapatite), and those of the G-2444 sample undergoing four heat treatment procedures are Ca5(PO4)3F and β-CaSiO3 (β-wollastonite). The heat treatment procedures are found to greatly influence the mechanical properties of the glass-ceramic, and an apatite layer is induced on the glass-ceramic surface after soaking in the SBF solution.

Attikaite, Ca3Cu2Al2(AsO4)4(OH)4 · 2H2O, a new mineral species

Science.gov (United States)

Chukanov, N. V.; Pekov, I. V.; Zadov, A. E.

2007-12-01

Attikaite, a new mineral species, has been found together with arsenocrandalite, arsenogoyazite, conichalcite, olivenite, philipsbornite, azurite, malachite, carminite, beudantite, goethite, quartz, and allophane at the Christina Mine No. 132, Kamareza, Lavrion District, Attiki Prefecture (Attika), Greece. The mineral is named after the type locality. It forms spheroidal segregations (up to 0.3 mm in diameter) consisting of thin flexible crystals up to 3 × 20 × 80 μm in size. Its color is light blue to greenish blue, with a pale blue streak. The Mohs’ hardness is 2 to 2.5. The cleavage is eminent mica-like parallel to {001}. The density is 3.2(2) g/cm3 (measured in heavy liquids) and 3.356 g/cm3 (calculated). The wave numbers of the absorption bands in the infrared spectrum of attikaite are (cm-1; sh is shoulder; w is a weak band): 3525 sh, 3425, 3180, 1642, 1120 w, 1070 w, 1035 w, 900 sh, 874, 833, 820, 690 w, 645 w, 600 sh, 555, 486, 458, and 397. Attikaite is optically biaxial, negative, α = 1.642(2), β = γ = 1.644(2) ( X = c) 2 V means = 10(8)°, and 2 V calc = 0°. The new mineral is microscopically colorless and nonpleochroic. The chemical composition (electron microprobe, average over 4 point analyses, wt %) is: 0.17 MgO, 17.48 CaO, 0.12 FeO, 16.28 CuO, 10.61 Al2O3, 0.89 P2O5, 45.45 As2O5, 1.39 SO3, and H2O (by difference) 7.61, where the total is 100.00. The empirical formula calculated on the basis of (O,OH,H2O)22 is: Ca2.94Cu{1.93/2+} Al1.97Mg0.04Fe{0.02/2+} [(As3.74S0.16P0.12)Σ4.02O16.08](OH)3.87 · 2.05H2 O. The simplified formula is Ca3Cu2Al2(AsO4)4(OH)4 · 2H2O. Attikaite is orthorhombic, space group Pban, Pbam or Pba2; the unit-cell dimensions are a = 10.01(1), b = 8.199(5), c = 22.78(1) Å, V = 1870(3) Å3, and Z = 4. In the result of the ignition of attikaite for 30 to 35 min at 128 140°, the H2O bands in the IR spectrum disappear, while the OH-group band is not modified; the weight loss is 4.3%, which approximately corresponds to two H2O

Zoledronate complexes. III. Two zoledronate complexes with alkaline earth metals: [Mg(C(5)H(9)N(2)O(7)P(2))(2)(H(2)O)(2)] and [Ca(C(5)H(8)N(2)O(7)P(2))(H(2)O)](n).

Science.gov (United States)

Freire, Eleonora; Vega, Daniel R; Baggio, Ricardo

2010-06-01

Diaquabis[dihydrogen 1-hydroxy-2-(imidazol-3-ium-1-yl)ethylidene-1,1-diphosphonato-kappa(2)O,O']magnesium(II), [Mg(C(5)H(9)N(2)O(7)P(2))(2)(H(2)O)(2)], consists of isolated dimeric units built up around an inversion centre and tightly interconnected by hydrogen bonding. The Mg(II) cation resides at the symmetry centre, surrounded in a rather regular octahedral geometry by two chelating zwitterionic zoledronate(1-) [or dihydrogen 1-hydroxy-2-(imidazol-3-ium-1-yl)ethylidene-1,1-diphosphonate] anions and two water molecules, in a pattern already found in a few reported isologues where the anion is bound to transition metals (Co, Zn and Ni). catena-Poly[[aquacalcium(II)]-mu(3)-[hydrogen 1-hydroxy-2-(imidazol-3-ium-1-yl)ethylidene-1,1-diphosphonato]-kappa(5)O:O,O':O',O''], [Ca(C(5)H(8)N(2)O(7)P(2))(H(2)O)](n), consists instead of a Ca(II) cation in a general position, a zwitterionic zoledronate(2-) anion and a coordinated water molecule. The geometry around the Ca(II) atom, provided by six bisphosphonate O atoms and one water ligand, is that of a pentagonal bipyramid with the Ca(II) atom displaced by 0.19 A out of the equatorial plane. These Ca(II) coordination polyhedra are ;threaded' by the 2(1) axis so that successive polyhedra share edges of their pentagonal basal planes. This results in a strongly coupled rhomboidal Ca(2)-O(2) chain which runs along [010]. These chains are in turn linked by an apical O atom from a -PO(3) group in a neighbouring chain. This O-atom, shared between chains, generates strong covalently bonded planar arrays parallel to (100). Finally, these sheets are linked by hydrogen bonds into a three-dimensional structure. Owing to the extreme affinity of zoledronic acid for bone tissue, in general, and with calcium as one of the major constituents of bone, it is expected that this structure will be useful in modelling some of the biologically interesting processes in which the drug takes part.

Orphan Spins in the S=5/2 Antiferromagnet CaFe_{2}O_{4}.

Science.gov (United States)

Stock, C; Rodriguez, E E; Lee, N; Demmel, F; Fouquet, P; Laver, M; Niedermayer, Ch; Su, Y; Nemkovski, K; Green, M A; Rodriguez-Rivera, J A; Kim, J W; Zhang, L; Cheong, S-W

2017-12-22

CaFe_{2}O_{4} is an anisotropic S=5/2 antiferromagnet with two competing A (↑↑↓↓) and B (↑↓↑↓) magnetic order parameters separated by static antiphase boundaries at low temperatures. Neutron diffraction and bulk susceptibility measurements, show that the spins near these boundaries are weakly correlated and a carry an uncompensated ferromagnetic moment that can be tuned with a magnetic field. Spectroscopic measurements find these spins are bound with excitation energies less than the bulk magnetic spin waves and resemble the spectra from isolated spin clusters. Localized bound orphaned spins separate the two competing magnetic order parameters in CaFe_{2}O_{4}.

Orphan Spins in the S =5/2 Antiferromagnet CaFe2O4

Science.gov (United States)

Stock, C.; Rodriguez, E. E.; Lee, N.; Demmel, F.; Fouquet, P.; Laver, M.; Niedermayer, Ch.; Su, Y.; Nemkovski, K.; Green, M. A.; Rodriguez-Rivera, J. A.; Kim, J. W.; Zhang, L.; Cheong, S.-W.

2017-12-01

CaFe2O4 is an anisotropic S =5/2 antiferromagnet with two competing A (↑↑↓↓) and B (↑↓↑↓) magnetic order parameters separated by static antiphase boundaries at low temperatures. Neutron diffraction and bulk susceptibility measurements, show that the spins near these boundaries are weakly correlated and a carry an uncompensated ferromagnetic moment that can be tuned with a magnetic field. Spectroscopic measurements find these spins are bound with excitation energies less than the bulk magnetic spin waves and resemble the spectra from isolated spin clusters. Localized bound orphaned spins separate the two competing magnetic order parameters in CaFe2 O4 .

Structure and properties of ZnO-B{sub 2}O{sub 3}-P{sub 2}O{sub 5}-TeO{sub 2} glasses

Energy Technology Data Exchange (ETDEWEB)

Mosner, Petr, E-mail: petr.mosner@upce.cz [Department of General and Inorganic Chemistry, University of Pardubice, Faculty of Chemical Technology, 53210 Pardubice (Czech Republic); Vosejpkova, Katerina; Koudelka, Ladislav [Department of General and Inorganic Chemistry, University of Pardubice, Faculty of Chemical Technology, 53210 Pardubice (Czech Republic); Montagne, Lionel; Revel, Bertrand [Unite de Catalyse et de Chimie du Solide - UCCS, Univ Lille Nord de France, F-59000, CNRS UMR 8181, USTL F-59655, ENSCL F-59652, Villeneuve d' Ascq (France)

2010-11-01

Zinc borophosphate glasses doped with TeO{sub 2} were studied in the compositional series (100 - x)[0.5ZnO-0.1B{sub 2}O{sub 3}-0.4P{sub 2}O{sub 5}]-xTeO{sub 2} in a broad concentration range of x = 0-80 mol% TeO{sub 2}. The structure of the glasses was studied by Raman and IR spectroscopy and by {sup 31}P and {sup 11}B MAS NMR spectroscopy. According to the Raman and IR spectra, TeO{sub 2} is incorporated in the structural network in the form of TeO{sub 3}, TeO{sub 3+1} and TeO{sub 4} structural units. The ratio of TeO{sub 4}/TeO{sub 3} increases with increasing TeO{sub 2} content in the glasses. The incorporation of TeO{sub x} units into the glass network is associated with the depolymerisation of phosphate chains, as revealed by Raman spectroscopy. The incorporation of TeO{sub 2} modifies also the coordination of boron atoms, where B(OP){sub 4} structural units are gradually replaced by B(OP){sub 4-n}(OTe){sub n} units. The addition of TeO{sub 2} to the parent zinc borophosphate glass results in a decrease of glass transition temperature associated with the replacement of stronger P-O and B-O bonds by weaker Te-O bonds. Chemical durability of glasses reveals a minimum at the glass containing 10 mol% TeO{sub 2}, but with further additions of TeO{sub 2} it improves and the glasses with a high TeO{sub 2} content reveal better durability than the parent zinc borophosphate glass.

Ilyukhinite (H3O,Na)14Ca6Mn2Zr3Si26O72(OH)2 • 3H2O, a New Mineral of the Eudialyte Group

Science.gov (United States)

Chukanov, N. V.; Rastsvetaeva, R. K.; Rozenberg, K. A.; Aksenov, S. M.; Pekov, I. V.; Belakovsky, D. I.; Kristiansen, R.; Van, K. V.

2017-12-01

A new eudialyte-group mineral, ilyukhinite, ideally (H3O,Na)14Ca6Mn2Zr3Si26O72(OH)2 · 3H2O, has been found in peralkaline pegmatite at Mt. Kukisvumchorr, Khibiny alkaline pluton, Kola Peninsula, Russia. It occurs as brownish orange, with vitreous luster anhedral grains up to 1 mm across in hydrothermally altered peralkaline rock, in association with aegirine, murmanite, albite, microcline, rhabdophane-(Ce), fluorite, sphalerite and molybdenite. The Mohs hardness is 5; cleavage is not observed. D meas 2.67(2), D calc 2.703 g/cm3. Ilyukhinite is optically uniaxial (-): ω = 1.585(2), ɛ = 1.584(2). The IR spectrum is given. The average chemical composition of ilyukhinite (wt %; electron microprobe, ranges given in parentheses; H2O determined by gas chromatography) is as follows: 3.07 (3.63-4.43) Na2O, 0.32 (0.28-0.52) K2O, 10.63 (10.26-10.90) CaO, 3.06 (2.74-3.22) MnO, 1.15 (0.93-1.37) FeO, 0.79 (0.51-0.89) La2O3, 1.21 (0.97-1.44) Ce2O3, 0.41 (0.30-0.56) Nd2O3, 0.90 (0.77-1.12) TiO2, 10.94 (10.15-11.21) ZrO2, 1.40 (0.76-1.68) Nb2O5, 51.24 (49.98-52.28) SiO2, 1.14 (0.89-1.37) SO3, 0.27 (0.19—0.38) Cl, 10.9(5 )H2O,-0.06-O = C1, total is 98.27. The empirical formula is H36.04(Na3.82K0.20)(Ca5.65Ce0.22La0.14Nd0.07)(Mn1.285Fe0.48)(Zr2.645Ti0.34)Nb0.31Si25.41S0.42Cl0.23O86.82. The crystal structure has been solved ( R = 0.046). Ilyukhinite is trigonal, R3 m; a = 14.1695(6) Å, b = 31.026(1) Å, V = 5394.7(7) Å3, Z = 3. The strongest XRD reflections [ d, Å (I, %) ( hkl)] are 11.44 (82) (101), 7.09 (70) (110), 6.02 (44) (021), 4.371 (89) 205), 3.805 (47) (303, 033), 3.376 (41) (131), 2.985 (100) (315, 128), 2.852 (92) (404). Ilyukhinite was named in memory of Vladimir V. Ilyukhin (1934-1982), an outstanding Soviet crystallographer. The type specimen of ilyukhinite has been deposited in the collection of the Natural History Museum, University of Oslo, Norway.

Effect of CeO2 and Y2O3 on microstructure, bioactivity and degradability of laser cladding CaO-SiO2 coating on titanium alloy.

Science.gov (United States)

Li, H C; Wang, D G; Chen, C Z; Weng, F

2015-03-01

To solve the lack of strength of bulk biomaterials for load-bearing applications and improve the bioactivity of titanium alloy (Ti-6Al-4V), CaO-SiO2 coatings on titanium alloy were fabricated by laser cladding technique. The effect of CeO2 and Y2O3 on microstructure and properties of laser cladding coating was analyzed. The cross-section microstructure of ceramic layer from top to bottom gradually changes from cellular-dendrite structure to compact cellular crystal. The addition of CeO2 or Y2O3 refines the microstructure of the ceramic layer in the upper and middle regions. The refining effect on the grain is related to the kinds of additives and their content. The coating is mainly composed of CaTiO3, CaO, α-Ca2(SiO4), SiO2 and TiO2. Y2O3 inhibits the formation of CaO. After soaking in simulated body fluid (SBF), the calcium phosphate layer is formed on the coating surface, indicating the coating has bioactivity. After soaking in Tris-HCl solution, the samples doped with CeO2 or Y2O3 present a lower weight loss, indicating the addition of CeO2 or Y2O3 improves the degradability of laser cladding sample. Copyright © 2015 Elsevier B.V. All rights reserved.

