Zr-92(d,p)Zr-93 and Zr-92(d,t)Zr-91

Science.gov (United States)

Baron, N.; Fink, C. L.; Christensen, P. R.; Nickels, J.; Torsteinsen, T.

1972-01-01

The structures of Zr-93 and Zr-91 were studied by the stripping reaction Zr-92(d,p)Zr-93 and the pick-up reaction Zr-92(d,t)Zr-91 using 13 MeV incident deuterons. The reaction product particles were detected by counter telescope. Typical spectra from the reactions were analyzed by a nonlinear least squares peak fitting program which included a background search. Spin and parity assignments to observed excited levels were made by comparing experimental angular distributions with distorted wave Born approximation calculations.

PENGARUH KONSENTRASI ZrO2 TERHADAP KORELASI PERPINDAHAN PANAS NANOFLUIDA AIR-ZrO2 UNTUK PENDINGIN REAKTOR

Directory of Open Access Journals (Sweden)

K.A. Sudjatmi

2015-03-01

Full Text Available Sejalan dengan perkembangan konsep keselamatan pasif pada sistem keselamatan PLTN, maka sistem perpindahan panas konveksi alam memegang peranan penting. Pemakaian nanofluid sebagai fluida pendingin pada sistem keselamatan nuklir dapat digunakan pada Sistem Pendingin Teras Darurat dan Sistem Pendingin Pengungkung Luar Reaktor. Beberapa peneliti telah melakukan studi desain konseptual aplikasi nanofluid untuk meningkatkan keselamatan AP1000 dan sistem pendingin teras darurat pada reaktor daya eksperimen. Penerapan nanofluida juga mulai dikembangkan melalui hasil penelitian perpindahan panas konveksi alamiah pada sub-buluh dengan nanofluida sebagai fluida kerjanya sangat dibutuhkan. Penelitian ini bertujuan untuk menentukan pengaruh perubahan konsentrasi ZrO2 terhadap korelasi perpindahan panas konveksi alamiah dengan pendekatan eksperimental. Data eksperimental yang diperoleh digunakan untuk mengembangkan korelasi umum empirik perpindahan panas konveksi alamiah. Metode penelitian dengan menggunakan alat uji sub-buluh vertikal dengan geometri segitiga dan segiempat menggunakan air dan nanofluida air-ZrO2 sebagai fluida kerjanya. Konsentrasi nanopartikel dalam larutan yang digunakan sebesar 0,05 %, 0,10% dan 0,15 % dalam persen berat. Hasil penelitian menunjukan bahwa untuk bilangan Rayleigh yang sama, kemampuan pemindahan kalor oleh nanofluida air-ZrO2 lebih baik dari pada pemindahan kalor oleh air. Namun peningkatan konsentrasi nanofluida tidak selalu mendapatkan kemampuan pemindahan kalor yang lebih baik. Kata kunci: nanofluida air-ZrO2, konveksi alamiah, sub-buluh segitiga, sub-buluh segi segiempat   In line with the development of the passive safety concept for the safety systems of nuclear power plants, the natural convection heat transfer system plays an important role. The nanofluid as coolant fluid on nuclear safety system can be used in Emergency core cooling system and in reactor coolant system confinement. Several researchers have

Pharmacokinetics study of Zr-89-labeled melanin nanoparticle in iron-overload mice

International Nuclear Information System (INIS)

Zhang, Pengjun; Yue, Yuanyuan; Pan, Donghui; Yang, Runlin; Xu, Yuping; Wang, Lizhen; Yan, Junjie; Li, Xiaotian; Yang, Min

2016-01-01

Melanin, a natural biological pigment present in many organisms, has been found to exhibit multiple functions. An important property of melanin is its ability to chelate metal ions strongly, which might be developed as an iron chelator for iron overload therapy. Herein, we prepared the ultrasmall water-soluble melanin nanoparticle (MP) and firstly evaluate the pharmacokinetics of MP in iron-overload mice to provide scientific basis for treating iron-overload. To study the circulation time and biodistribution, MP was labeled with 89 Zr, a long half-life (78.4 h) positron-emitting metal which is suited for the labeling of nanoparticles and large bioactive molecule. MP was chelated with 89 Zr directly at pH 5, resulting in non-decay-corrected yield of 89.6% and a radiochemical purity of more than 98%. The specific activity was at least190 MBq/μmol. The 89 Zr-MP was stable in human plasma and PBS for at least 48 h. The half-life of 89 Zr-MP was about 15.70 ± 1.74 h in iron-overload mice. Biodistribution studies and MicroPET imaging showed that 89 Zr-MP mainly accumulated in liver and spleen, which are the target organ of iron-overload. The results indicate that the melanin nanoparticle is promising for further iron overload therapy.

Enhancing MA transmutation by irradiation of (MA, Zr)Hx in FBR blanket region - 5383

International Nuclear Information System (INIS)

Konashi, K.; Ikeda, K.; Itoh, K.; Hirai, M.; Koyama, T.; Kurosaki, K.

2015-01-01

Minor actinide (MA) hydride is proposed as transmutation target in sodium-cooled mixed oxide fuelled fast reactor. Preliminarily calculations have been done to check the transmutation efficiency of MA hydride targets. Three different types of MA target, MA-Zr alloy, (MA, Zr)O 2 and (MA, Zr)H x , have been compared on MA transmutation rate. The targets are assumed to be loaded around an active core in a 280 MWe sodium-cooled reactor; 54 MA target assemblies are respectively arranged in a row in the radial blanket zone. They are supposed to be irradiated for one year and then be cooled for 60 days. The transmuted mass has been evaluated by three-dimensional diffusion calculation to be 25, 15, 61 kg/EFPY for the alloy, the oxide and the hydride respectively, where production of MA in the active core is taken into account. The transmutation mass by (MA, Zr)H x is much larger than those by the other types of targets, while the core characteristics remain sound by locating MA targets outside of the active core. On top of that, two kinds of (MA, Zr)O 2 targets which are combined with ZrH x (x=1.7) pins have been calculated. Major Research/Development items are selected to establish the MA hydride transmutation method by reviewing technologies applicable to the transmutation system. The practical use of the MA hydride transmutation method is not far ahead technically, since this method can be developed by the extension of existing technologies. (authors)

A simple thick target for production of ⁸⁹Zr using an ¹¹MeV cyclotron

Energy Technology Data Exchange (ETDEWEB)

Link, Jeanne M.; Krohn, Kenneth A.; O' Hara, Matthew J.

2017-04-01

The growing interest but limited availability of ⁸⁹Zr for PET led us to test targets for the ⁸⁹(p,n) reaction. The goal was an easily constructed target for an 11 MeV Siements cyclotron. Yttrium foils were tested at different thicknesses, angles and currents. A 90 degree foil tolerated 41 microAmp without damage and produced ~800 MBq/hr, >20 mCi, an amount adequate for radiochemistry research and human doses in a widely available accelerator. This method should translate to higher energy cyclotrons.