Structural and Physical Properties of Fe2O3-B2O3-V2O5 Glasses

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Virender Kundu

2008-01-01

Full Text Available The structural and physical properties of xFe2O3-(40-x B2O3-60V2O5  (0≤x≤20 glass system have been investigated. The samples were prepared by normal melt-quench technique. The structural changes were inferred by means of FTIR by monitoring the infrared (IR spectra in the spectral range 600–4000 cm-1. The absence of boroxol ring (806 cm-1 in the present glass system suggested that these glasses consist of randomly connected BO3 and BO4 units. The conversion of BO3 to BO4 and VO5 to VO4 tetrahedra along with the formation of non-bridging oxygen's (NBOs attached to boron and vanadium takes place in the glasses under investigation. The density and molar volume of the present glass system were found to depend on Fe2O3 content. DC conductivity of the glass system has been determined in the temperature range 310–500 K. It was found that the general behavior of electrical conductivity was similar for all glass compositions and found to increase with increasing iron content. The parameters such as activation energy, average separation between transition metal ions (TMIs, polaron radius, and so forth have been calculated in adiabatic region and are found consistent with Mott's model of phonon-assisted polaronic hopping.

Structural and optical properties of Ta{sub 2}O{sub 5}:Eu{sup 3+}: Mg{sup 2+} or Ca{sup 2+} phosphor prepared by molten salt method

Energy Technology Data Exchange (ETDEWEB)

Verma, Naveen, E-mail: vermanaveen17@gmail.com; Singh, Krishan Chander; Jindal, Jitender [Department of chemistry, Maharshi Dayanand University, Rohtak-124001 – India (India); Mari, Bernabe; Mollar, Miguel; Manjón, F. J. [Institut de Disseny per la Fabricació Automatitzada - Departament de Física Aplicada, Universitat Politècnica de València, Camí de Vera s/n, 46022 València (Spain); Rana, Ravi [Department of Chemistry, SGT University, Gurgaon (India); Pereira, A. L. J. [Universitat Politècnica de València, 46022 València (Spain)

2016-04-13

Ta{sub 2}O{sub 5}:Eu{sup 3+}: Mg{sup 2+} or Ca{sup 2+} phosphor materials were prepared by molten salt method using KCl as flux. The X-ray diffraction (XRD) patterns illustrated that the well crystallized Ta{sub 2}O{sub 5}:Eu{sup 3+}: Mg{sup 2+} or Ca{sup 2+} were formed in the presence of flux under reduced temperature (800 °C) in contrast to conventional solid state method (1200-1500 °C). Scanning electron microscope (SEM) images indicate the achievement of well dispersed particles (hexagonal tablet and rod-like structures). Meanwhile, the photo-luminescent studies demonstrated that Ta{sub 2}O{sub 5} is an efficient host to sensitize europium red emissions. The addition of Mg{sup 2+} or Ca{sup 2+} as co-dopant enhanced the luminescent intensity of Ta{sub 2}O{sub 5}: Eu{sup 3+} compound.

The crystallization behaviour and bioactivity of wollastonite glass-ceramic based on Na2O–K2O–CaO–SiO2–F glass system

Directory of Open Access Journals (Sweden)

S.M. Salman

2015-09-01

Full Text Available The study concerns about the crystallization behaviour and in vitro bioactivity of a glass-ceramic prepared from a series of glasses in the Na2O–K2O–CaO–SiO2–F system. A minor amount of cerium oxide was also added instead of calcium oxide in some selective glass batches. The main crystalline phases, formed after the appropriate heat treatments, were wollastonite solid solution and pseudo-wollastonite-like phases. There is a preferential tendency for wollastonite (CaSiO3 to accommodate K, Na, F, and Ce ions in its structure forming wollastonite solid solution with variable formulas. The bioactivity of the resulting crystalline materials was examined in vitro by immersion in simulated body fluid at 37 °C. An increase of the surface bioactivity of glass-ceramic with the Na2O/K2O replacement was observed which is attributed to the augmentation solubility of the crystalline sample. On the other hand, the bioactivity of the crystalline sample with CeO2/CaO replacement was improved by the crystallization of pseudo-wollastonite phase together with wollastonite solid solution phase.

Luminescence and energy transfer of Tb3+-doped BaO-Gd2O3-Al2O3-B2O3-SiO2 glasses.

Science.gov (United States)

Zuo, Chenggang; Huang, Jinze; Liu, Shaoyou; Xiao, Anguo; Shen, Youming; Zhang, Xiangyang; Zhou, Zhihua; Zhu, Ligang

2017-12-05

Transparent Tb 3+ -doped BaO-Gd 2 O 3 -Al 2 O 3 -B 2 O 3 -SiO 2 glasses with the greater than 4g/cm 3 were prepared by high temperature melting method and its luminescent properties have been investigated by measured UV-vis transmission, excitation, emission and luminescence decay spectra. The transmission spectrum shows there are three weak absorption bands locate at about 312, 378 and 484nm in the glasses and it has good transmittance in the visible spectrum region. Intense green emission can be observed under UV excitation. The effective energy transfer from Gd 3+ ion to Tb 3+ ion could occur and sensitize the luminescence of Tb 3+ ion. The green emission intensity of Tb 3+ ion could change with the increasing SiO 2 /B 2 O 3 ratio in the borosilicate glass matrix. With the increasing concentration of Tb 3+ ion, 5 D 4 → 7 F J transitions could be enhanced through the cross relaxation between the two nearby Tb 3+ ions. Luminescence decay time of 2.12ms from 546nm emission is obtained. The results indicate that Tb 3+ -doped BaO-Gd 2 O 3 -Al 2 O 3 -B 2 O 3 -SiO 2 glasses would be potential scintillating material for applications in X-ray imaging. Copyright © 2017 Elsevier B.V. All rights reserved.

PHASE TRANSITION OF CaFeO2.5 AT HIGH TEMPERATURE

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T Labii

2011-12-01

Full Text Available The numerous studies conducted on the structure of CaFeO2.5 showed that the material undergoes a series of transformations based on temperature. The first one appears around 700 K and indicates the evolution of the phasemagnetic material to a paramagnetic phase. At about 970 K the structure of CaFeO2.5 changes from rhombohedral to centered structure. Finally, around 1180 K it undergoes the transition to a structure that has been described as incommensurate modulated structure. We have observed the behavior of the material beyond this temperature by dilatometry, DSC and TGA. The tests conducted on a single crystal CaFeO2.5 confirm the changes already observed.For the first time there was a dilatometric anomaly (confirmed by DSC and TGA at 1310 K. This anomaly appears only in the crystallographic direction b which should probably be a  commensurate transformation of the material.

Crystallization and magnetic properties of a 10Li{sub 2}O–9MnO{sub 2}–16Fe{sub 2}O{sub 3}–25CaO–5P{sub 2}O{sub 5}–35SiO{sub 2} glass

Energy Technology Data Exchange (ETDEWEB)

Wang, Moo-Chin, E-mail: mcwang@kmu.edu.tw [Department of Fragrance and Cosmetic Science, Kaohsiung Medical University, 100 Shih-Chuan 1st Road, Kaohsiung 80708, Taiwan (China); Cheng, Huy-Zu [Department of Materials Science and Engineering, I-Shou University, 1 123456789Hsueh-Cheng Road, Section 1, Ta-Hsu, Kaohsiung 84001, Taiwan (China); Lin, Huey-Jiuan [Department of Materials Science and Engineering, National United University, 1 Lien-Da Road, Kung-Ching Li, Miao-Li 36003, Taiwan (China); Wang, Chien-Fu [Department of Materials Science and Engineering, I-Shou University, 1 123456789Hsueh-Cheng Road, Section 1, Ta-Hsu, Kaohsiung 84001, Taiwan (China); Hsi, Chi-Shiung, E-mail: chsi@nuu.edu.tw [Department of Materials Science and Engineering, National United University, 1 Lien-Da Road, Kung-Ching Li, Miao-Li 36003, Taiwan (China)

2013-06-15

The crystallization behavior and magnetic properties of 10Li{sub 2}O–9MnO{sub 2}–16Fe{sub 2}O{sub 3}–25CaO–5P{sub 2}O{sub 5}–35SiO{sub 2} (10LFS) glass have been studied using differential thermal analysis (DTA), X-ray diffraction (XRD), scanning electron microscopy (SEM), energy-dispersive X-ray spectrometry (EDS), transmission electron microscopy (TEM) and selected area electron diffraction (SAED) to observe the crystallization behavior and a superconducting quantum interference device (SQUID) for measurements of the magnetic properties. The DTA shows that the 10LFS glass has one broad exothermic peak at approximately 674 °C and one sharp (the highest) exothermic peak at 764 °C. When the 10LFS glass crystallized at 850 °C for 4 h, the crystalline phases identified by XRD were lithium silicate (Li{sub 2}SiO{sub 3}), β-wollastonite (β-CaSiO{sub 3}), lithium orthophosphate (Li{sub 3}PO{sub 4}), magnetite (FeFe{sub 2}O{sub 4}) and triphylite (Li(Mn{sub 0.5}Fe{sub 0.5})PO{sub 4}). The SEM surface analysis revealed that the β-wollastonite and lithium silicate have a lath morphology. The TEM microstructure examination showed that the largest FeFe{sub 2}O{sub 3} particles have a size of approximately 0.3 μm. When the 10LFS glass was heat treated at 850 °C for 16 h and a magnetic field of 1000 Oe was applied, a very small remnant magnetic induction of 0.01 emu g{sup −1} and a coercive force of 50 Oe were obtained, which revealed an inverse spinel structure. - Highlights: ► The phases formed at 850 °C in the 10LFS glass-ceramics are LiSiO{sub 3}, β-CaSiO{sub 3}, Li{sub 3}PO{sub 4}, FeFe{sub 2}O{sub 4} and Li(Mn{sub 0.5}Fe{sub 0.5})PO{sub 4}. ► The β-wollastonite and lithium silicate have a lath morphology. ► When 10LFS glass-ceramics applied magnetic field showing the ferromagnetic behavior of an inverse spinel structure.

MgO–CaO–Cr2O3 composition as a novel refractory brick: Use of Cr2O3 nanoparticles

Energy Technology Data Exchange (ETDEWEB)

Ghasemi-Kahrizsangi, S.; Dehsheikh, H.G.; Boroujerdnia, M.

2017-07-01

At this study the effect of Cr2O3 nanoparticles (up to 3wt.%) on the physical and mechanical properties of MgO–CaO refractory composition with emphasis on the hydration resistance improvement have been investigated. Specimens pressed at 90MPa then were sintered at 1650°C for 5h in an electric furnace. Properties such as bulk density, apparent porosity, cold crushing strength and hydration resistance were examined. The crystalline phases and microstructure characteristics of sintered specimens were studied by X-ray diffraction (XRD) and scanning electron microscopy (SEM/EDS), respectively. Results shown that add of the 1.5wt.% Cr2O3 nanoparticles have the best results i.e. increased the bulk density (3.41g/cm3), cold crushing strength (848kg/cm2), hydration resistance (1.5%) and decreased apparent porosity (5.58%), respectively. The mechanism of specimens hydration resistance improvement are: (i) decreasing the amount of free CaO and MgO with converted to high hydration resistance phases such as CaCr2O4 and MgCr2O4 phases, (ii) promotion of the densification as well as (iii) modification of the microstructure. (Author)

Formulation of calcium dialuminate (CaO·2Al2O3 refractory cement from local bauxite

Directory of Open Access Journals (Sweden)

A.B. Tchamba

2015-06-01

Full Text Available Three types of bauxites containing aluminum hydroxide of 58.1% gibbsite and 19.3% boehmite for BX3, 95.5% of gibbsite for BX55 and 84.5% of gibbsite for BX8 were used with lime at 95% of CaO through solid state sintering in one stage to prepare a refractory clinker at 1550 °C. The powder obtained after grinding the clinker showed in the XRD curves the presence of CaO·2Al2O3 and CaO·TiO2 phases in the cement samples. The density of cement powder varied between 2.95 and 3.17 g/cm3 and the specific area of powder obtained after grinding was between 0.72 and 0.85 m2/g. The properties of hydrated cement, W/C = 0.33, after stabilization of cement components for 48 h at 105 °C were showed by XRD, DTA, DTG and SEM (C3AH6, AH3, CA2 and CaO·TiO2. The Young's modulus of the cement made varied between 35.5 and 39.4 GPa, and these Young's moduli were compared to conventional CA14M cement.

Preparation of orthophosphate glasses in the MgO-CaO-SiO2-Nb2O5-P2O5 system.

Science.gov (United States)

Lee, Sungho; Ueda, Kyosuke; Narushima, Takayuki; Nakano, Takayoshi; Kasuga, Toshihiro

2017-01-01

Niobia/magnesia-containing orthophosphate invert glasses were successfully prepared in our earlier work. Orthophosphate groups in the glasses were cross-linked by tetrahedral niobia (NbO4) and magnesia. The aim of this work is to prepare calcium orthophosphate invert glasses containing magnesia and niobia, incorporating silica, and to evaluate their structures and releasing behaviors. The glasses were prepared by melt-quenching, and their structures and ion-releasing behaviors were evaluated. 31P solid-state nuclear magnetic resonance (NMR) and Raman spectroscopies showed the glasses consist of orthophosphate (PO4), orthosilicate (SiO4), and NbO4 tetrahedra. NbO4 and MgO in the glasses act as network formers. By incorporating SiO2 into the glasses, the chemical durability of the glasses was slightly improved. The glasses reheated at 800°C formed the orthophosphate crystalline phases, such as β-Ca3(PO4)2, Mg3(PO4)2 and Mg3Ca3(PO4)4 in the glasses. The chemical durability of the crystallized glasses was slightly improved. Orthosilicate groups and NbO4 in the glasses coordinated with each other to form Si-O-Nb bonds. The chemical durability of the glasses was slightly improved by addition of SiO2, since the field strength of Si is larger than that of Ca or Mg.

Luminescence of a new class of UV-blue-emitting phosphors MSi2O2-deltaN2+2/3delta:Ce3+ (M = Ca, Sr, Ba)

NARCIS (Netherlands)

Li, Y.Q.; With, de G.; Hintzen, H.T.J.M.

2005-01-01

The luminescence properties of Ce3+,Na+-codoped MSi2O22dN2+2/3d (M 5 Ca, Sr, Ba) are reported. The undoped and Ce3+,Na+-codoped MSi2O22dN2+2/3d powders were prepared by a solid-state reaction at temperatures between 1300–1400 uC under N2–H2 (10%) atmosphere in the system MO–SiO2–Si3N4 (M 5 Ca, Sr,

An i.r. investigation on some calcium aluminate hydrates, Ca2Al(OH)6+X-.yH2O (= 3CaO.Al2O3.CaX2.nH2O, X- = univalent anion)

NARCIS (Netherlands)

Houtepen, C.J.M.; Stein, H.N.

1976-01-01

The i.r. spectra of some hydrated and dehydrated calcium aluminate hydrates of the type Ca2Al(OH)6+X-·yH2O with X- = Cl-, Br-, J-, ClO3-, NO3-, ClO4- (y = 2) and X- = BrO3-, JO3- (2

Phase diagram study for the PbO-ZnO-CaO-SiO_2 -“Fe_2O_3 ” system in air with CaO/SiO_2 in 1.1 and PbO/(CaO+SiO_2) in 2.4 weight ratios

International Nuclear Information System (INIS)

Lopez-Rodriguez, Josue; Romero-Serrano, Antonio; Hernandez-Ramirez, Aurelio; Cruz-Ramirez, Alejandro; Almaguer-Guzman, Isaias; Benavides-Perez, Ricardo; Flores-Favela, Manuel

2017-01-01

An experimental study on the phase equilibrium and the liquidus isotherms for the PbO-ZnO-CaO-SiO_2 -“Fe_2O_3 ” system with CaO/SiO_2 in 1.1 and PbO/(CaO+SiO_2) in 2.4 weight ratios, respectively, was carried out in the temperature range 1100-1300 deg C (1373-1573 K). High temperature phases were determined by the equilibrium-quenching method. Results are presented in the form of pseudo-ternary sections “Fe_2O_3 ”-ZnO-(PbO+CaO+SiO_2). X-Ray diffraction (XRD) and SEM-EDS results showed that the phase equilibria in this system are dominated by the high melting temperature spinel and zincite phases. It was observed that if the system is at a temperature below 1300 deg C and the total (Fe_2O_3 + ZnO) is greater than 20 wt%, spinel and/or zincite will be present in the slag system. As an application of the phase diagram, the liquid phase compositions below the liquidus surface were estimated, then their viscosities were calculated using FACTSage software. (author)

Viscosity and Structure of CaO-SiO2-P2O5-FetO System with Varying P2O5 and FeO Content

Science.gov (United States)

Diao, Jiang; Gu, Pan; Liu, De-Man; Jiang, Lu; Wang, Cong; Xie, Bing

2017-10-01

A rotary viscosimeter and Raman spectrum were employed to measure the viscosity and structural information of the CaO-SiO2-P2O5-FetO system at 1673 K. The experimental data have been compared with the calculated results using different viscosity models. It shows that the National Physical Laboratory (NPL) and Pal models fit the CaO-SiO2-P2O5-FeOt system better. With the P2O5 content increasing from 5% to 14%, the viscosity increases from 0.12 Pa s to 0.27 Pa s. With the FeO content increasing from 30% to 40%, the viscosity decreases from 0.21 Pa s to 0.12 Pa s. Increasing FeO content makes the complicated molten melts become simple, and increasing P2O5 content will complicate the molten melts. The linear relation between viscosity and structure parameter Q(Si + P) was obtained by regression analysis. The calculated viscosity by using the optimized NPL and Pal model are almost identical with the fitted values.

Structural studies of five layer Aurivillius oxides: A2Bi4Ti5O18 (A=Ca, Sr, Ba and Pb)

International Nuclear Information System (INIS)

Ismunandar; Kamiyama, T.; Hoshikawa, A.; Zhou, Q.; Kennedy, B.J.; Kubota, Y.; Kato, K.

2004-01-01

The room temperature structures of the five layer Aurivillius phases A 2 Bi 4 Ti 5 O 18 , (A=Ca, Sr, Ba and Pb) have been refined from powder neutron diffraction data using the Rietveld method. The structures consist of [Bi 2 O 2 ] 2+ layers interleaved with perovskite-like [A 2 Bi 2 Ti 5 O 16 ] 2- blocks. The structures were refined in the orthorhombic space group B2eb (SG. No. 41), Z=4, and the unit cell parameters of the oxides are a=5.4251(2), b=5.4034(1), c=48.486(1); a=5.4650(2), b=5.4625(3), c=48.852(1); a=5.4988(3), b=5.4980(4), c=50.352(1); a=5.4701(2), b=5.4577(2), c=49.643(1) for A=Ca, Sr, Ba and Pb, respectively. The structural features of the compounds were found similar to n=2-4 layers bismuth oxides. The strain caused by mismatch of cell parameter requirements for the [Bi 2 O 2 ] 2+ layers and perovskite-like [A 2 Bi 2 Ti 5 O 16 ] 2- blocks were relieved by tilting of the TiO 6 octahedra. Variable temperature synchrotron X-ray studies for Ca and Pb compounds showed that the orthorhombic structure persisted up to 675 and 475K, respectively. Raman spectra of the compounds are also presented

Investigation of the effect of doping of Cr2O3 on bioactivity properties of the SiO2-CaO-P2O5 bioceramics

Science.gov (United States)

Sarin, Nonita; Singh, K. J.; Kaur, Kulwinder; Anand, Vikas; Kaur, Raminderjit; Singh, Jatinder

2018-05-01

Due to better biocompatibility among various types of biomaterials, bioceramics have been found to be useful for the repair of damaged bone tissues. Authors have prepared bioceramics of the composition xCr2O3-(40-x) SiO2- 40CaO-20P2O5(where, x = 0 and 2 mole %) by using sol gel technique. Prepared samples have been assessed for their bioactivity and cell viability with the help of X-ray diffraction, Fourier transform infrared and MG63 cell line. The aim of this study is to estimate the practical utility of the prepared samples as successful implant materials in human body.

MgO–CaO–Cr2O3 composition as a novel refractory brick: Use of Cr2O3 nanoparticles

Directory of Open Access Journals (Sweden)

Salman Ghasemi-Kahrizsangi

2017-03-01

Full Text Available At this study the effect of Cr2O3 nanoparticles (up to 3 wt.% on the physical and mechanical properties of MgO–CaO refractory composition with emphasis on the hydration resistance improvement have been investigated. Specimens pressed at 90 MPa then were sintered at 1650 °C for 5 h in an electric furnace. Properties such as bulk density, apparent porosity, cold crushing strength and hydration resistance were examined. The crystalline phases and microstructure characteristics of sintered specimens were studied by X-ray diffraction (XRD and scanning electron microscopy (SEM/EDS, respectively. Results shown that add of the 1.5 wt.% Cr2O3 nanoparticles have the best results i.e. increased the bulk density (3.41 g/cm3, cold crushing strength (848 kg/cm2, hydration resistance (1.5% and decreased apparent porosity (5.58%, respectively. The mechanism of specimens hydration resistance improvement are: (i decreasing the amount of free CaO and MgO with converted to high hydration resistance phases such as CaCr2O4 and MgCr2O4 phases, (ii promotion of the densification as well as (iii modification of the microstructure.

Gamma-ray shielding properties of CaO–SrO–B2O3 glasses

DEFF Research Database (Denmark)

Singh, K; Singh, H; Sharma, G

2005-01-01

, the molar volume of the glasses has been derived from density measurements, and the excess volume has been determined as a function of composition. The reported data should be useful for potential applications of these glasses in radiation shielding. (C) 2004 Elsevier Ltd. All rights reserved.......Mass attenuation coefficients, effective atomic numbers and effective electron densities have been determined experimentally for the glass system xCaO . (0.3-x)SrO . 0.7B(2)O(3) at photon energies 511, 662, 1173, and 1332KeV. The results are compared with theoretical calculations. In addition...

Crystallization and sintering characteristics of CaO-Al2O3-SiO2 glasses in the presence of TiO2, CaF2 and ZrO2

International Nuclear Information System (INIS)

Banijamali, S.; Eftekhari Yekta, B.; Rezaie, H.R.; Marghussian, V.K.

2009-01-01

In this study, the effects of different amounts of TiO 2 , ZrO 2 and CaF 2 nucleating agents on sinterability, crystallization, mechanical properties and chemical resistance of glass-ceramics belonging to the CaO-Al 2 O 3 -SiO 2 system were investigated, using differential thermal analysis (DTA), X-ray diffractometry (XRD), scanning electron microscopy (SEM), mechanical and chemical resistance measurements. It was found that in CaF 2 containing samples, the sinterability, crystallization and mechanical properties were improved by increasing of CaF 2 amount. However, addition of ZrO 2 and TiO 2 increases the firing temperature required for complete densification of specimens. Our experiments showed that fluctuations of chemical composition of the residual glass phases during sintering were responsible for these dissimilar trends and greatly influenced mechanical and chemical properties. According to the obtained results, appropriate sinterability, acceptable mechanical and chemical properties, as well as desirable whiteness of the most promising specimens make them suitable choices for floor tile applications. The main crystallization phases in all fully sintered glass-ceramics were wollastonite, anorthite and calcium aluminum silicate.

Ca2 Al2 SiO7 :Ce3+ phosphors for mechanoluminescence dosimetry.

Science.gov (United States)

Tiwari, Geetanjali; Brahme, Nameeta; Sharma, Ravi; Bisen, D P; Sao, Sanjay Kumar; Sahu, Ishwar Prasad

2016-12-01

A series of Ce 3+ ion single-doped Ca 2 Al 2 SiO 7 phosphors was synthesized by a combustion-assisted method at an initiating temperature of 600 °C. The samples were annealed at 1100 °C for 3 h and their X-ray diffraction patterns confirmed a tetragonal structure. The phase structure, particle size, surface morphology and elemental analysis were analyzed using X-ray diffraction (XRD), transmission electron microscope (TEM), scanning electron microscopy (SEM) and energy dispersive X-ray (EDX) spectroscopy techniques. Thermoluminescence (TL) intensity increased with increase in ultraviolet (UV) light exposure time up to 15 min. With further increase in the UV irradiation time the TL intensity decreases. The increase in TL intensity indicates that trap concentration increased with UV exposure time. A broad peak at 121 °C suggested the existence of a trapping level. The peak of mechanoluminescence (ML) intensity versus time curve increased linearly with increasing impact velocity of the moving piston. Mechanoluminescence intensity increased with increase in UV irradiation time up to 15 min. Under UV-irradiation excitation, the TL and ML emission spectra of Ca 2 Al 2 SiO 7 :Ce 3+ phosphor showed the characteristic emission of Ce 3+ peaking at 400 nm (UV-violet) and originating from the Ce 3+ transitions of 5d-4f ( 2 F 5/2 and 2 F 7/2 ). The photoluminescence (PL) emission spectra for Ca 2 Al 2 SiO 7 :Ce 3+ were similar to the ML/TL emission spectra. The mechanism of ML excitation and the suitability of the Ca 2 Al 2 SiO 7 :Ce 3+ phosphor for radiation dosimetry are discussed. Copyright © 2016 John Wiley & Sons, Ltd. Copyright © 2016 John Wiley & Sons, Ltd.

The effect of CaO/SiO2 molar ratio of CaO-Al2O3-SiO2 glasses on their structure and reactivity in alkali activated system.

Science.gov (United States)

Kucharczyk, Sylwia; Sitarz, Maciej; Zajac, Maciej; Deja, Jan

2018-04-05

The influence of CaO/SiO 2 molar ratio of calcium aluminosilicate glasses on resulting structure and reactivity was investigated. Chemical compositions of glasses were chosen to mimic the composition of the fly ash and slag amorphous phase. Understanding the reactivity of these materials is of high importance allowing further development of the composite cements to limit the environmental footprint of cement industry. Fourier transform infrared spectroscopy (FTIR) and Raman spectroscopy were employed to examine the structure of glasses. Reactivity of the glasses was analyzed on paste samples after 1, 2, 7, 28 and 90days of curing by means of thermogravimetry (TGA), X-ray diffraction (XRD) and FTIR. Spectroscopic results emphasize dependence of the structure on the chemical composition of the glasses. The higher CaO/SiO 2 the more depolymerized the glass network is, though there is no direct correlation with the reactivity. Significant differences in reactivity is observed primarily between the glasses of peraluminous (CaO/Al 2 O 3 1). Amongst the pastes made of glasses of percalcic region a higher degree of reaction at later ages is observed for the paste containing glass of lower CaO/SiO 2 molar ratio. This is due to both degree of depolimerization and the nature of these glasses (pozzolanic and hydraulic materials). No difference of degree of reaction has been observed within the glasses of CaO/SiO 2 lower than 1. Copyright © 2018 Elsevier B.V. All rights reserved.