Zr/ZrC modified layer formed on AISI 440B stainless steel by plasma Zr-alloying

Energy Technology Data Exchange (ETDEWEB)

Shen, H.H.; Liu, L.; Liu, X.Z.; Guo, Q.; Meng, T.X.; Wang, Z.X.; Yang, H.J.; Liu, X.P., E-mail: liuxiaoping@tyut.edu.cn

2016-12-01

Highlights: • A Zr/ZrC modified layer was formed on AISI 440B stainless steel using plasma surface Zr-alloying. • The thickness of the modified layer increases with alloying temperature and time. • Formation mechanism of the modified layer is dependent on the mutual diffusion of Zr and substrate elements. • The modified surface shows an improved wear resistance. - Abstract: The surface Zr/ZrC gradient alloying layer was prepared by double glow plasma surface alloying technique to increase the surface hardness and wear resistance of AISI 440B stainless steel. The microstructure of the Zr/ZrC alloying layer formed at different alloying temperatures and times as well as its formation mechanism were discussed by using scanning electron microscopy, glow discharge optical emission spectrum, X-ray diffraction and X-ray photoelectron spectroscopy. The adhesive strength, hardness and tribological property of the Zr/ZrC alloying layer were also evaluated in the paper. The alloying surface consists of the Zr-top layer and ZrC-subsurface layer which adheres strongly to the AISI 440B steel substrate. The thickness of the Zr/ZrC alloying layer increases gradually from 16 μm to 23 μm with alloying temperature elevated from 900 °C to 1000 °C. With alloying time from 0.5 h to 4 h, the alloyed depth increases from 3 μm to 30 μm, and the ZrC-rich alloyed thickness vs time is basically parabola at temperature of 1000 °C. Both the hardness and wear resistance of the Zr/ZrC alloying layer obviously increase compared with untreated AISI 440B steel.

First Year Report: Nuclear Reaction Measurements with Radioactive Beams and Targets- Progress in Measurements of the 89Zr (n,xnyp) Reaction Cross Sections

International Nuclear Information System (INIS)

Joseph Cerny; Dennis Moltz; Sylvia La; Ed Morse; Larry Ahle; Lee Bernstein; Ken Moody; Kevin Roberts; Margaret Moody; James Powell; Jim O'Neil; Anthony Belian

2004-01-01

OAK-B135 During the underground nuclear tests in Nevada, some of the most important information was obtained by radiochemical analysis of post-test excavations. By adding small samples of refractory and rare earth elements not commonly present in the surrounding soil to the device, a detailed look could be had of the actual event. In order to properly analyze these data, several hundred cross sections are needed at a neutron energy of 14 MeV (a d-t-burn product). Although it has always been assumed that these calculations are correct, insufficient experimental data exist to corroborate this assumption. The purpose of this experiment is to measure two reaction cross sections, namely the 89 Zr (n, 2n) 88 Zr and 89 Zr (n, np) 88 Y reactions. Although the former reaction has been measured in an unpublished report ( A. A. Delucchi and W. Goishi, LANL Report LA-7841-C (1977) pp. 33-36), we intend to reduce the experimental error in this cross section. The latter cross section has not been measured. This case is much simplified because these reaction products have half-lives ∼100 days compared with ∼3 days for the target nuclide. Therefore the assay can be accomplished long after the target nuclei have decayed away

Zr/ZrC modified layer formed on AISI 440B stainless steel by plasma Zr-alloying

Science.gov (United States)

Shen, H. H.; Liu, L.; Liu, X. Z.; Guo, Q.; Meng, T. X.; Wang, Z. X.; Yang, H. J.; Liu, X. P.

2016-12-01

The surface Zr/ZrC gradient alloying layer was prepared by double glow plasma surface alloying technique to increase the surface hardness and wear resistance of AISI 440B stainless steel. The microstructure of the Zr/ZrC alloying layer formed at different alloying temperatures and times as well as its formation mechanism were discussed by using scanning electron microscopy, glow discharge optical emission spectrum, X-ray diffraction and X-ray photoelectron spectroscopy. The adhesive strength, hardness and tribological property of the Zr/ZrC alloying layer were also evaluated in the paper. The alloying surface consists of the Zr-top layer and ZrC-subsurface layer which adheres strongly to the AISI 440B steel substrate. The thickness of the Zr/ZrC alloying layer increases gradually from 16 μm to 23 μm with alloying temperature elevated from 900 °C to 1000 °C. With alloying time from 0.5 h to 4 h, the alloyed depth increases from 3 μm to 30 μm, and the ZrC-rich alloyed thickness vs time is basically parabola at temperature of 1000 °C. Both the hardness and wear resistance of the Zr/ZrC alloying layer obviously increase compared with untreated AISI 440B steel.

Annotating MYC status with 89Zr-transferrin imaging.

Science.gov (United States)

Holland, Jason P; Evans, Michael J; Rice, Samuel L; Wongvipat, John; Sawyers, Charles L; Lewis, Jason S

2012-10-01

A noninvasive technology that quantitatively measures the activity of oncogenic signaling pathways could have a broad impact on cancer diagnosis and treatment with targeted therapies. Here we describe the development of (89)Zr-desferrioxamine-labeled transferrin ((89)Zr-transferrin), a new positron emission tomography (PET) radiotracer that binds the transferrin receptor 1 (TFRC, CD71) with high avidity. The use of (89)Zr-transferrin produces high-contrast PET images that quantitatively reflect treatment-induced changes in MYC-regulated TFRC expression in a MYC-driven prostate cancer xenograft model. Moreover, (89)Zr-transferrin imaging can detect the in situ development of prostate cancer in a transgenic MYC prostate cancer model, as well as in prostatic intraepithelial neoplasia (PIN) before histological or anatomic evidence of invasive cancer. These preclinical data establish (89)Zr-transferrin as a sensitive tool for noninvasive measurement of oncogene-driven TFRC expression in prostate and potentially other cancers, with prospective near-term clinical application.

The 91Zr(d,t)90Zr reaction

International Nuclear Information System (INIS)

Gomes, L.C.

1975-01-01

Sixteen levels populated in the 91 Zr(d,t) 90 Zr pick-up reaction were studied with 16 MeV deuterons. Distorted waves Born approximation calculations were compared to the data, and yielded spectroscopic factors and l values. Particle-hole states in 90 Zr were observed. Some significant errors were found in Zr(d,t) reactions Q values recently compiled [pt

Roles of texture of Zr alloys in ZrO{sub 2} film formation and δ-hydride orientation near ZrO{sub 2}/Zr interface

Energy Technology Data Exchange (ETDEWEB)

Qin, W.; Szpunar, J.A., E-mail: weq565@mail.usask.ca, E-mail: jerzy.szpunar@usask.ca [Univ. of Saskatchewan, Dept. of Mechanical Engineering, Saskatoon, SK (Canada); Kozinski, J., E-mail: janusz.kozinski@lassonde.yorku.ca [York Univ., Faculty of Science and Engineering, Toronto, ON (Canada)

2014-07-01

Oxidation and hydrogen embrittlement are related to formation of cracks and failure of Zr alloys used in nuclear reactor applications. An in-depth understanding of the formation of ZrO{sub 2} film and the hydride precipitation and orientation is important for improving the corrosion resistance of zirconium alloys. In this work a theoretical model is developed to analyze the microstructure of ZrO{sub 2} film formed on Zr alloys and the effect of stress that results from ZrO{sub 2} formation on hydride reorientation in the region near oxide/metal interface. Our work shows that the macroscopic stress produced due to Pilling-Bedworth ratio for ZrO{sub 2}/Zr could lead to the hydride re-orientation in the region near ZrO{sub 2}/Zr interface. Whether or not this effect can occur is dependent on the texture of the zirconium alloys. Control of texture of zirconium alloys can affect the microstructure of ZrO{sub 2} film and can be responsible for change of hydride orientation. (author)

Antibacterial activity and cell compatibility of TiZrN, TiZrCN, and TiZr-amorphous carbon coatings

Energy Technology Data Exchange (ETDEWEB)