The phenomenon of phase separated in Na2O-B2O3-SiO2, Na2O-SiO2-P2O5 glasses

International Nuclear Information System (INIS)

Procyk, B.; Bieniarz, P.; Plichta, E.; Pudelek, B.; Kucinski, G.; Staniewicz-Brudnik, B.

1997-01-01

During the thermal treatment, the phenomenon of phase separation has been observed in the some glasses. The glass has became opaque, due to the opalescence of phase separated. Investigations of the phenomenon of phase separation were conducted using the basic systems: Na 2 O-B 2 O 3 -SiO 2 , Na 2 O-SiO 2 -P 2 O 5 and theirs modifications. The occurrence of binodal and spinodal phase decomposition was observed by TEM. The phase separation inhomogeneities have drop-like character and with higher concentration shows a tendency for coalescence. The influence of the chemical composition, temperature and time on the phenomenon of phase separation in the investigated glasses has been defined. (author)

Superconducting tunnel junctions on MgB{sub 2} using MgO and CaF{sub 2} as a barrier

Energy Technology Data Exchange (ETDEWEB)

Sakoda, Masahito, E-mail: sakoda@cc.tuat.ac.jp [Department of Applied Physics, Tokyo University of Agriculture and Technology, 2-24-16, Koganei, Tokyo 184-8588 (Japan); Aibara, Masato; Mede, Kazuya; Kikuchi, Motoyuki; Naito, Michio [Department of Applied Physics, Tokyo University of Agriculture and Technology, 2-24-16, Koganei, Tokyo 184-8588 (Japan)

2016-11-15

Highlights: • We have revised the manuscript according to reviewer's comments. The details are in “Response to Reviewers”. • Superconducting junctions with MgO and CaF{sub 2} barrier were fabricated in order to improve the quality of junctions. • In SIN junctions with MgO barrier, clear superconducting gap was observed. (). • In SIS junctions with CaF2 barrier, Josephson current was observed over 30 K. (). • The compatibility of each barrier material at the upper and lower interfaces was clarified. (). - Abstract: We report the fabrication of superconducting tunnel junctions, both of superconductor–insulator-normal metal (SIN) and superconductor–insulator-superconductor (SIS), on MgB{sub 2} using MgO and CaF{sub 2} as a barrier. The SIN junctions fabricated using an MgO barrier showed excellent quasi-particle characteristics, including a large superconducting gap (Δ) of 2.5–3 meV and a low zero-bias conductance. We have also fabricated SIS junctions with an MgO barrier, but the quasi-particle characteristics of the SIS junctions are not as good as those of the SIN junctions, namely a reduced superconducting gap and a high zero-bias conductance. It appears that top MgB{sub 2} electrodes do not grow well on an MgO barrier, which is also suggested from in-situ RHEED observation. The SIN junctions fabricated using a CaF{sub 2} barrier showed less sharp quasi-particle characteristics than using an MgO barrier. However, the SIS junctions using a CaF{sub 2} barrier showed a fairly large I{sub c}R{sub N} value at 4.2 K over 1 mV and also exhibited finite Josephson current up to almost the film's T{sub c} (∼30 K). The RHEED observation revealed that top MgB{sub 2} electrodes grow well on a CaF{sub 2} barrier.

Ferromagnetic glass ceramics and glass fibers based on the composition of SiO{sub 2}-CaO-Al{sub 2}O{sub 3}-B{sub 2}O{sub 3}-Fe{sub 2}O{sub 3} glass system

Energy Technology Data Exchange (ETDEWEB)

Liu, Jianan, E-mail: lja@qlu.edu.cn; Zhu, Chaofeng; Zhang, Meimei; Zhang, Yanfei; Yang, Xuena

2017-03-15

Ferromagnetic glass-ceramics and glass fibers were obtained by the melt-method from the glass system SiO{sub 2}-CaO-Al{sub 2}O{sub 3}-B{sub 2}O{sub 3}-Fe{sub 2}O{sub 3} without performing any nucleation and crystallization heat treatments. Glass-ceramics and glass fibers were characterized by x-ray diffraction, scanning and transmission electron microscopy, magnetic measurements, and thermal expansion instrument. The influence of alumina content on the spontaneous crystallization of magnetite, magnetism properties and thermal expansion performances in glass were investigated. We examined the crystallization behavior of the glasses and found that the spontaneous crystallization capacity of magnetite and magnetism properties in base glass increases with increasing the content of alumina. The ferromagnetic glass fibers containing magnetite nano-crystals are also obtained. - Highlights: • Magnetite nano-crystals are formed spontaneously in the investigated glass systems. • The crystallization behavior of the glasses with the alumina content is examined. • Ferromagnetic glass fibers containing magnetite nano-crystals are obtained.

Raman spectroscopic study of structure and crystallisation behaviour of MoO3-La2O3-B2O3 and MoO3-ZnO-B2O3 glasses

Science.gov (United States)

Aleksandrov, L.; Komatsu, T.; Nagamine, K.; Oishi, K.

2011-03-01

In this study, we focus on the structure and crystallization behavior of MoO3-La2O3-B2O3 and MoO3-ZnO-B2O3 glasses. Glasses of both systems were prepared by a melt-quenching method. The thermal stability of the glasses was examined using differential thermal anaysis (DTA) measurements, and the crystalline phases formed by heat treatments were identified by X-ray diffraction (XRD) analysis. Raman scattering spectra at room temperature for the glasses and crystallized samples were measured with a laser microscope operated with an Ar+ (wavelength: 488 nm) laser. DTA measurements indicated that the thermal stability against crystallization of the glasses decreases drastically with increasing MoO3 content. XRD analysis confirmed that crystallization at 600°C for 3 h of glass with the nominal composition of 50MoO3-25La2O3-25B2O3 resulted in the formation of monoclinic LaMoBO6. Crystallization of 50ZnO-xMoO3-(50-x)B2O3 glasses formed triclinic α-ZnMoO4 as an initial crystalline phase. Moreover, for 30 mol% MoO3 glass, transmission electron microscopy observations showed the formation of α-ZnMoO4 nanocrystals with a diameter of ~ 5 nm. Raman bands at 860, 930 and 950 cm-1 suggested that the coordination state of Mo6+ ions in the glasses were mainly (MoO4)2- tetrahedral units. Therefore, MoO3-containing glasses have good potential for optical applications.

Crystal structures of CCa2CuO5 and CSr1.9Ca1.1Cu2O7 refined from single crystal data

International Nuclear Information System (INIS)

Kopnin, E.M.; Matveev, A.T.; Salamakha, P.S.; Sato, A.; Takayama-Muromachi, E.

2003-01-01

Single crystals were grown for new layered oxycarbonates CCa 2 CuO 5 and CSr 1.9 Ca 1.1 Cu 2 O 7 at 6 GPa using a belt-type apparatus. Their crystal structures were determined using single crystal X-ray diffraction data with R1(wR2)=0.0294(0.0659) and 0.0199(0.0457) for CCa 2 CuO 5 and CSr 1.9 Ca 1.1 Cu 2 O 7 , respectively. These phases crystallize in the space group P4/mmm (No. 123), Z=1 with a=3.8157(1) Angst, c=7.1426(3) Angst for CCa 2 CuO 5 and a=3.8753(1) Angst, c=10.6765(5) Angst for CSr 1.9 Ca 1.1 Cu 2 O 7 . In contrast to CSr 2 CuO 5 , no ordering in the orientation of the triangular CO 3 groups was revealed in CCa 2 CuO 5 and CSr 1.9 Ca 1.1 Cu 2 O 7

Structural study of Al2O3-Na2O-CaO-P2O5 bioactive glasses as a function of aluminium content.

Science.gov (United States)

Smith, J M; King, S P; Barney, E R; Hanna, J V; Newport, R J; Pickup, D M

2013-01-21

Calcium phosphate based biomaterials are extensively used in the context of tissue engineering: small changes in composition can lead to significant changes in properties allowing their use in a wide range of applications. Samples of composition (Al(2)O(3))(x)(Na(2)O)(0.11-x)(CaO)(0.445)(P(2)O(5))(0.445), where x = 0, 0.03, 0.05, and 0.08, were prepared by melt quenching. The atomic-scale structure has been studied using neutron diffraction and solid state (27)Al MAS NMR, and these data have been rationalised with the determined density of the final glass product. With increasing aluminium concentration the density increases initially, but beyond about 3 mol. % Al(2)O(3) the density starts to decrease. Neutron diffraction data show a concomitant change in the aluminium speciation, which is confirmed by (27)Al MAS NMR studies. The NMR data reveal that aluminium is present in 4, 5, and 6-fold coordination and that the relative concentrations of these environments change with increasing aluminium concentration. Materials containing aluminium in 6-fold coordination tend to have higher densities than analogous materials with the aluminium found in 4-fold coordination. Thus, the density changes may readily be explained in terms of an increase in the relative concentration of 4-coordinated aluminium at the expense of 6-fold aluminium as the Al(2)O(3) content is increased beyond 3 mol. %.

Syntheses and structural characterization of vanado-tellurites and vanadyl-selenites: SrVTeO{sub 5}(OH), Cd{sub 2}V{sub 2}Te{sub 2}O{sub 11}, Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O and Ba{sub 2}VSe{sub 3}O{sub 10}

Energy Technology Data Exchange (ETDEWEB)

Konatham, Satish; Vidyasagar, Kanamaluru, E-mail: kvsagar@iitm.ac.in

2017-05-15

Four new quaternary vanado-tellurites and vanadyl-selenites, namely, SrVTeO{sub 5}(OH)(1), Cd{sub 2}V{sub 2}Te{sub 2}O{sub 11}(2), Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O(3) and Ba{sub 2}VSe{sub 3}O{sub 10}(4) have been synthesized and structurally characterized by single crystal X-ray diffraction. The oxidation state of vanadium is +5 in tellurites 1 and 2 and +4 in selenites 3 and 4. The structures of SrVTeO{sub 5}(OH)(1) and Cd{sub 2}V{sub 2}Te{sub 2}O{sub 11}(2) compounds consist of (VTeO{sub 5}(OH)){sup 2-} and (V{sub 2}Te{sub 2}O{sub 11}){sup 4-}anionic chains respectively, which are built from tetrahedral VO{sub 4} and disphenoidal TeO{sub 4} moieties. Similarly the structures of Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O(3) and Ba{sub 2}VSe{sub 3}O{sub 10}(4) respectively contain (VSe{sub 2}O{sub 7}){sup 2-} and (VSe{sub 3}O{sub 10}){sup 4-} anionic chains, which are made up of octahedral VO{sub 6} and pyramidal SeO{sub 3} units. Compounds 1 and 3 have been characterized by thermogravimetric and infrared spectroscopic methods. Compounds 1 and 2 are wide band gap semiconductors. - Graphical abstract: Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O and Ba{sub 2}VSe{sub 3}O{sub 10} compounds contain (VSe{sub 2}O{sub 7}){sup 2-} and (VSe{sub 3}O{sub 10}){sup 4-} chains. - Highlights: • Four new vanado-tellurites and vanadyl-selenites are synthesized. • Their structural features are different. • The vanado-tellurites are wide band gap semiconductors.

Structural and magnetic properties of SiO2–CaO–Na2O–P2O5 containing BaO–Fe2O3 glass–ceramics

International Nuclear Information System (INIS)

Leenakul, W.; Kantha, P.; Pisitpipathsin, N.; Rujijanagul, G.; Eitssayeam, S.; Pengpat, K.

2013-01-01

The incorporation method was employed to produce bioactive glass–ceramics from the BaFe 12 O 19 –SiO 2 –CaO–Na 2 O–P 2 O 5 glass system. The ferrimagnetic BaFe 12 O 19 was first prepared using a simple mixed oxide method, where the oxide precursors of 45S5 bioglass were initially mixed and then melted to form glass. The devitrification of Na 3 Ca 6 (PO 4 ) 5 and Fe 3 O 4 was observed in all of the quenched glass samples. The glass samples were then subjected to a heat treatment schedule for further crystallization. It was found that the small traces of BaFe 12 O 19 phases started to crystallize in high BF content samples of 20 and 40 wt%. These samples also exhibited good magnetic properties comparable to that of other magnetic glass–ceramics. The bioactivity of the BF glass–ceramics improved with increasing BF content as was evident by the formation of bone-like apatite layers on the surface of all of the glass–ceramics after soaking in SBF for 14 days. The results support the use of these bioactive glass–ceramics for hyperthermia treatment within the human body. - Highlights: ►BF addition improves the magnetic property and bioactivity of 45S5 bioglasses.►Bioglass-ceramics exhibited soft magnetic properties with Mr=14.850 emu/g.►Magnetic property can be enhanced by crystallization of BF in 45S5 bioglasses.

Crystalline and Electronic Structures and Magnetic and Electrical Properties of La-Doped Ca2Fe2O5 Compounds

Science.gov (United States)

Phan, T. L.; Tho, P. T.; Tran, N.; Kim, D. H.; Lee, B. W.; Yang, D. S.; Thiet, D. V.; Cho, S. L.

2018-01-01

Brownmillerite Ca2Fe2O5 has been observed to exhibit many outstanding properties that are applicable to ecotechnology. However, very little work on doped Ca2Fe2O5 compounds has been carried out to widen their application scope. We present herein a detailed study of the crystalline/geometric and electronic structures and magnetic and electrical properties of Ca2- x La x Fe2O5 ( x = 0 to 1) prepared by conventional solid-state reaction. X-ray diffraction patterns indicated that the compounds with x = 0 to 0.05 exhibited brownmillerite-type single phase. La doping with higher content ( x ≥ 0.1) stimulated additive formation of Grenier- (LaCa2Fe3O8) and perovskite-type (LaFeO3) phases. Extended x-ray absorption fine structure spectroscopy at the Fe K-edge and electron spin resonance spectroscopy revealed presence of Fe3+ in the parent Ca2Fe2O5 ( x = 0) and both Fe3+ and Fe4+ in the doped compounds ( x ≥ 0.05). The Fe4+ content tended to increase with increasing x. This stimulates ferromagnetic exchange interactions between Fe3+ and Fe4+ ions and directly influences the magnetic properties of Ca2- x La x Fe2O5. Electrical resistivity ( ρ) measurements in the temperature range of T = 20 K to 400 K revealed that all the compounds exhibit insulator behavior; the ρ( T) data for x ≥ 0.1 could be described based on the adiabatic small polaron hopping model.

Synthesis, bioactivity and preliminary biocompatibility studies of glasses in the system CaO-MgO-SiO2-Na2O-P2O5-CaF2.

Science.gov (United States)

Tulyaganov, D U; Agathopoulos, S; Valerio, P; Balamurugan, A; Saranti, A; Karakassides, M A; Ferreira, J M F

2011-02-01

New compositions of bioactive glasses are proposed in the CaO-MgO-SiO(2)-Na(2)O-P(2)O(5)-CaF(2) system. Mineralization tests with immersion of the investigated glasses in simulated body fluid (SBF) at 37°C showed that the glasses favour the surface formation of hydroxyapatite (HA) from the early stages of the experiments. In the case of daily renewable SBF, monetite (CaHPO(4)) formation competed with the formation of HA. The influence of structural features of the glasses on their mineralization (bioactivity) performance is discussed. Preliminary in vitro experiments with osteoblasts' cell-cultures showed that the glasses are biocompatible and there is no evidence of toxicity. Sintering and devitrification studies of glass powder compacts were also performed. Glass-ceramics with attractive properties were obtained after heat treatment of the glasses at relatively low temperatures (up to 850°C).

Electrical mobility of silver ion in Ag2O-B2O3-P2O5-TeO2 glasses.

Science.gov (United States)

Sklepić, Kristina; Vorokhta, Maryna; Mošner, Petr; Koudelka, Ladislav; Moguš-Milanković, Andrea

2014-10-16

The effect of adding TeO(2) into (100 - x)[0.5Ag(2)O - 0.1B(2)O(3) - 0.4P(2)O(5)] - xTeO(2), with 0-80 mol % TeO(2) glass, on the structural changes and electrical properties has been investigated. DSC and thermodilatomery were used to study their thermal behavior, structure was studied by Raman spectroscopy, and electrical properties have been studied by impedance spectroscopy over a wide temperature and frequency range. The introduction of TeO(2) as a third glass former to the glass network causes the structural transformation from TeO(3) (tp) to TeO(4) (tbp) which contributes to the changes in conductivity. The glasses with low TeO(2) content show only a slow decrease in dc conductivity with addition of TeO(2) due to the increase of the number of nonbridging oxygens, which increases the mobility of Ag(+) ions. The steep decrease in conductivity for glasses containing more than 40 mol % TeO(2) is a result of decrease of the Ag(2)O content and stronger cross-linkage in glass network through the formation of more Te-(eq)O(ax)-Te bonds in TeO(4) tbp units. The glasses obey ac conductivity scaling with respect to temperature, implying that the dynamic process is not temperature dependent. On the other hand, the scaling of the spectra for different glass compositions showed the deviations from the Summerfield scaling because of the local structural disorder which occurs as a result of the structural modifications in the tellurite glass network.

High-pressure X-ray diffraction and Raman spectroscopy of CaFe2O4-type β-CaCr2O4

Science.gov (United States)

Zhai, Shuangmeng; Yin, Yuan; Shieh, Sean R.; Shan, Shuangming; Xue, Weihong; Wang, Ching-Pao; Yang, Ke; Higo, Yuji

2016-04-01

In situ high-pressure synchrotron X-ray diffraction and Raman spectroscopic studies of orthorhombic CaFe2O4-type β-CaCr2O4 chromite were carried out up to 16.2 and 32.0 GPa at room temperature using multi-anvil apparatus and diamond anvil cell, respectively. No phase transition was observed in this study. Fitting a third-order Birch-Murnaghan equation of state to the P-V data yields a zero-pressure volume of V 0 = 286.8(1) Å3, an isothermal bulk modulus of K 0 = 183(5) GPa and the first pressure derivative of isothermal bulk modulus K 0' = 4.1(8). Analyses of axial compressibilities show anisotropic elasticity for β-CaCr2O4 since the a-axis is more compressible than the b- and c-axis. Based on the obtained and previous results, the compressibility of several CaFe2O4-type phases was compared. The high-pressure Raman spectra of β-CaCr2O4 were analyzed to determine the pressure dependences and mode Grüneisen parameters of Raman-active bands. The thermal Grüneisen parameter of β-CaCr2O4 is determined to be 0.93(2), which is smaller than those of CaFe2O4-type CaAl2O4 and MgAl2O4.

Effect of MgO on compositions of the system CaO-Al2O3-Fe2O3. Solubility

Directory of Open Access Journals (Sweden)

Palomo, Ángel

1986-12-01

Full Text Available Five different compositions belonging to the equilibrium system CaO-Al2O3-Fe2O3 were dopep with a fixed quantity of MgO (6,5% wt. The compositions, which lie in different primary fields of crystallization and in different triangles of compatibility, were submitted to several thermal treatments. Each composition, which had previously been melted, originates in its solidification the aluminates and ferrites which are usual in the interstitial phase of clinker Portland, although they are in different microstructural arrangements. The effect of MgO on the generated microstructures has been shown. Also, the solubility of MgO on the aluminic and ferritic phases has been measured.CCinco composiciones diferentes pertenecientes al sistema de equilibrio CaO-Al2O3-Fe2O3 fueron dopadas con una cantidad fija de MgO (6,5%. Las cinco composiciones, que están situadas sobre diferentes campos primarios de cristalización y/o sobre diferentes triángulos de compatibilidad, fueron sometidas a varios tratamientos térmicos. Cada composición (previamente fundida origina en su solidificación los aluminatos y ferritos habituales en la fase intersticial del clinker portland, aunque ordenados en microestructuras diferentes. Se ha comprobado el efecto del MgO sobre las microestructuras generadas, así como su solubilidad en las fases alumínicas y ferríticas.

Wear Behavior of Cold Pressed and Sintered Al2O3/TiC/CaF2Al2O3/TiC Laminated Ceramic Composite

Institute of Scientific and Technical Information of China (English)

Xuefeng YANG; Jian CHENG; Peilong SONG; Shouren WANG; Liying YANG; Yanjun WANG; Ken MAO

2013-01-01

A novel laminated Al2O3/TiC/CaF2-Al2O3/TiC sandwich ceramic composite was fabricated through cold pressing and sintering to achieve better anti-wear performance,such as low friction coefficient and low wear rate.Al2O3/TiC/CaF2 and Al2O3/TiC composites were alternatively built layer-by-layer to obtain a sandwich structure.Solid lubricant CaF2 was added evenly into the Al2O3/TiC/CaF2 layer to reduce the friction and wear.Al2O3/TiC ceramic was also cold pressed and sintered for comparison.Friction analysis of the two ceramics was then conducted via a wear-and-tear machine.Worn surface and surface compositions were examined by scanning electron microscopy and energy dispersion spectrum,respectively.Results showed that the laminated Al2O3/TiC/CaF2-Al2O3/TiC sandwich ceramic composite has lower friction coefficient and lower wear rate than those of Al2O3/TiC ceramic alone because of the addition of CaF2 into the laminated Al2O3/TiC/CaF2-Al2O3/TiC sandwich ceramic composite.Under the friction load,the tiny CaF2 particles were scraped from the Al2O3/TiC/CaF2 layer and spread on friction pairs before falling off into micropits.This process formed a smooth,self-lubricating film,which led to better anti-wear properties.Adhesive wear is the main wear mechanism of Al2O3/TiC/CaF2 layer and abrasive wear is the main wear mechanism of Al2O3/TiC layer.

Optical properties of BaO added bioactive Na2O-CaO-P2O5 glasses

Science.gov (United States)

Edathazhe, Akhila B.; Shashikala, H. D.

2018-04-01

This paper deals with the effect of BaO addition on the optical properties of bioactive Na2O-CaO-P2O5 glasses for biomedical optics applications. The phosphate glasses with composition (26-x)Na2O-xBaO-29CaO-45P2O5 (x = 0, 5, 10, 15 mol%) have been prepared by melt-quenching technique at 1100°C. The refractive index of glasses increased with BaO content. The optical band gap and Urbach energy of synthesized glasses were derived from the optical absorption spectra by using UV-Visible spectrometer. The addition of 5 mol% of BaO increased the band gap energy of glasses due to the formation of ionic cross-links in the glass structure. The defect and interstitial bonds formation in theglasses decreased with BaO additions as indicated by reductions in the Urbach energy values. No such variations in the band gap and Urbach energy values of glasses were observed with BaO content from 5 to 15 mol%. The molar and oxide ion polarizability values were calculated from the band gap and molar volume of glasses. The increase in the calculated optical basicity and metallization criteria of glasses supported the rise in band gap energy values with BaO additions. As the melting temperature of glasses decreased from 1200 to 1100°C, the refractive index increased as supported by the measured density values. The band gap energy is not changed with melting temperature. The Urbach energy decreased with decrease in melting temperature in case of BaO-free Na2O-CaO-P2O5 glasses, whereas it increased in case of BaO added glasses due to the role of BaO as modifying oxide.

Ordering of calcium and vacancies in calcium catapleiite CaZr[Si3O9] • 2H2O

International Nuclear Information System (INIS)

Aksenov, S. M.; Portnov, A. M.; Chukanov, N. V.; Rastsvetaeva, R. K.; Nelyubina, Yu. V.; Kononkova, N. N.; Akimenko, M. I.

2016-01-01

A sample of holotypic calcium catapleiite from the Burpala alkaline massif (Northern Baikal, Russia) is studied by single crystal X-ray analysis at 120 K and IR spectroscopy. The empirical formula of calcium catapleiite is Ca 0.97 Na 0.02 Zr 1.01 Si 3 O 9 • 2H 2 O (Z = 4). The X-ray diffraction study confirms the orthorhombic unit cell with the following parameters: a = 7.406(1), b = 12.687(1), and c = 10.112(1) Å; V = 950.1(2) Å 3 ; space group Pbnn. The crystal structure is refined in the anisotropic approximation of atomic displacement parameters using 1177 reflections with I > 2σ(I) to the final R = 2.91%. The structure of calcium catapleiite under study is based on the microporous heteropolyhedral framework formed by ZrO 6 octahedra and threemembered silicon–oxygen rings [Si 3 O 9 ]. It is on the whole analogous to the structures of the samples studied earlier, but differs from them by a high degree of ordering of calcium and vacancies at extraframework positions. The distribution of calcium over Ca1 and Ca2 positions in the calcium catapleiite structure leads to the formation of zigzag chains of the …Ca1–Zr–Ca1–Zr… and …Ca2–h–Ca2–□… types. Low occupancy of the Ca2 position and its alternation with the vacancy are prerequisites for potential Ca 2+ cationic conduction.

In situ formation of CA6 platelets in Al2O3 and Al2O3/ZrO2 matrices

International Nuclear Information System (INIS)

Belmonte, M.; Sanchez-Herencia, A.J.; Moreno, R.; Miranzo, P.; Moya, J.S.; Tomsia, A.P.

1993-01-01

Al 2 O 3 and Al 2 O 3 /ZrO 2 compacts containing CaO as a dopant have been sintered under different conditions and atmospheres: air, high vacuum (> 10 -6 torr). SEM observations have been made on the polished surfaces of sintered and also of annealed samples. Only after the annealing treatment in air at temperatures ranging from 1400 to 1500 C, a massive formation of CA 6 platelets was detected in samples sintered in low oxygen partial pressure atmospheres. In order to clarify the mechanism of formation of this secondary phase at the grain boundaries, CaO has been introduced in the form of either plaster of Paris (to reproduce a possible contamination provided by the molds in slip casting) or CaCO 3 . The obtained results indicate the important role of the firing atmosphere on the precipitation of secondary phases at grain boundary. (orig.)