Huang, Heng-Li [School of Dentistry, China Medical University, Taichung 404, Taiwan (China); Department of Bioinformatics and Medical Engineering, Asia University, Taichung 41354, Taiwan (China); Chang, Yin-Yu, E-mail: yinyu@nfu.edu.tw [Department of Mechanical and Computer-aided Engineering, National Formosa University, Yunlin 632, Taiwan (China); Liu, Jia-Xu [Department of Mechanical and Computer-aided Engineering, National Formosa University, Yunlin 632, Taiwan (China); Tsai, Ming-Tzu [Department of Biomedical Engineering, Hungkuang University, Taichung 433, Taiwan (China); Lai, Chih-Ho [Department of Microbiology and Immunology, Graduate Institute of Biomedical Sciences, Chang Gung University, Taoyuan, Taiwan (China)

2015-12-01

A cathodic-arc evaporation system with plasma-enhanced duct equipment was used to deposit TiZrN, TiZrCN, and TiZr/a-C coatings. Reactive gases (N{sub 2} and C{sub 2}H{sub 2}) activated by the Ti and Zr plasma in the evaporation process was used to deposit the TiZrCN and TiZr/a-C coatings with different C and nitrogen contents. The crystalline structures and bonding states of coatings were analyzed by X-ray diffraction and X-ray photoelectron spectroscopy. The microbial activity of the coatings was evaluated against Staphylococcus aureus (Gram-positive bacteria) and Actinobacillus actinomycetemcomitans (Gram-negative bacteria) by in vitro antibacterial analysis using a fluorescence staining method employing SYTO9 and a bacterial-viability test on an agar plate. The cell compatibility and morphology related to CCD-966SK cell-line human skin fibroblast cells on the coated samples were also determined using the 3-(4, 5-dimethylthiazol-2-yl)-2, 5-diphenyltetrazolium bromide assay, reverse-transcriptase-polymerase chain reaction, and scanning electron microscopy. The results suggest that the TiZrCN coatings not only possess better antibacterial performance than TiZrN and TiZr/a-C coatings but also maintain good compatibility with human skin fibroblast cells. - Highlights: • TiZrN, TiZrCN, and TiZr/a-C coatings were deposited using cathodic arc evaporation. • The TiZrCN showed a composite structure containing TiN, ZrN, and a-C. • The TiZrCN-coated Ti showed the least hydrophobicity among the samples. • The TiZrCN-coated Ti showed good human skin fibroblast cell viability. • The TiZrCN-coated Ti exhibited good antibacterial performance.

Phase equilibria in the Zr-Si-B ternary system (Zr-Si-ZrB{sub 2} region) at 1 173 K

Energy Technology Data Exchange (ETDEWEB)

Han, Feng; Luo, Hao [Guangxi Univ., Nanning (China). College of Materials Science and Engineering; Guangxi Univ., Nanning (China). Guangxi Key Lab. of Processing for Non-ferrous Metal and Featured Materials; Zhan, Yongzhong [Guangxi Univ., Nanning (China). College of Materials Science and Engineering; Guangxi Univ., Nanning (China). Guangxi Key Lab. of Processing for Non-ferrous Metal and Featured Materials; Guangxi Univ., Nanning (China). Center of Ecological Collaborative Innovation for Aluminum Industry

2017-10-15

The isothermal section of the Zr-Si-B ternary system (Zr-Si-ZrB{sub 2} region) at 1 173 K has been experimentally determined. All equilibrated alloys were characterized via X-ray powder diffraction and scanning electron microscopy equipped with energy-dispersive X-ray analysis. A ternary phase Zr{sub 5}(Si{sub 0.86}B{sub 0.14}){sub 3} was found at 1 173 K. The experimental results show that the isothermal section consists of 11 single-phase regions, 26 two-phase regions and 13 three-phase regions. The existence of eight compounds, i.e. ZrSi{sub 2}, ZrSi, Zr{sub 5}Si{sub 4}, Zr{sub 3}Si{sub 2}, Zr{sub 2}Si, ZrB, ZrB{sub 2} and Zr{sub 5}(Si{sub 0.86}B{sub 0.14}){sub 3} in this system has been confirmed in the Zr-Si-ZrB{sub 2} region at 1 173 K.

Sputter deposition of wear-resistant coatings within the system Zr-B-N

Energy Technology Data Exchange (ETDEWEB)

Mitterer, C; Uebleis, A; Ebner, R [Inst. fuer Metallkunde und Werkstoffpruefung, Montanuniv., Leoben (Austria)

1991-07-07

Wear-resistant coatings of zirconium boride and zirconium boron nitride were deposited on steel and molybdenum substrates employing non-reactive as well as reactive d.c. magnetron sputtering using zirconium diboride targets. The characterization of the coatings was done by means of scanning electron microscopy, transmission electron microscopy and X-ray diffraction. The results are discussed in connection with measured mechanical coating properties such as microhardness and adhesion. The optical properties of the coatings were determined using a CIE-L{sup *}a{sup *}b{sup *} colorimeter and specialized corrosion and abrasion tests. Non-reactive sputtering using ZrB{sub 2} targets results in the formation of coatings with a columnar structure and predominantly (001)-orientated ZrB{sub 2} crystals. Coatings deposited at low nitrogen flow rates exhibit very fine-grained or even fracture amorphous structures with a hexagonal Zr-B-N phase derived from the ZrB{sub 2} lattice. A further increase of the nitrogen flow leads to an amorphous film growth. The maximum Vickers microhardness of the coatings was found to be approximately 2300 HV 0.02. Zr-B and Zr-B-N coatings offer a wide range of interesting colours as well as good corrosion and wear resistance. (orig.).

States in 94Zr from 94Zr(d,d')94Zr* at 15.5 Mev

International Nuclear Information System (INIS)

Frota-Pessoa, E.; Joffily, S.

1986-01-01

94 energy levels up to approx. 4.3 Mev excitation energy are studied in the 94 Zr(d,d') 94 Zr* reaction. Deuterons had a bombarding energy of 15.5 MeV. The emergent deuterons were analysed by a magnetic spectrograph and the detector was nuclear emulsion. The resolution in energy was about 11 KeV. The distorted-wave analysis was used to determine the l transferred, the β 2 l and J Π values for some 94 Zr excited states. These results are compared with previous ones. 32 levels of excitation energy in 94 Zr were found which did not appear in previous 94 Zr(d,d') reactions. 20 levels do not correspond to the ones. (Author) [pt

Ultrafast optical control of the electronic properties of ZrTe5

Energy Technology Data Exchange (ETDEWEB)

Crepaldi, Alberto; Cilento, Federico [Elettra-Sincrotrone Trieste (Italy); Manzoni, Giulia; Sterzi, Andrea; Diego, Michele [Universita degli Studi di Trieste (Italy); Kuhn, Timo; Gragnaniello, Luca; Fonin, Mikhail [University of Konstanz (Germany); Autes, Gabriel; Bugnon, Philippe; Magrez, Arnaud; Berger, Helmuth; Yazyev, Oleg; Grioni, Marco [EPFL (Switzerland); Zacchigna, Michele [C.N.R.-I.O.M. (Italy); Parmigiani, Fulvio [Elettra-Sincrotrone Trieste (Italy); Universita degli Studi di Trieste (Italy)

2016-07-01

ZrTe5 has recently attracted considerable interest owing to some unique, albeit only partially understood, properties. The electrical resistivity exhibits a peak at a temperature where the nature of the charge carriers changes from holes to electrons. The observed negative magneto-resistance has been attributed to the presence of Dirac particles, either three-dimensional or two-dimensional and spin-polarized. Our time and angle-resolved photoelectron spectroscopy (tr-ARPES) study has addressed the origin of the anomalous transport behavior of ZrTe5, while showing the possibility to control the electronic properties of this material via sub-ps IR laser pulses. These observations open the way to the exploitation of ZrTe5 as a platform for magnetoelectric optical and thermoelectric transport applications. Finally, by combining ab initio calculations, ARPES and scanning tunneling microscopy (STM) we are contributing to shed light on the topological nature of ZrTe5, which is shown to be close to transition between strong and weak topological insulator phases.