Thermal stability of SiO{sub 2}–B{sub 2}O{sub 3}–Al{sub 2}O{sub 3}–Na{sub 2}O–CaO glasses with high Nd{sub 2}O{sub 3} and MoO{sub 3} concentrations

Energy Technology Data Exchange (ETDEWEB)

Chouard, Nolwenn [Chimie ParisTech, PSL Research University, CNRS, Institut de Recherche de Chimie Paris (IRCP), 75005, Paris (France); Laboratoire d' Etude et Développement des Matrices de Conditionnement, CEA/DEN/DTCD/SECM, Marcoule, 30207, Bagnols-sur-Cèze (France); Caurant, Daniel, E-mail: daniel.caurant@chimie-paristech.fr [Chimie ParisTech, PSL Research University, CNRS, Institut de Recherche de Chimie Paris (IRCP), 75005, Paris (France); Majérus, Odile; Guezi-Hasni, Nadia [Chimie ParisTech, PSL Research University, CNRS, Institut de Recherche de Chimie Paris (IRCP), 75005, Paris (France); Dussossoy, Jean-Luc [Laboratoire des Matériaux et Procédés Actifs, CEA/DEN/DTCD/SECM/LMPA, Marcoule, 30207, Bagnols-sur-Cèze (France); Baddour-Hadjean, Rita; Pereira-Ramos, Jean-Pierre [Groupe Electrochimie et Spectroscopie des Matériaux (UMR CNRS 7182), Institut de Chimie et des Matériaux Paris-Est, 94320, Thiais (France)

2016-06-25

The incorporation of high MoO{sub 3} amounts in borosilicate glasses developed for the immobilization of radioactive waste may lead to the crystallization of Mo-rich phases that may induce a decrease of the long term performances of glasses. It is thus essential to understand their crystallization mechanisms and the possible effect of other abundant fission products present in the wastes (such as rare earths) in order to control or to avoid their formation during glass preparation. This paper presents a study, performed by X-ray diffraction, scanning electron microscopy, Raman and optical absorption spectroscopies of the stability as a function of the thermal treatment temperature T{sub C} of a simplified Mo-rich nuclear waste glass. The impact of the addition of a high amount of Nd{sub 2}O{sub 3} on the thermal stability of this glass is studied. For comparison, the thermal stability of a Nd{sub 2}O{sub 3}-rich glass without Mo is also presented. The crystallization range of all phases formed in these glasses (CaMoO{sub 4}, Na{sub 2}MoO{sub 4}, Ca{sub 2}Nd{sub 8}(SiO{sub 4}){sub 6}O{sub 2} (apatite)) and the evolution of their structure and microstructure as a function of T{sub C} are presented. The introduction of Nd{sub 2}O{sub 3} in the MoO{sub 3}-rich glass inhibits the crystallization of molybdates (increase of Mo solubility), as long as apatite does not form which suggests that [MoO{sub 4}]{sup 2-} entities and Nd{sup 3+} cations are close to each other in the glass structure. Besides, when a high density of apatite crystals form, for instance from glass surface, small Mo-rich partially crystallized globular heterogeneities are observed between these crystals that exacerbate the nucleation of new apatite crystals (nucleating effect). - Highlights: • Effect of MoO{sub 3} and Nd{sub 2}O{sub 3} separately or together on glass crystallization is studied. • The crystallization range of molybdates and apatite (Ca{sub 2}Nd{sub 8}(SiO{sub 4}){sub 6}O{sub 2}) was

Zero photoelastic and water durable ZnO-SnO-P2O5-B2O3 glasses

Science.gov (United States)

Saitoh, Akira; Nakata, Kohei; Tricot, Grégory; Chen, Yuanyuan; Yamamoto, Naoki; Takebe, Hiromichi

2015-04-01

We report properties of zero birefringent xZnO-(67-x)SnO-(33-y)P2O5-y B2O3 glasses, within 18.5 ≤ x ≤ 22 and y = 0, 3, and 10 mol. %. These compositions of boro-phosphate glasses provide both zero photoelastic constant (PEC) and improved water durability. x = 19 and y = 3 compositions show minimum PEC of -0.002 × 10-12 Pa-1, which can contribute to candidate material for fiber current sensor devise without lead. The structures of zero photoelastic glasses were investigated by Raman scattering and nuclear magnetic resonance spectroscopies. Compositions of zero PEC glasses are explained by the empirical model proposed by Zwanziger et al. [Chem. Mater. 19, 286-290 (2007)].

Observation of microstructure of hydrated Ca3SiO5

International Nuclear Information System (INIS)

Mori, Kazuhiro; Sato, Takashi; Fukunaga, Toshiharu; Oishi, Koji; Kimura, Katsuhiko; Iwase, Kenji; Sugiyama, Masaaki; Itoh, Keiji; Shikanai, Fumihito; Wuernisha, Tuerxun; Yonemura, Masao; Sulistyanintyas, Dyah; Tsukushi, Itaru; Takata, Shinich; Otomo, Toshiya; Kamiyma, Takashi; Kawai, Masayoshi

2006-01-01

Quasi-elastic neutron scattering experiments were carried out to evaluate the hydration rate of tricalcium silicate (Ca 3 SiO 5 ). Furthermore, in the early hydration period, a variation in surface roughness of Ca 3 SiO 5 was observed in nano-scale by the small-angle neutron scattering. From these results, it was found that the hydration rate of Ca 3 SiO 5 is suppressed when the surface of Ca 3 SiO 5 becomes rough through the creation of hydration products C-S-H gel and Ca(OH) 2 , and this roughness is associated with changes in the Ca 3 SiO 5 hydration rate

EXAFS and EPR study of La0.6Sr0.2Ca0.2MnO3 and La0.6Sr0.2Ba0.2MnO3

International Nuclear Information System (INIS)

Yang, D.-K.Dong-Seok; Ulyanov, A.N.; Phan, Manh-Huong; Kim, Ikgyun; Ahn, Byong-Keun; Rhee, Jang Roh; Kim, Jung Sun; Nguyen, Chau; Yu, Seong-Cho

2003-01-01

Extended X-ray absorption fine structure (EXAFS) analysis and electron-paramagnetic resonance (EPR) have been used to examine the local structure and the internal dynamics of La 0.6 Sr 0.2 Ca 0.2 MnO 3 and La 0.6 Sr 0.2 Ba 0.2 MnO 3 lanthanum manganites. The Mn-O bond distance (∼1.94 Angst for both samples) and the Debye-Waller factors (0.36x10 -2 and 0.41x10 -2 Angst 2 for La 0.6 Sr 0.2 Ca 0.2 MnO 3 and for La 0.6 Sr 0.2 Ba 0.2 MnO 3 , respectively) were obtained from the EXAFS analysis. The dependence of the EPR line width on dopant kind (Ca or Ba) showed a decrease of the spin-lattice interaction with an increase of the Curie temperature. For both compositions, the EPR line intensity followed the exponential law I(T)=I 0 exp(E a /k B T), deduced on the basis of the adiabatic polaron hopping model

Structural and magnetic properties of SiO{sub 2}-CaO-Na{sub 2}O-P{sub 2}O{sub 5} containing BaO-Fe{sub 2}O{sub 3} glass-ceramics

Energy Technology Data Exchange (ETDEWEB)

Leenakul, W.; Kantha, P.; Pisitpipathsin, N. [Department of Physics and Materials Science, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Rujijanagul, G.; Eitssayeam, S. [Department of Physics and Materials Science, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Materials Science Research Center, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Pengpat, K., E-mail: kamonpan.p@cmu.ac.th [Department of Physics and Materials Science, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Materials Science Research Center, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand)

2013-01-15

The incorporation method was employed to produce bioactive glass-ceramics from the BaFe{sub 12}O{sub 19}-SiO{sub 2}-CaO-Na{sub 2}O-P{sub 2}O{sub 5} glass system. The ferrimagnetic BaFe{sub 12}O{sub 19} was first prepared using a simple mixed oxide method, where the oxide precursors of 45S5 bioglass were initially mixed and then melted to form glass. The devitrification of Na{sub 3}Ca{sub 6}(PO{sub 4}){sub 5} and Fe{sub 3}O{sub 4} was observed in all of the quenched glass samples. The glass samples were then subjected to a heat treatment schedule for further crystallization. It was found that the small traces of BaFe{sub 12}O{sub 19} phases started to crystallize in high BF content samples of 20 and 40 wt%. These samples also exhibited good magnetic properties comparable to that of other magnetic glass-ceramics. The bioactivity of the BF glass-ceramics improved with increasing BF content as was evident by the formation of bone-like apatite layers on the surface of all of the glass-ceramics after soaking in SBF for 14 days. The results support the use of these bioactive glass-ceramics for hyperthermia treatment within the human body. - Highlights: Black-Right-Pointing-Pointer BF addition improves the magnetic property and bioactivity of 45S5 bioglasses. Black-Right-Pointing-Pointer Bioglass-ceramics exhibited soft magnetic properties with Mr=14.850 emu/g. Black-Right-Pointing-Pointer Magnetic property can be enhanced by crystallization of BF in 45S5 bioglasses.

Thermodynamic investigation of the CaO-Al2O3-CaCO3-H2O closed system at 25 C and the influence of Na2O

International Nuclear Information System (INIS)

Damidot, D.; Stronach, S.; Kindness, A.; Atkins, M.; Glasser, F.P.

1994-01-01

The solubilities of calcium hemicarboaluminate, calcium monocarboaluminate and calcium tricarboaluminate have been determined and the equilibrium phase diagram for the CaO-Al 2 O 3 -CaCO 3 -H 2 O closed system at 25 C has been calculated. Six isothermally invariant points have been located involving six stable hydrates: CH, C 3 AH 6 , AH 3 , calcium hemicarboaluminate, calcium monocarboaluminate and calcite. Calcium tricarboaluminate, the carbonate analogue of ettringite, does not appear to be stable at 25 C. This study was part of a larger study on radioactive waste solidification

In situ formation of CA6 platelets in Al2O3 and Al2O3/ZrO2 matrices

OpenAIRE

Belmonte , M.; SÁnchez-Herencia , A.; Moreno , R.; Miranzo , P.; Moya , J.; Tomsia , A.

1993-01-01

Al2O3 and Al2O3/ZrO2 compacts containing CaO as a dopant have been sintered under different conditions and atmospheres: air, high vacuum (> 10-6torr). SEM observations have been made on the polished surfaces of sintered and also of annealed samples. Only after the annealing treatment in air at temperatures ranging from 1400° to 1 500°C, a massive formation of CA6 platelets was detected in samples sintered in low oxygen partial pressure atmospheres.ln order to clarify the mechanism of formatio...

A new nonlinear optical silicate carbonate K2Ca[Si2O5](CO3) with a hybrid structure of kalsilite and soda-like layered fragments

Science.gov (United States)

Belokoneva, Elena L.; Stefanovich, Sergey Yu.; Volkov, Anatoly S.; Dimitrova, Olga V.

2016-10-01

Single crystals of a new silicate carbonate, K2Ca[Si2O5](CO3), have been synthesized in a multi-components hydrothermal solution with a pH value close to neutral and a high concentration of a carbonate mineralizer. The new compound has an axial structure (s.g. P6322) with unit cell parameters a = 5.04789 (15), c = 17.8668 (6) Å. Pseudosymmetry of the structure corresponds to s.g. P63/mmc which is broken only by one oxygen position. The structure consists of two layered fragments: one of the type of the mineral kalsilite (KAlSiO4) and the other of the high-temperature soda-like α-Na2CO3, Ca substituting for Na. The electro-neutral layer K2[Si2O5] (denoted K) as well as the layer Ca(CO3) (denoted S) may separately correspond to individual structures. In K2Ca[Si2O5](CO3) the S-K layers are connected together via Ca-O interactions between Ca atoms from the carbonate layer and apical O atoms from the silicate one, and also via K-O interlayer interactions. A hypothetical acentric structure, sp.gr. P-62c, is predicted on the basis of the order-disorder theory. It presents another symmetrical option for the arrangement of K-layers relative to S-layers. The K,Ca-silicate-carbonate powder produces a moderate SHG signal that is two times larger that of the α-quartz powder standard and close to other silicates with acentric structures and low electronic polarizability.

Crystal structure and spectroscopic behavior of synthetic novgorodovaite Ca2(C2O4)Cl2·2H2O and its twinned triclinic heptahydrate analog

Science.gov (United States)

Piro, Oscar E.; Echeverría, Gustavo A.; González-Baró, Ana C.; Baran, Enrique J.

2018-02-01

Synthetic novgorodovaite analog Ca2(C2O4)Cl2·2H2O is identical to its natural counterpart. It crystallizes in the monoclinic I2/ m space group with a = 6.9352(3), b = 7.3800(4), c = 7.4426(3) Å, β = 94.303(4)°, V = 379.85(3) Å3 and Z = 2. The heptahydrate analog, Ca2(C2O4)Cl2·7H2O, crystallizes as triclinic twins in the P \\overline{1} space group with a = 7.3928(8), b = 8.9925(4), c = 10.484(2) Å, α = 84.070(7), β = 70.95(1), γ = 88.545(7)°, V = 655.3(1) Å3 and Z = 2. The crystal packing of both calcium oxalate-chloride double salts favors the directional bonding of oxalate, C2O4 2-, ligands to calcium ions as do other related calcium oxalate minerals. The π-bonding between C and O atoms of the C2O4 2- oxalate group leaves sp 2-hydridised orbitals of the oxygen atoms available for bonding to Ca. Thus, the Ca-O bonds in both calcium oxalate-chloride double salts are directed so as to lie in the plane of the oxalate group. This behavior is reinforced by the short O···O distances between the oxygens attached to a given carbon atom, which favors them bonding to a shared Ca atom in bidentate fashion. Strong bonding in the plane of the oxalate anion and wide spacing perpendicular to that plane due to repulsion between oxalate π-electron clouds gives rise to a polymerized structural units which are common to both hydrates, explaining the nearly equal cell constants 7.4 Å which are defined by the periodicity of Ca-oxalate chains in the framework (monoclinic b ≈ triclinic a). When compared with novgorodovaite, the higher water content of Ca2(C2O4)Cl2·7H2O leads to some major differences in their structures and ensuing physical properties. While novgorodovaite has a three-dimensional framework structure, in the higher hydrate, the highly polar water molecules displace chloride ions from the calcium coordination sphere and surround them through OwH···Cl hydrogen bonds. As a result, polymerization in Ca2(C2O4)Cl2·7H2O solid is limited to the formation

Impact of calcium ion on cytotoxic effect of the boroxine derivative, K2[B3O3F4OH].

Science.gov (United States)

Ivankovic, Sinisa; Stojkovic, Ranko; Maksimovic, Milka; Galic, Borivoj; Milos, Mladen

2016-01-01

The effect of Ca 2+ ions on the cytotoxic ability of boron heterocyclic compound dipotassium-trioxohydroxytetrafluorotriborate (K 2 [B 3 O 3 F 4 OH]), on in vitro tumor cells (mammary adenocarcinoma 4T1, melanoma B16F10 and squamous cell carcinoma SCCVII) and non-tumoral fibroblast cells (mouse dermal L929 and hamster lung V79) was examined. At small concentrations of Ca 2+ ions (0.42 mM), K 2 [B 3 O 3 F 4 OH] (3.85 mM) has a very strong cytotoxic effect on all cancer cells tested (89.1, 85.6 and 84.6%) and significantly less effect on normal cells (19.5 and 24.2%), respectively. Applying larger concentrations of Ca 2+ ions (9.42-72.42 mM), at the same concentration of K 2 [B 3 O 3 F 4 OH], no significant cytotoxic effect was detected on cancer cells and normal cells investigated. The selective ability of K 2 [B 3 O 3 F 4 OH], in the medium with a low concentration of Ca 2+ ions has a strong cytotoxic effect on cancer cells and very weak effect in normal cells, opens up the possibility of its application in antitumor therapy.