Fretting wear of ZrN and Zr(21% Hf)N coatings

Energy Technology Data Exchange (ETDEWEB)

Atar, E. [Gebze Inst. of Tech., Material Science and Engineering Dept., Kocaeli (Turkey); Cimenoglu, H.; Kayali, E.S. [Istanbul Technical Univ., Dept. of Metallurgy and Materials Engineering, Istanbul (Turkey)

2004-07-01

In this study, the wear behaviours of ZrN and Zr(21% Hf)N coatings, deposited on hardened AISI D2 cold work tool steel were examined by a fretting wear tester. The hardness of ZrN and Zr(21% Hf)N coatings were almost the same, where as they exhibited different wear resistance. Addition of 21% Hf to ZrN coating achieved about 25% increase in the wear resistance. (orig.)

Fretting wear of ZrN and Zr(21% Hf)N coatings

International Nuclear Information System (INIS)

Atar, E.; Cimenoglu, H.; Kayali, E.S.

2004-01-01

In this study, the wear behaviours of ZrN and Zr(21% Hf)N coatings, deposited on hardened AISI D2 cold work tool steel were examined by a fretting wear tester. The hardness of ZrN and Zr(21% Hf)N coatings were almost the same, where as they exhibited different wear resistance. Addition of 21% Hf to ZrN coating achieved about 25% increase in the wear resistance. (orig.)

Nanostructured multilayers of TiN/ZrN obtained by magnetron sputtering

International Nuclear Information System (INIS)

Caicedo A, J.C.; Bejarano G, G.; Gomez, M.E.; Prieto, P.; Cortez, C.; Munoz, J.

2007-01-01

In order to find an industrial application for thin films of TiN and ZrN monolayers, as well as TiN/ZrN multilayers were deposited onto silicon (100) and AISI 5160 steel substrates by r.f. (13.56 MHz) multi-target magnetron sputtering from high-purity (99.5%) Ti and (99.5%) Zr targets in an Ar (93%)/N 2 (7%) gas mixture. For their deposition, we applied a substrate bias voltage of -100 V and a target power of 350 W. The films were deposited at a pressure of 6x10 -3 mbar and a temperature of 250 C. The structure, composition, morphology, and topography were characterized by, XRD, FTIR, SEM, AFM, and optical microscopy. Mechanical properties like hardness and elastic modulus were determined by Nanoindentation. Hardness and elastic modulus of the films increased proportionally to the number of bilayers. Finally, cutting tools were coated with 1, 2, 3, 4, 5, 6, 7, and 8 bilayers of TiN/ZrN. Cutting tests on paper blades were conducted. Increased cut quality performance was observed for cutting tools coated with 8 bilayers, as compared to uncoated tools. This work opens the possibility to use coated AISI 5160 as cutting tools for the paper industry, reducing the import of expensive high-quality tool steel. (copyright 2007 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Nanostructured multilayers of TiN/ZrN obtained by magnetron sputtering

Energy Technology Data Exchange (ETDEWEB)

Caicedo A., J.C. [CDT ASTIN, SENA Regional Valle, Cali (Colombia); Grupo de Peliculas Delgadas, Universidad del Valle (Colombia); Centro de Excelencia en Nuevos Materiales, CENM, Universidad del Valle (Colombia); Bejarano G., G. [CDT ASTIN, SENA Regional Valle, Cali (Colombia); Group of Corrosion and Protection, Antioquia University, Medellin (Colombia); Gomez, M.E. [Grupo de Peliculas Delgadas, Universidad del Valle (Colombia); Centro de Excelencia en Nuevos Materiales, CENM, Universidad del Valle (Colombia); Prieto, P. [Centro de Excelencia en Nuevos Materiales, CENM, Universidad del Valle (Colombia); Cortez, C.; Munoz, J. [Centro de Investigacion y Estudios Avanzados del CINVESTAV-IPN, Queretaro (Mexico)

2007-07-01

In order to find an industrial application for thin films of TiN and ZrN monolayers, as well as TiN/ZrN multilayers were deposited onto silicon (100) and AISI 5160 steel substrates by r.f. (13.56 MHz) multi-target magnetron sputtering from high-purity (99.5%) Ti and (99.5%) Zr targets in an Ar (93%)/N{sub 2} (7%) gas mixture. For their deposition, we applied a substrate bias voltage of -100 V and a target power of 350 W. The films were deposited at a pressure of 6x10{sup -3} mbar and a temperature of 250 C. The structure, composition, morphology, and topography were characterized by, XRD, FTIR, SEM, AFM, and optical microscopy. Mechanical properties like hardness and elastic modulus were determined by Nanoindentation. Hardness and elastic modulus of the films increased proportionally to the number of bilayers. Finally, cutting tools were coated with 1, 2, 3, 4, 5, 6, 7, and 8 bilayers of TiN/ZrN. Cutting tests on paper blades were conducted. Increased cut quality performance was observed for cutting tools coated with 8 bilayers, as compared to uncoated tools. This work opens the possibility to use coated AISI 5160 as cutting tools for the paper industry, reducing the import of expensive high-quality tool steel. (copyright 2007 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Reduction behaviors of Zr for LiCl-KCl-ZrCl4 and LiCl-KCl-ZrCl4-CdCl2

International Nuclear Information System (INIS)

Kim, Si Hyung; Yoon, Jongho; Kim, Gha Young; Kim, Tack Jin; Shim, Joon Bo; Kim, Kwang Rag; Jung, Jae Hoo; Ahn, Do Hee; Paek, Seungwoo

2013-01-01

The reduction potentials of most of the zirconium ions on the solid cathode are smaller (about 0.4V) than that of uranium, and thus zirconium can be recovered prior to uranium during the reduction stage. In the case of a liquid cadmium cathode, which is one of the major cathodes, the reduction potential can be changed because zirconium reacts with the liquid cadmium. Up to now, it has not been well known what the reduction potential of Zr was on the liquid Cd cathode. According to the Cd-Zr phase diagram, there are four intermetallic compounds between cadmium and zirconium. It is easier to use the solid cathode than the liquid cadmium cathode in LiCl-KCl-ZrCl 4 containing CdCl 2 to identify the formation of the Cd-Zr phase. In this study, the reduction behaviors of zirconium were compared in the LiCl-KCl-ZrCl 4 and LiCl-KCl-ZrCl 4 -CdCl 2 solutions when using a solid cathode. The reduction behavior of Zr at a solid W cathode and a Cd-coated W cathode was compared in a LiCl-KCl-ZrCl 4 solution at 500 .deg. C. It was observed from the results using a solid W cathode that Zr 4+ ions were gradually oxidized to Zr 2+ , Zr, and ZrCl during the reduction sweep, but the final oxidation peak of Zr 2+ to Zr 4+ seemed to be unclear during the oxidation sweep. In the case of the Cd-coated W electrode, only a Cd 2 Zr phase was formed at 500 .deg. C, which seemed to be related to the melting point of Cd-Zr intermetallics. Through additional studies at different temperatures, the formation behavior will be studied

Cu-Zr-Ag bulk metallic glasses based on Cu8Zr5 icosahedron

International Nuclear Information System (INIS)

Xia Junhai; Qiang Jianbing; Wang Yingmin; Wang Qing; Dong Chuang

2007-01-01

Based on the cluster line criterion, the Ag addition into the Cu 8 Zr 5 cluster composition is investigated for the search of ternary Cu-Zr-Ag bulk metallic glasses with high glass forming abilities. Two initial binary compositions Cu 0.618 Zr 0.382 and Cu 0.64 Zr 0.36 are selected. The former one corresponds to a deep eutectic point; it is also the composition of the Cu 8 Zr 5 icosahedron, which is derived from the Cu 8 Zr 3 structure. The latter one, which can be regarded as the Cu 8 Zr 5 cluster plus a glue atom Cu, is the best glass-forming composition in the Cu-Zr binary system. Two composition lines (Cu 0.618 Zr 0.382 ) 1-x Ag x and (Cu 0.64 Zr 0.36 ) 1-x Ag x are thus constructed in the Cu-Zr-Ag system by linking these two compositions with the third constitute Ag. A series of Cu-Zr-Ag bulk metallic glasses are found with 2-8 at.% Ag contents in both composition lines. The optimum composition (Cu 0.618 Zr 0.382 ) 0.92 Ag 0.08 within the searched region with the highest T g /T l = 0.633, is located along the cluster line (Cu 0.618 Zr 0.382 ) 1-x Ag x , where the deep eutectic Cu 0.618 Zr 0.382 exactly corresponds to the dense packing cluster Cu 8 Zr 5 . The alloying mechanism is discussed in the light of atomic size and electron concentration factors

Influence of negative substrate bias voltage on the impurity concentrations in Zr films

International Nuclear Information System (INIS)

Lim, J.-W.; Bae, J.W.; Mimura, K.; Isshiki, M.

2006-01-01

Zr films were deposited on Si(1 0 0) substrates without a substrate bias voltage and with substrate bias voltages of -50 V and -100 V using a non-mass separated ion beam deposition system. Secondary ion mass spectrometry and glow discharge mass spectrometry were used to determine the impurity concentrations in a Zr target and Zr films. It was found that the total amount of impurities in the Zr film deposited at the substrate bias voltage of -50 V was much lower than that in the Zr film deposited without the substrate bias voltage. It means that applying a negative bias voltage to the substrate can suppress the increase in impurities of Zr films. Furthermore, it was confirmed that dominant impurity elements such as C, N and O have a considerable effect on the purity of Zr films and these impurities can be remarkably reduced by applying the negative substrate bias voltage

In situ synthesis and formation mechanism of ZrC and ZrB2 by combustion synthesis from the Co-Zr-B4C system

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Mengxian Zhang

2015-09-01

Full Text Available ZrC-ZrB2-based composites were prepared by combustion synthesis (CS reaction from 10 wt.% to 50 wt.% Co-Zr-B4C powder mixtures. With increasing Co contents, the particle sizes of near-spherical ZrC and platelet-like ZrB2 decreased from 1 μm to 0.5 μm and from 5 μm to 2 μm, respectively. In addition, the formation mechanism of ZrC and ZrB2 was explored by the phase transition and microstructure evolution on the combustion wave quenched sample in combination with differential scanning calorimeter analysis. The results showed that the production of ZrC was ascribed to the solid-solid reaction between Zr and C and the precipitation from the Co-Zr-B-C melt, while ZrB2 was prepared from the saturated liquid. The low B concentration in the Co-Zr-B-C liquid and high cooling rate during the CS process led to the presence of Co2B and ZrCo3B2 in the composites. The addition of Co in the Co-Zr-B4C system not only prevented ZrC and ZrB2 particulates from growing, but also promoted the occurrence of ZrC-ZrB2-forming reaction.

Zr-rich corner of the Zr-Sn-O diagram

International Nuclear Information System (INIS)

Roberti, L.A.; Arias, D.E.

1993-01-01

The understanding of the effect of light elements (in particular oxygen, nitrogen and hydrogen) on the behaviour of alloys for nuclear use is necessary because of its technological importance. The Zr-Sn-O system is perhaps the most representative of all possible ternary systems which can be used to simulate a simplified Zircaloy-type alloy in which the effect of O can be studied. However, in the specialized literature experimental data on phase equilibria and thermophysical properties of this system are not easily found. In the present work, the equilibrium compositions of the α and β phases of the Zr-Sn-O system at temperatures between 1150 and 1323 K are calculated, using the scarce available information. First results of the calculations show satisfactory coincidences with experimental data. Future work will be oriented towards the proposal of isothermal cross-sections calculated by a modelling of phases with wider Sn and O composition ranges, and involving equilibria with the phases Zr 4 Sn, Zr 5 Sn 3 , ZrO 2 , ZrSnO 4 . (Author)

Lattice constant changes leading to significant changes of the spin-gapless features and physical nature in a inverse Heusler compound Zr2MnGa

Science.gov (United States)

Wang, Xiaotian; Cheng, Zhenxiang; Khenata, Rabah; Wu, Yang; Wang, Liying; Liu, Guodong

2017-12-01

The spin-gapless semiconductors with parabolic energy dispersions [1-3] have been recently proposed as a new class of materials for potential applications in spintronic devices. In this work, according to the Slater-Pauling rule, we report the fully-compensated ferrimagnetic (FCF) behavior and spin-gapless semiconducting (SGS) properties for a new inverse Heusler compound Zr2MnGa by means of the plane-wave pseudo-potential method based on density functional theory. With the help of GGA-PBE, the electronic structures and the magnetism of Zr2MnGa compound at its equilibrium and strained lattice constants are systematically studied. The calculated results show that the Zr2MnGa is a new SGS at its equilibrium lattice constant: there is an energy gap between the conduction and valence bands for both the majority and minority electrons, while there is no gap between the majority electrons in the valence band and the minority electrons in the conduction band. Remarkably, not only a diverse physical nature transition, but also different types of spin-gapless features can be observed with the change of the lattice constants. Our calculated results of Zr2MnGa compound indicate that this material has great application potential in spintronic devices.

Enthalpy of mixing of liquid Ni-Zr and Cu-Ni-Zr alloys

International Nuclear Information System (INIS)

Witusiewicz, V.T.; Sommer, F.

2000-01-01

Since the Al-Cu-Ni-Zr system is a basis for the production of bulk amorphous materials by rapid solidification techniques from the liquid state, it is of great scientific interest to determine the partial and the integral thermodynamic functions of liquid and undercooled liquid alloys. Such data, as was pointed out previously, are important in order to understand their extremely good glass-forming ability in multicomponent metallic systems as well as for processing improvements. In order to measure the thermodynamic properties of the Al-Cu-Ni-Zr quaternary, it is necessary to have reliable thermochemical data for its constituent canaries and ternaries first. In a series of articles, the authors have reported in detail the thermodynamic properties of liquid Al-Cu, Al-Ni, Cu-Ni, Cu-Zr, Al-Zr, Al-Cu-Ni, and Al-Cu-Zr alloys. This article deals with the direct calorimetric measurements of the partial and the integral enthalpies of mixing of liquid Ni-Zr and Cu-Ni-Zr alloys and the heat capacity of liquid Ni 26 Zr 74 . In a subsequent article, the authors will present similar data for the liquid ternary Al-Ni-Zr and for the liquid quaternary Al-Cu-Ni-Zr alloys

EFFECT OF TIME AND TEMPERATURE ON ISOMERIZATION REACTION OF ?-PINENEUSING CATALYST ZR 4+ Nanik Wijayati, Supartono, Nuni Widiarti, Tri Handayani /NATURAL ZEOLITE

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Nanik Wijayati

2016-03-01

Full Text Available Effects of time and temperature on ?-pinene isomerization reaction using catalysts Zr/natural zeolitewas studied. Characterization of the catalysts include: crystallinity, observed using X-Ray Diffraction, count Zr 4+ carried observed using X-Ray Fluorescence, area and porosity catalyst was observed using the Surface Area Analyzer, and acidity catalyst observed through gravimetric method. Isomerization reaction carried out in a batch reactor with temperature variations 90, 120 and 150 C and reaction time variations of 60, 90, 120, 150 and 180 minutes. Best results of isomerisation in this study was obtained at 150 derajat C with a reaction time of 180 minutes. Kindsof isomer obtained was observed using GCMS. Catalyst characterization results indicate that modification of the catalyst by cation Zr increases the acidity from 2.76 to 6.64 mmol/g and does not damage the crystal structure significantly. The highest product conversion in this research is 9.24%, less than the maximum results caused by pre-treatment of the catalyst produces a low area. Thus, temperature and reaction time affect the concentration of ? pinene isomerization product in addition to the effect of the catalyst used.