Interrelation between domain structures and polarization switching in hybrid improper ferroelectric Ca3(Mn,Ti)2O7

Science.gov (United States)

Gao, Bin; Huang, Fei-Ting; Wang, Yazhong; Kim, Jae-Wook; Wang, Lihai; Lim, Seong-Joon; Cheong, Sang-Wook

2017-05-01

Ca3Mn2O7 and Ca3Ti2O7 have been proposed as the prototypical hybrid improper ferroelectrics (HIFs), and a significant magnetoelectric (ME) coupling in magnetic Ca3Mn2O7 is, in fact, reported theoretically and experimentally. Although the switchability of polarization is confirmed in Ca3Ti2O7 and other non-magnetic HIFs, there is no report of switchable polarization in the isostructural Ca3Mn2O7. We constructed the phase diagram of Ca3Mn2-xTixO7 through our systematic study of a series of single crystalline Ca3Mn2-xTixO7 (x = 0, 0.1, 1, 1.5, and 2). Using transmission electron microscopy, we have unveiled the unique domain structure of Ca3Mn2O7: the high-density 90° stacking of a- and b-domains along the c-axis due to the phase transition through an intermediate Acca phase and the in-plane irregular wavy ferroelastic twin domains. The interrelation between domain structures and physical properties is unprecedented: the stacking along the c-axis prevents the switching of polarization and causes the irregular in-plane ferroelastic domain pattern. In addition, we have determined the magnetic phase diagram and found complex magnetism of Ca3Mn2O7 with isotropic canted moments. These results lead to negligible observable ME coupling in Ca3Mn2O7 and guide us to explore multiferroics with large ME coupling.

Thin film YBa{sub 2}Cu{sub 3}O{sub 7} junctions with La{sub 2/3}Ca{sub 1/3}MnO{sub 3} barrier

Energy Technology Data Exchange (ETDEWEB)

Hepting, Matthias; Stoehr, Andreas; Werner, Robert; Kleiner, Reinhold; Koelle, Dieter [Physikalisches Institut - Experimentalphysik II and Center for Collective Quantum Phenomena in LISAplus, Universitaet Tuebingen, Auf der Morgenstelle 14, 72076 Tuebingen (Germany)

2012-07-01

We report on the fabrication and electric transport properties of thin film YBa{sub 2}Cu{sub 3}O{sub 7} (YBCO) junctions with La{sub 2/3}Ca{sub 1/3}MnO{sub 3} (LCMO) barrier. Heteroepitaxial YBCO/LCMO/YBCO multilayers were grown in-situ by pulsed laser deposition and subsequently patterned by photolithography and Ar ion milling to form rectangular junctions with typical area 5 {mu}m x 30 {mu}m. A self-alignment process was used for electrical contact via an Au wiring layer to the upper YBCO electrode, similarly as described. Samples were characterized at temperature T=4.2 K either in magnetically shielded environment or in in-plane magnetic fields B up to the Tesla range. We present and discuss current-voltage-characteristics and measurements of critical current vs B.

In vitro and in vivo evaluation of zinc-modified ca-si-based ceramic coating for bone implants.

Science.gov (United States)

Yu, Jiangming; Li, Kai; Zheng, Xuebin; He, Dannong; Ye, Xiaojian; Wang, Meiyan

2013-01-01

The host response to calcium silicate ceramic coatings is not always favorable because of their high dissolution rates, leading to high pH within the surrounding physiological environment. Recently, a zinc-incorporated calcium silicate-based ceramic Ca2ZnSi2O7 coating, developed on a Ti-6Al-4V substrate using plasma-spray technology, was found to exhibit improved chemical stability and biocompatibility. This study aimed to investigate and compare the in vitro response of osteoblastic MC3T3-E1 cells cultured on Ca2ZnSi2O7 coating, CaSiO3 coating, and uncoated Ti-6Al-4V titanium control at cellular and molecular level. Our results showed Ca2ZnSi2O7 coating enhanced MC3T3-E1 cell attachment, proliferation, and differentiation compared to CaSiO3 coating and control. In addition, Ca2ZnSi2O7 coating increased mRNA levels of osteoblast-related genes (alkaline phosphatase, procollagen α1(I), osteocalcin), insulin-like growth factor-I (IGF-I), and transforming growth factor-β1 (TGF-β1). The in vivo osteoconductive properties of Ca2ZnSi2O7 coating, compared to CaSiO3 coating and control, was investigated using a rabbit femur defect model. Histological and histomorphometrical analysis demonstrated new bone formation in direct contact with the Ca2ZnSi2O7 coating surface in absence of fibrous tissue and higher bone-implant contact rate (BIC) in the Ca2ZnSi2O7 coating group, indicating better biocompatibility and faster osseointegration than CaSiO3 coated and control implants. These results indicate Ca2ZnSi2O7 coated implants have applications in bone tissue regeneration, since they are biocompatible and able to osseointegrate with host bone.

In vitro and in vivo evaluation of zinc-modified ca-si-based ceramic coating for bone implants.

Directory of Open Access Journals (Sweden)

Jiangming Yu

Full Text Available The host response to calcium silicate ceramic coatings is not always favorable because of their high dissolution rates, leading to high pH within the surrounding physiological environment. Recently, a zinc-incorporated calcium silicate-based ceramic Ca2ZnSi2O7 coating, developed on a Ti-6Al-4V substrate using plasma-spray technology, was found to exhibit improved chemical stability and biocompatibility. This study aimed to investigate and compare the in vitro response of osteoblastic MC3T3-E1 cells cultured on Ca2ZnSi2O7 coating, CaSiO3 coating, and uncoated Ti-6Al-4V titanium control at cellular and molecular level. Our results showed Ca2ZnSi2O7 coating enhanced MC3T3-E1 cell attachment, proliferation, and differentiation compared to CaSiO3 coating and control. In addition, Ca2ZnSi2O7 coating increased mRNA levels of osteoblast-related genes (alkaline phosphatase, procollagen α1(I, osteocalcin, insulin-like growth factor-I (IGF-I, and transforming growth factor-β1 (TGF-β1. The in vivo osteoconductive properties of Ca2ZnSi2O7 coating, compared to CaSiO3 coating and control, was investigated using a rabbit femur defect model. Histological and histomorphometrical analysis demonstrated new bone formation in direct contact with the Ca2ZnSi2O7 coating surface in absence of fibrous tissue and higher bone-implant contact rate (BIC in the Ca2ZnSi2O7 coating group, indicating better biocompatibility and faster osseointegration than CaSiO3 coated and control implants. These results indicate Ca2ZnSi2O7 coated implants have applications in bone tissue regeneration, since they are biocompatible and able to osseointegrate with host bone.

Enhanced photoluminescence and thermal stability of divalent ions (Zn2+, Mg2+) assisted CaTiO3:Eu3+ perovskite phosphors for lighting applications

Science.gov (United States)

Singh, Dhananjay Kumar; Manam, J.

2018-03-01

Current study proposes the improved red emission of Zn2+ and Mg2+ ions incorporated CaTiO3:Eu3+ phosphors synthesized via the well-known solid-state reaction method. Under the 397 nm UV excitation, the Zn2+- and Mg2+-incorporated CaTiO3:0.15Eu3+ phosphor having orthorhombic structure with space group Pbnm exhibited an intense red emission at 619 nm. This can be credited to the hypersensitive 5D0 → 7F2 transition of Eu3+ ions, which is also indicative of the fact that the Eu3+ ions populated the non-inversion symmetry sites in the CaTiO3 lattices. The optimized composition CaTiO3:0.15Eu3+, 0.20Zn2+ and CaTiO3:0.15Eu3+, 0.10Mg2+ phosphors, pronounces in a magnificent enhancement of PL intensity by 5.5 and 2.5 times, respectively, as compared to CaTiO3:0.15 Eu3+ phosphor. From the temperature-dependent emission spectra, ΔEa were enunciated to be 0.101 and 0.086 eV for CaTiO3:0.15Eu3+, 0.20Zn2+ and CaTiO3:0.15Eu3+, 0.10Mg2+ phosphors, respectively, for thermal quenching. In addition, it can be better understood as related to the adequate thermal stability of 60% even at 450 and 420 K, respectively. Furthermore, the Judd-Ofelt theory was used to study the radiative intensity parameters of Eu3+ ions in the CaTiO3 lattices. The experimental results incited the bright prospects of synthesized ceramics as a promising candidate for lighting applications.

Promotion Effect of CaO Modification on Mesoporous Al2O3-Supported Ni Catalysts for CO2 Methanation

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Wen Yang

2016-01-01

Full Text Available The catalysts Ni/Al2O3 and CaO modified Ni/Al2O3 were prepared by impregnation method and applied for methanation of CO2. The catalysts were characterized by N2 adsorption/desorption, temperature-programmed reduction of H2 (H2-TPR, X-ray diffraction (XRD, and temperature-programmed desorption of CO2 and H2 (CO2-TPD and H2-TPD techniques, respectively. TPR and XRD results indicated that CaO can effectively restrain the growth of NiO nanoparticles, improve the dispersion of NiO, and weaken the interaction between NiO and Al2O3. CO2-TPD and H2-TPD results suggested that CaO can change the environment surrounding of CO2 and H2 adsorption and thus the reactants on the Ni atoms can be activated more easily. The modified Ni/Al2O3 showed better catalytic activity than pure Ni/Al2O3. Ni/CaO-Al2O3 showed high CO2 conversion especially at low temperatures compared to Ni/Al2O3, and the selectivity to CH4 was very close to 1. The high CO2 conversion over Ni/CaO-Al2O3 was mainly caused by the surface coverage by CO2-derived species on CaO-Al2O3 surface.

Melts in the Deep Earth: Calculating the Densities of CaO-FeO-MgO-Al2O3-SiO2 Liquids

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Thomas, C.; Guo, X.; Agee, C. B.; Asimow, P. D.; Lange, R. A.

2012-12-01

We present new equation of state (EOS) measurements for hedenbergite (Hd, CaFeSi2O6) and forsterite (Fo, Mg2SiO4) liquids. These liquid EOS add to the basis set in the CaO-FeO-MgO-Al2O3-SiO2 (CMASF) oxide space at elevated temperatures and pressures; other liquids include: enstatite (En, MgSiO3), anorthite (An, CaAl2Si2O8), diopside (Di, CaMgSi2O6), and fayalite (Fa, Fe2SiO4). The Hd EOS measurement was a multi-technique collaboration using 1-atm double-bob Archimedean, ultrasonic, sink/float, and shock wave techniques. Un-weighted linear fitting of the shock data in shock velocity (US)-particle velocity (up) space defines a pre-heated (1400 °C) Hugoniot US = 2.628(0.024) + 1.54(0.01)up km/s. The slope corresponds to a K' of 5.16(0.04), consistent with piston-cylinder and multi-anvil sink/float experiments. The intercept is fixed at the ultrasonic sound speed (Co) since the unconstrained intercept is within the stated error. This behavior demonstrates consistency across methods and that the liquid is relaxed during shock compression. Shock compression of pre-heated (2000°C) single crystal Fo gives an un-weighted linear Hugoniot of US = 2.674(0.188) + 1.64(0.06)up km/s. The unconstrained Co falls below estimates based on extrapolation in both temperature and composition from two published partial molar sound speed models, 3.195m/s [1] and 3.126 m/s [2]. The shock-derived Co indicates that dC/dT is negative for Fo liquid, contrary to the positive [1] and zero [2] temperature dependences derived over relatively narrow temperature intervals. CMASF liquid isentropes were calculated using five end-members (En, Fo, Fa, An, Di). For modeling crystallization of a fictive magma ocean, we examined two liquids: peridotite [3] (P=.33En+.56Fo+.07Fa+.03An+.007Di) and simplified chondrite [4] (Ch=.62En+.24Fo+.08Fa+.04An+.02Di). Each end-member is defined by a 3rd or 4th order Birch-Murnaghan isentrope, Mie-Grüneisen thermal pressure and a constant heat capacity. The volumes are

Luminescence in Eu2+ and Ce3+ doped SrCaP2O7 phosphors

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K.N. Shinde

Full Text Available Eu2+ and Ce3+ doped SrCaP2O7 has been achieved by modified solid state diffusion in reducing atmosphere. The prepared phosphor powders have been identified by their characteristic X-ray diffraction patterns. The mixed phases of α-Sr2P2O7 type with orthorhombic and α-Ca2P2O7 type with monoclinic form were investigated. Its excitation wavelength ranging from 250 to 430 nm fits well with the characteristic emission of UV light-emitting diode (LED. The excitation and emission spectra indicate that these phosphors can be effectively excited by the near-UV light, and emits blue (visible range due to 4f7 → 4f65d1 transition of Eu2+ particularly, SrCaP2O7: Eu2+ whereas, photoluminescence excitation spectrum measurements of Ce3+ activated SrCaP2O7 shows that the phosphor can be efficiently excited by UV–Vis light from 280 to 310 nm to realize emission in the near visible range due to the 5d–4f transition of Ce3+ ions which is applicable for scintillation purpose. The impacts of doping of divalent europium and trivalent cerium on photoluminescence properties on SrCaP2O7 pyrophosphate phosphors were investigated and I propose a feasible interpretation. Keywords: Phosphor, Luminescence, XRD, LED, FTIR