A radiochemical separation of spallogenic 88Zr in the carrier-free state for radioisotopic photoneutron sources

International Nuclear Information System (INIS)

Whipple, R.E.; Grant, P.M.; Daniels, R.J.; Daniels, W.R.; O'Brien, H.A.Jr.

1976-01-01

As the precursor of its 88 Y daughter, 88 Zr could be advantageously included in the active component of the 88 Y-Be photoneutron source for several reasons. The spallation of Mo targets with medium-energy protons at LAMPF procedure has been developed to separate radiozirconium from the target material and various spallogenic impurities. 88 Zr can consequently be obtained carrier-free and in quantitative yield. (author)

Isospin effect in the (e, e'p) reaction on Zr-isotopes and others

International Nuclear Information System (INIS)

Allen, K.J.F.; Davison, A.; Thompson, M.N.

1974-01-01

A considerable amount of work concerning 90 Zr and 91 Zr has been carried out by both the Melbourne and Tohoku groups. This interest largely originated from the observance of marked structure about the giant resonance region in early (p, γ 0 ) experiments on 90 Zr. A result of these studies so far is the proposal of a weak coupling core excitation model to explain the change in character of the isotopes 90 and 91. This has been successful with one major exception -- the lack of strength about Ep=7.9 MeV in 91 Zr. In order to further test this model and possibly arrive at some explanation for the above mentioned anomaly, the obvious progression to the isotopes 92 and 94 constitutes the basic theme of the present series of experiments. For protons from 92 Zr, to determine the nature of the proton groups seen in spectra obtained with Esub(e)=30 MeV, a series of runs with Esub(e) ranging from 22.5 to 15.0 MeV were taken with the end points differing by 0.5 MeV. It should be possible to obtain the estimates of P 0 , P 1 , and possibly P 2 cross-sections from these data. As to protons from 94 Zr, although it was not possible to make the investigation as detailed as that for 92 Zr, it will be possible to establish the nature of some of the decay scheme. (Tai, I.)

Determination of Nb and Zr in U-Nb-Zr alloys by ICP-AES

International Nuclear Information System (INIS)

Wang Cuiping; Dong Shizhe; Li Lin; He Meiying

2003-01-01

The U-Nb-Zr alloy sample is dissolved by HNO 3 , H 2 O 2 and HF, and the contents of Nb and Zr in the sample are determined on the JY-70 II type ICP-AES by using the internal standard synchronous dilution method. The range of determination is 1%-10% and 0.33%-3.33%, respectively for Nb and Zr. The relative standard deviation is better than 3.2% for Nb, and 2.5% for Zr. The method is rapid and convenient for determining Nb and Zr in U-Nb-Zr alloy sample

Nuclear orientation of 9597Nb and 95Zr in ZrFe2

International Nuclear Information System (INIS)

Krane, K.S.; Olsen, C.E.; Rosenblum, S.S.; Steyert, W.A.

1976-01-01

The angular distribution anisotropies of γ rays were measured following the decays of 95 , 97 Nb and 95 Zr oriented at low temperatures in the ferromagnetic Laves phase compound ZrFe 2 . The magnetic hyperfine field of Nb in ZrFe 2 was deduced to be 9.4+-1.6 T; that of Zr in ZrFe 2 was estimated to be 15+-4 T. The nuclear magnetic moment of 97 Nb was deduced to be μ = (7.5+-1.4) μ/subN/

Grain boundary sinks in neutron-irradiated Zr and Zr-alloys

International Nuclear Information System (INIS)

Griffiths, M.; Gilbert, R.W.; Coleman, C.E.

1988-01-01

Samples of annealed sponge and crystal-bar Zr and Zircaloy-2 have been examined following irradiation in EBR-II at temperatures ≅ 700 K. Loop analysis shows that there is selective denuding of interstitial loops near to some grain boundaries indicating that such boundaries are net sinks for interstitial point defects. Furthermore, in sponge Zr and Zircaloy-2, vacancy c-component loops are observed running into the grain boundaries showing that the grain boundaries are not preferred sinks for vacancies. Cavities are observed in all samples. In crystal-bar Zr and sponge Zr they are mostly observed adjacent to grain boundaries. They are also sometimes found within grains associated with precipitates. The cavities are more common in the crystal-bar Zr and this is probably because both the sponge Zr and Zircaloy-2 contain vacancy c-component loops which compete for vacancies (assuming that the cavities are vacancy sinks). Only some of the grain boundaries have cavities adjacent to them and this may be related to the orientation of the boundary. (orig.)

Determination of concentration of Zr in Cu-Cr-Zr alloy and Li and Ti in lithium titanate by CPAA using proton beam from VEC accelerator

International Nuclear Information System (INIS)

Dasgupta, S.; Datta, J.; Chowdhury, D.P.; Verma, R.

2015-01-01

It has recently been reported that copper exhibits advanced mechanical properties in several technological applications even at elevated temperatures while it still retains its usual excellent conducting properties for which it is recommended primarily. The addition of Zr inhibits chemical reaction of Cu at elevated temperatures. It also helps to retain the physical properties at elevated temperatures. The Zr content of 0.15% can increase the softening temperature (by 300°C) having no significant effect on electrical conductivity. Uses include heat sinks, electrical and mechanical power transmission devices, electrical switches and turbine generators. The concentration of Zr in Cu-Cr-Zr was determined by charged particle activation analysis (CPAA) through activation product 90g Nb (t 1/2 - 14.6 h, 141.2 keV (69 %) from 90 Zr(p, n) 90g Nb nuclear reaction using 13 MeV proton from VEC machine. The irradiation of sample and standard (pure Zr metal plate) were carried out with proton beam using ∼600 nA beam current for 15 - 30 min. 90 Zr was chosen as the preferred isotope due to its high abundance in nature, the availability of a suitable daughter product with a γ-energy having no other interfering γ-energies from the matrix elements. The counting measurements of active sample were performed with a high resolution γ-spectrometer using HPGe detector (Efficiency: 40%, Resolution: 2 keV at 1332 keV). The data analysis of the γ-spectra of samples of Cu-Cr-Zr and standard showed the concentration of Zr in Cu-Cr-Zr sample was 190±18 mg kg -1

Nanotube morphology changes for Ti-Zr alloys as Zr content increases

International Nuclear Information System (INIS)

Kim, Won-Gi; Choe, Han-Cheol; Ko, Yeong-Mu; Brantley, William A.

2009-01-01

Nanotube morphology changes in Ti-Zr alloys as Zr content increases have been investigated. Ti-Zr (10, 20, 30 and 40 wt.%) alloys were prepared by arc melting and heat treated for 24 h at 1000 o C in an argon atmosphere. TiO 2 nanotubes were formed on the Ti-Zr alloys by anodization in H 3 PO 4 containing 0.5 wt.% NaF. Electrochemical experiments were performed using a conventional three-electrode configuration with a platinum counter electrode and a saturated calomel reference electrode. Samples were embedded in epoxy resin, leaving an area of 10 mm 2 exposed to the electrolyte. Anodization was carried out using a scanning potentiostat, and all experiments were conducted at room temperature. Microstructures of the alloys were examined by optical microscopy (OM), field emission scanning electron microscopy (FE-SEM) and x-ray diffraction (XRD). The Ti-Zr alloy microstructures observed by OM and FE-SEM changed from a lamellar structure to a needle-like structure with increasing Zr content. The microstructures also changed from β phase to increasing amounts of α phase as the Zr content increased. The number of large nanotubes formed by anodization decreased, and the number of small nanotubes increased, as the Zr content increased. The mean inner diameter ranged from approximately 150 to 200 nm with a tube-wall thickness of about 20 nm. The interspace between the nanotubes was approximately 60, 70, 100 and 130 nm for Zr contents of 10, 20, 30 and 40 wt.%, respectively.

Stress corrosion of the alloy U-7.5 Nb-2.5 Zr

International Nuclear Information System (INIS)

Lepoutre, D.; Nomine, A.M.; Miannay, D.

1983-09-01

Oxide formed on U-7.5 Nb-2.5 Zr at room temperature during stress corrosion cracking in oxygen is identical to the natural oxide of the alloy. It is formed by UO 2 with Nb and Zr and is associated with an increased Nb content at the interface. This oxide would be responsible for cracking [fr

Morphology evolution of ZrB2 nanoparticles synthesized by sol-gel method

International Nuclear Information System (INIS)

Zhang Yun; Li Ruixing; Jiang Yanshan; Zhao Bin; Duan Huiping; Li Junping; Feng Zhihai

2011-01-01

Zirconium diboride (ZrB 2 ) nanoparticles were synthesized by sol-gel method using zirconium n-propoxide (Zr(OPr) 4 ), boric acid (H 3 BO 3 ), sucrose (C 12 H 22 O 11 ), and acetic acid (AcOH). Clearly, it was a non-aqueous solution system at the very beginning of the reactions. Here, AcOH was used as both chemical modifier and solvent to control Zr(OPr) 4 hydrolysis. Actually, AcOH could dominate the hydrolysis by self-produced water of the chemical propulsion, rather than the help of outer water. C 12 H 22 O 11 was selected, since it can be completely decomposed to carbon. Thus, carbon might be accounted precisely for the carbothermal reduction reaction. Furthermore, we investigated the influence of the gelation temperature on the morphology of ZrB 2 particles. Increasing the gelation temperature, the particle shapes changed from sphere-like particles at 65 deg. C to a particle chain at 75 deg. C, and then form rod-like particles at 85 deg. C. An in-depth HRTEM observation revealed that the nanoparticles of ZrB 2 were gradually fused together to evolve into a particle chain, finally into a rod-like shape. These crystalline nature of ZrB 2 related to the gelation temperature obeyed the 'oriented attachment mechanism' of crystallography. - Graphical Abstract: Increasing the gelation temperature, the particle shapes changed from sphere-like particles at 65 deg. C to a particle chain at 75 deg. C, and then form rod-like particles at 85 deg. C. Highlights: → ZrB 2 nanoparticles were synthesized by sol-gel method in an non-aqueous solution system. → AcOH was used as both chemical modifier and solvent to control Zr(OPr) 4 hydrolysis. → C 12 H 22 O 11 was selected since it can be completely decomposed to carbon. → Increasing the gelation temperature, the particles changed from sphere-like to rod-like ones. → Crystalline nature of ZrB 2 obeyed the 'oriented attachment mechanism' of crystallography.

Synthesis of Zr2WP2O12/ZrO2 Composites with Adjustable Thermal Expansion

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Zhiping Zhang

2017-11-01

Full Text Available Zr2WP2O12/ZrO2 composites were fabricated by solid state reaction with the goal of tailoring the thermal expansion coefficient. XRD, SEM and TMA were used to investigate the composition, microstructure, and thermal expansion behavior of Zr2WP2O12/ZrO2 composites with different mass ratio. Relative densities of all the resulting Zr2WP2O12/ZrO2 samples were also tested by Archimedes' methods. The obtained Zr2WP2O12/ZrO2 composites were comprised of orthorhombic Zr2WP2O12 and monoclinic ZrO2. As the increase of the Zr2WP2O12, the relative densities of Zr2WP2O12/ZrO2 ceramic composites increased gradually. The coefficient of thermal expansion of the Zr2WP2O12/ZrO2 composites can be tailored from 4.1 × 10−6 K−1 to −3.3 × 10−6 K−1 by changing the content of Zr2WP2O12. The 2:1 Zr2WP2O12/ZrO2 specimen shows close to zero thermal expansion from 25 to 700°C with an average linear thermal expansion coefficient of −0.09 × 10−6 K−1. These adjustable and near zero expansion ceramic composites will have great potential application in many fields.

Synthesis of Zr2WP2O12/ZrO2 Composites with Adjustable Thermal Expansion.

Science.gov (United States)

Zhang, Zhiping; Sun, Weikang; Liu, Hongfei; Xie, Guanhua; Chen, Xiaobing; Zeng, Xianghua

2017-01-01

Zr 2 WP 2 O 12 /ZrO 2 composites were fabricated by solid state reaction with the goal of tailoring the thermal expansion coefficient. XRD, SEM and TMA were used to investigate the composition, microstructure, and thermal expansion behavior of Zr 2 WP 2 O 12 /ZrO 2 composites with different mass ratio. Relative densities of all the resulting Zr 2 WP 2 O 12 /ZrO 2 samples were also tested by Archimedes' methods. The obtained Zr 2 WP 2 O 12 /ZrO 2 composites were comprised of orthorhombic Zr 2 WP 2 O 12 and monoclinic ZrO 2 . As the increase of the Zr 2 WP 2 O 12 , the relative densities of Zr 2 WP 2 O 12 /ZrO 2 ceramic composites increased gradually. The coefficient of thermal expansion of the Zr 2 WP 2 O 12 /ZrO 2 composites can be tailored from 4.1 × 10 -6 K -1 to -3.3 × 10 -6 K -1 by changing the content of Zr 2 WP 2 O 12 . The 2:1 Zr 2 WP 2 O 12 /ZrO 2 specimen shows close to zero thermal expansion from 25 to 700°C with an average linear thermal expansion coefficient of -0.09 × 10 -6 K -1 . These adjustable and near zero expansion ceramic composites will have great potential application in many fields.

Zr inclusions in actinide—Zr alloys: New data and ideas about how they form

International Nuclear Information System (INIS)

Janney, Dawn E.; O'Holleran, Thomas P.

2015-01-01

High-Zr inclusions are common in actinide—Zr alloys despite phase diagrams indicating that these alloys should not contain a high-Zr phase. The inclusions may contain enough Zr to cause significant differences between bulk compositions and those of inclusion-free areas, leading to possible errors in interpreting data if the inclusions are not considered. This paper presents data from high-Zr inclusions in a complex U—Np—Pu—Am—Zr—RE alloy. It is suggested that the high-Zr inclusions nucleated as high-Zr solid solutions at interfaces with high-actinide RE liquids, then unmixed to form nanometer-scale high-actinide sub-inclusions.