Crystal and magnetic study of the disordered perovskites Ca(Mn{sub 0.5}Sb{sub 0.5})O{sub 3} and Ca(Fe{sub 0.5}Sb{sub 0.5})O{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Retuerto, M., E-mail: mretuerto@icmm.csic.es [Instituto de Ciencia de Materiales de Madrid, CSIC, Energia, Medio Ambiente y Tecnologias Sostenibles, Sor Juana Ines de la Cruz 3, Cantoblanco, E-28049 Madrid (Spain); Martinez-Lope, M.J.; Garcia-Hernandez, M. [Instituto de Ciencia de Materiales de Madrid, CSIC, Energia, Medio Ambiente y Tecnologias Sostenibles, Sor Juana Ines de la Cruz 3, Cantoblanco, E-28049 Madrid (Spain); Munoz, A. [Departamento de Fisica Aplicada, EPS, Universidad Carlos III, Avda. Universidad 30, E-28911 Leganes-Madrid (Spain); Fernandez-Diaz, M.T. [Institut Max Von Laue Paul Langevin, F-38042 Grenoble (France); Alonso, J.A. [Instituto de Ciencia de Materiales de Madrid, CSIC, Energia, Medio Ambiente y Tecnologias Sostenibles, Sor Juana Ines de la Cruz 3, Cantoblanco, E-28049 Madrid (Spain)

2010-10-15

We have investigated the double perovskites Ca{sub 2}MSbO{sub 6} (M = Mn, Fe) that have been prepared by solid-state reaction (M = Fe) and wet chemistry procedures (M = Mn). The crystal and magnetic structures have been studied from X-ray (XRD) and neutron powder diffraction (NPD) data. Rietveld refinements show that the crystal structures are orthorhombic (space group Pbnm) with complete disorder of M and Sb cations, so the formula should be rewritten as Ca(M{sub 0.5}Sb{sub 0.5})O{sub 3}. Due to this disorder no evidences of Jahn-Teller distortion can be observed in the MnO{sub 6} octahedra of Ca(Mn{sub 0.5}Sb{sub 0.5})O{sub 3}, in contrast with the ordered double perovskite Sr{sub 2}MnSbO{sub 6}. Ca(Fe{sub 0.5}Sb{sub 0.5})O{sub 3} behaves as an antiferromagnet with an ordered magnetic moment for Fe{sup 3+} of 1.53(4){mu}{sub B} and a propagation vector k = 0, as investigated by low-temperature NPD. The antiferromagnetic ordering is a result of the high degree of Fe/Sb anti-site disorder of the sample, which originates the spontaneous formation of Fe-rich islands, characterized by the presence of strong Fe-O-Fe antiferromagnetic couplings with enough long-range coherence to produce a magnetic contribution perceptible by NPD. By contrast, the magnetic structure of Ca(Mn{sub 0.5}Sb{sub 0.5})O{sub 3} cannot be observed by low-temperature NPD because the magnitude of the ordered magnetic moments is below the detection threshold for neutrons.

Natural CaO-TiO2-SiO2 based ceramics

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Jelena Pantić

2011-06-01

Full Text Available Lešnica river deposits consist of a large number of minerals of different grain sizes including sphene. Since it is very difficult to obtain pure monophase titanite by different synthetic routes (sol-gel, coprecipitation, combustion, spray pyrolysis and hydrothermal method, the aim of this work was to study the structure of the sphene from the Lešnica river deposits and possibility of using it as a natural precursor for CaO-TiO2-SiO2 based ceramics. The sphene from Lešnica was analyzed by different methods: tristimulus colorimetry, infrared spectroscopy, electron microprobe and X-ray single crystal diffraction. It was confirmed that Al, Fe, Mn and P are present in the sphene structure and proposed that corresponding structural formula could be: (Ca2+1.008 Mn2+0.0021.010(Ti4+0.901 Fe3+0.033 Al3+0.060 P5+0.0010.995 Si4+1.024 O2-5.

Sintering densification of CaO–UO{sub 2}–Gd{sub 2}O{sub 3} nuclear fuel pellets

Energy Technology Data Exchange (ETDEWEB)

Wang, Yun [Fundamental Science on Radioactive Geology and Exploration Technology Laboratory, East China Institute of Technology, Nanchang, 330013, Jiangxi (China); Sun, Huidong [China Nucle Power Engineering Co., Ltd (China); Wang, Hui, E-mail: yinchanggeng5525@163.com [National Key Laboratory for Nuclear Fuel and Materials, Nuclear Power Institute of China, Chengdu, 610041 (China); Pan, Xiaoqiang; Li, Tongye; Liu, Jinhong; Zhang, Yong; Wang, Xinjie [National Key Laboratory for Nuclear Fuel and Materials, Nuclear Power Institute of China, Chengdu, 610041 (China)

2015-10-15

CaO-doped UO{sub 2}-10 wt% Gd{sub 2}O{sub 3} burnable poison fuel was prepared by co-precipitation reaction method. It was found that 0.3 wt% CaO-doping significantly improved the sintered density, grain sizes and crushing strength of UO{sub 2}–Gd{sub 2}O{sub 3} fuel pellets at the sintering temperature of 1650 °C in the sintering atmosphere of hydrogen for 3.5 h. In addition, homogeneous solid solution without precipitation of free phases of CaO and Gd{sub 2}O{sub 3} was successfully achieved. CaO doping in UO{sub 2}–Gd{sub 2}O{sub 3} fuel pellet system accelerated the thermally activated material transport, so the onset temperature of densification as well as the temperature of the maximum densification rate shifted to a lower temperature region. - Highlights: • A small amount of 0.3% doped CaO{sub 2} can significantly improve the sintered density. • Homogeneous solid solution forms without precipitation of free phases. • The pellet has good density, high strength and increasing grain sizes with homogeneity. • The pellet accelerates a thermally activated material transport.

Synthesis of Nanoscale CaO-Al2O3-SiO2-H2O and Na2O-Al2O3-SiO2-H2O Using the Hydrothermal Method and Their Characterization

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Jingbin Yang

2017-06-01

Full Text Available C-A-S-H (CaO-Al2O3-SiO2-H2O and N-A-S-H (Na2O-Al2O3-SiO2-H2O have a wide range of chemical compositions and structures and are difficult to separate from alkali-activated materials. Therefore, it is difficult to analyze their microscopic properties directly. This paper reports research on the synthesis of C-A-S-H and N-A-S-H particles with an average particle size smaller than 300 nm by applying the hydrothermal method. The composition and microstructure of the products with different CaO(Na2O/SiO2 ratios and curing conditions were characterized using XRD, the RIR method, FTIR, SEM, TEM, and laser particle size analysis. The results showed that the C-A-S-H system products with a low CaO/SiO2 ratio were mainly amorphous C-A-S-H gels. With an increase in the CaO/SiO2 ratio, an excess of Ca(OH2 was observed at room temperature, while in a high-temperature reaction system, katoite, C4AcH11, and other crystallized products were observed. The katoite content was related to the curing temperature and the content of Ca(OH2 and it tended to form at a high-temperature and high-calcium environment, and an increase in the temperature renders the C-A-S-H gels more compact. The main products of the N-A-S-H system at room temperature were amorphous N-A-S-H gels and a small amount of sodalite. An increase in the curing temperature promoted the formation of the crystalline products faujasite and zeolite-P. The crystallization products consisted of only zeolite-P in the high-temperature N-A-S-H system and its content were stable above 70%. An increase in the Na2O/SiO2 ratio resulted in more non-bridging oxygen and the TO4 was more isolated in the N-A-S-H structure. The composition and microstructure of the C-A-S-H and N-A-S-H system products synthesized by the hydrothermal method were closely related to the ratio of the raw materials and the curing conditions. The results of this study increase our understanding of the hydration products of alkali

Scintillation characteristics of LiB3O5 and β-BaB2O4 single crystals

International Nuclear Information System (INIS)

Nazarenko, B.P.; Pedash, V.Yu.; Shekhovtsov, A.N.; Tarasov, V.A.; Zelenskaya, O.V.

2006-01-01

LiB 3 O 5 and β-BaB 2 O 4 single crystals have been grown by the top seeded solution growth technique. The optical characteristics and scintillation parameters of the grown single crystals have been tested and discussed

In vitro evaluation of bioactivity of SiO2-CaO-P2O5-Na2O-CaF2-ZnO glass-ceramics

Science.gov (United States)

Riaz, Madeeha; Zia, Rehana; Saleemi, Farhat; Bashir, Farooq; Hossain, Tousif; Kayani, Zohra

2014-09-01

Zinc is an essential trace element that stimulates bone formation but it is also known as an inhibitor of apatite crystal growth. In this work addition of ZnO to SiO2-CaO-P2O5-Na2O-CaF2 glass-ceramic system was made by conventional melt-quenching technique. DSC curves showed that the addition of ZnO moved the endothermic and exothermic peaks to lower temperatures. X-ray diffraction analysis did not reveal any additional phase caused by ZnO addition and showed the presence of wollastonite and hydroxyapatite crystalline phases only in all the glass-ceramic samples. As bio-implant apatite forming ability is an essential condition, the surface reactivity of the prepared glass-ceramic specimens was studied in vitro in Kokubo's simulated body fluid (SBF) [1] with ion concentration nearly equal to human blood plasma for 30 days at 37 °C under static condition. Atomic absorption spectroscopy (AAS) was used to study the changes in element concentrations in soaking solutions and XRD, FT-IR and SEM were used to elucidate surface properties of prepared glass-ceramics, which confirmed the formation of HCAp on the surface of all glass-ceramics. It was found that the addition of ZnO had a positive effect on bioactivity of glass-ceramics and made it a potential candidate for restoration of damaged bones.

(Solid + liquid) phase equilibria of (Ca(H2PO2)2 + CaCl2 + H2O) and (Ca(H2PO2)2 + NaH2PO2 + H2O) ternary systems at T = 323.15 K

International Nuclear Information System (INIS)

Cao, Hong-yu; Zhou, Huan; Bai, Xiao-qin; Ma, Ruo-xin; Tan, Li-na; Wang, Jun-min

2016-01-01

Graphical abstract: Solubility diagram of the (Ca(H 2 PO 2 ) 2 + NaH 2 PO 2 + H 2 O) system at T = (323.15 and 298.15) K. - Highlights: • Phase diagrams of Ca 2+ -H 2 PO 2 − -Cl − -H 2 O, Ca 2+ -Na + -H 2 PO 2 − -H 2 O at 323.15 K were obtained. • Incompatible double salt of NaCa(H 2 PO 2 ) 3 in Ca 2+ -Na + -H 2 PO 2 − -H 2 O system was determined. • Density diagram of the corresponding liquid were simultaneously measured. - Abstract: Calcium hypophosphite has been widely used as an anti-corrosive agent, flame retardant, fertilizer, assistant for Ni electroless plating, and animal nutritional supplement. High purity calcium hypophosphite can be synthesized via the replacement reaction of sodium hypophosphite and calcium chloride. In this work, the (solid + liquid) phase equilibria of (Ca(H 2 PO 2 ) 2 + CaCl 2 + H 2 O) and (Ca(H 2 PO 2 ) 2 + NaH 2 PO 2 + H 2 O) ternary systems at T = 323.15 K were studied experimentally via the classical isothermal solubility equilibrium method, and the phase diagrams for these two systems were obtained. It was found that two solid salts of CaCl 2 ·2H 2 O and Ca(H 2 PO 2 ) 2 exist in the (Ca(H 2 PO 2 ) 2 + CaCl 2 + H 2 O) system, and three salts of Ca(H 2 PO 2 ) 2 , NaH 2 PO 2 ·H 2 O and one incompatible double salt, NaCa(H 2 PO 2 ) 3 occur in the (Ca(H 2 PO 2 ) 2 + NaH 2 PO 2 + H 2 O) system.

Compositional and microstructural design of highly bioactive P2O5-Na2O-CaO-SiO2 glass-ceramics.

Science.gov (United States)

Peitl, Oscar; Zanotto, Edgar D; Serbena, Francisco C; Hench, Larry L

2012-01-01

Bioactive glasses having chemical compositions between 1Na(2)O-2CaO-3SiO(2) (1N2C3S) and 1.5Na(2)O-1.5CaO-3SiO(2) (1N1C2S) containing 0, 4 and 6 wt.% P(2)O(5) were crystallized through two stage thermal treatments. By carefully controlling these treatments we separately studied the effects on the mechanical properties of two important microstructural features not studied before, crystallized volume fraction and crystal size. Fracture strength, elastic modulus and indentation fracture toughness were measured as a function of crystallized volume fraction for a constant crystal size. Glass-ceramics with a crystalline volume fraction between 34% and 60% exhibited a three-fold improvement in fracture strength and an increase of 40% in indentation fracture toughness compared with the parent glass. For the optimal crystalline concentration (34% and 60%) these mechanical properties were then measured for different grain sizes, from 5 to 21 μm. The glass-ceramic with the highest fracture strength and indentation fracture toughness was that with 34% crystallized volume fracture and 13 μm crystals. Compared with the parent glass, the average fracture strength of this glass-ceramic was increased from 80 to 210 MPa, and the fracture toughness from 0.60 to 0.95 MPa.m(1/2). The increase in indentation fracture toughness was analyzed using different theoretical models, which demonstrated that it is due to crack deflection. Fortunately, the elastic modulus E increased only slightly; from 60 to 70 GPa (the elastic modulus of biomaterials should be as close as possible to that of cortical bone). In summary, the flexural strength of our best material (215 MPa) is significantly greater than that of cortical bone and comparable with that of apatite-wollastonite (A/W) bioglass ceramics, with the advantage that it shows a much lower elastic modulus. These results thus provide a relevant guide for the design of bioactive glass-ceramics with improved microstructure. Copyright © 2011 Acta