Experimental investigation of the Zr corner of the ternary Zr-Nb-Fe phase diagram

Energy Technology Data Exchange (ETDEWEB)

Granovsky, M.S. E-mail: granovsk@cnea.gov.ar; Canay, M.; Lena, E.; Arias, D

2002-04-01

Intermediate phases in the Zr-rich region of the Zr-Nb-Fe system have been investigated by X-ray diffraction, optical and electron microscopy and electron microprobe analysis. The chemical composition ranges covered by the alloys studied here are: (41-97) at.% Zr, (32-0.9) at.% Nb and (0.6-38) at.% Fe. The phases found in this region were: the solid solutions {alpha}-Zr and {beta}-Zr, the intermetallic Zr{sub 3}Fe with less than 0.2 at.% Nb in solution, two new ternary intermetallic compounds (Zr+Nb){sub 2}Fe '{lambda}{sub 1}' with a cubic Ti{sub 2}Ni-type structure in the composition range (2.4-13) at.% Nb and (31-33) at.% Fe, and (Fe+Nb){sub 2}Zr '{lambda}{sub 2}' indexed as hexagonal Laves phase MgZn{sub 2} type (C14) with a wide range of compositions close to (35-37) at.% Zr, (12-31) at.% Nb and (32-53) at.% Fe.

Experimental investigation of the Zr corner of the ternary Zr-Nb-Fe phase diagram

International Nuclear Information System (INIS)

Granovsky, M.S.; Canay, M.; Lena, E.; Arias, D.

2002-01-01

Intermediate phases in the Zr-rich region of the Zr-Nb-Fe system have been investigated by X-ray diffraction, optical and electron microscopy and electron microprobe analysis. The chemical composition ranges covered by the alloys studied here are: (41-97) at.% Zr, (32-0.9) at.% Nb and (0.6-38) at.% Fe. The phases found in this region were: the solid solutions α-Zr and β-Zr, the intermetallic Zr 3 Fe with less than 0.2 at.% Nb in solution, two new ternary intermetallic compounds (Zr+Nb) 2 Fe 'λ 1 ' with a cubic Ti 2 Ni-type structure in the composition range (2.4-13) at.% Nb and (31-33) at.% Fe, and (Fe+Nb) 2 Zr 'λ 2 ' indexed as hexagonal Laves phase MgZn 2 type (C14) with a wide range of compositions close to (35-37) at.% Zr, (12-31) at.% Nb and (32-53) at.% Fe

A First-Principles Study on the Vibrational and Electronic Properties of Zr-C MXenes

Science.gov (United States)

Wang, Chang-Ying; Guo, Yong-Liang; Zhao, Yuan-Yuan; Zeng, Guang-Li; Zhang, Wei; Ren, Cui-Lan; Han, Han; Huai, Ping

2018-03-01

Within the framework of density functional theory calculations, the structural, vibrational, and electronic properties of Zr n C n - 1 (n = 2, 3, and 4) and their functionalized MXenes have been investigated. We find that the most stable configurations for Zr-C MXene are the ones that the terminal groups F, O, and OH locate on the common hollow site of the superficial Zr layer and its adjacent C layer. F and OH-terminated Zr 3 C 2 and Zr 4 C 3 have small imaginary acoustic phonon branches around Γ point while the others have no negative phonon modes. The pristine MXenes (Zr 2 C, Zr 3 C 2 and Zr 4 C 3 ) are all metallic with large DOS contributed by the Zr atom at the Fermi energy. When functionalized by F, O and OH, new hybridization states appear and the DOS at the Fermi level are reduced. Moreover, we find that their metallic characteristic increases with an increase in n. For (Zr n C n - 1 )O 2, Zr 2 CO 2 is a semiconductor, Zr 3C2O2 is a semimetal, and Zr 4 C 3O2 becomes a metal. Supported by the National Natural Science Foundation of China under Grant Nos. 11605273, 21571185, U1404111, 11504089, 21501189, 21676291, the Shanghai Municipal Science and Technology Commission 16ZR1443100, the Strategic Priority Research Program of the Chinese Academy of Sciences (XDA02040104)

Effect of ZrB{sub 2} particles on the microstructure and mechanical properties of hybrid (ZrB{sub 2} + Al{sub 3}Zr)/AA5052 insitu composites

Energy Technology Data Exchange (ETDEWEB)

Gautam, Gaurav, E-mail: gauravgautamm1988@gmail.com; Mohan, Anita, E-mail: amohan.app@iitbhu.ac.in

2015-11-15

Present study outlines the effect of ZrB{sub 2} particles variation on the morphology and mechanical properties of (ZrB{sub 2}+Al{sub 3}Zr)/AA5052Al alloy composites. Composites with varying amount of ZrB{sub 2} particles have been produced by direct melt reaction (DMR) technique. These composites have been characterized by X-ray diffractometer (XRD) and energy-dispersive spectroscopy (EDS) to confirm the presence of ZrB{sub 2} and Al{sub 3}Zr particles. Optical microscopy (OM) and scanning-electron microscopy (SEM) have been used to understand the morphology. To see the effect of ZrB{sub 2} variation on mechanical properties, hardness and tensile properties have been evaluated. The XRD and EDS results confirm the successful formation of ZrB{sub 2} particles in matrix of AA5052Al alloy. SEM and TEM studies exhibit that ZrB{sub 2} particles are mostly in hexagonal and some rectangular shape while Al{sub 3}Zr particles are in polyhedron and rectangular shapes. Most of ZrB{sub 2} particles are within a size range of 10–190 nm. Interface region is free of any impurity. OM studies show grain refinement of AA5052Al alloy matrix with formation of second phase ZrB{sub 2} particles. Tensile results indicate that the UTS and YS improve up to 3 vol.% of ZrB{sub 2} but beyond this composition a decreasing trend is observed. The strength coefficient increases with increase in ZrB{sub 2} particles up to 3 vol.% in the Al{sub 3}Zr/Al alloy composites, whereas strain hardening decreases. While beyond 3 vol.% ZrB{sub 2} particles in the Al{sub 3}Zr/Al alloy composite, opposite trend is observed in strength coefficient and strain hardening. Percentage elongation also improves with 1vol.% ZrB{sub 2}, but further addition of ZrB{sub 2} shows an adverse effect. However, a continuous increasing trend has been observed in bulk hardness. Fracture studies show facets of Al{sub 3}Zr particles and dimples of matrix, but with inclusion of ZrB{sub 2} dimple size decreases. Increase in Zr

Calculation of Gibbs energy of Zr-Al-Ni, Zr-Al-Cu, Al-Ni-Cu and Zr-Al-Ni-Cu liquid alloys based on quasiregular solution model

International Nuclear Information System (INIS)

Li, H.Q.; Yang, Y.S.; Tong, W.H.; Wang, Z.Y.

2007-01-01

With the effects of electronic structure and atomic size being introduced, the mixing enthalpy as well as the Gibbs energy of the ternary Zr-Al-Cu, Ni-Al-Cu, Zr-Ni-Al and quaternary Zr-Al-Ni-Cu systems are calculated based on quasiregular solution model. The computed results agree well with the experimental data. The sequence of Gibbs energies of different systems is: G Zr-Al-Ni-Cu Zr-Al-Ni Zr-Al-Cu Cu-Al-Ni . To Zr-Al-Cu, Ni-Al-Cu and Zr-Ni-Al, the lowest Gibbs energy locates in the composition range of X Zr 0.39-0.61, X Al = 0.38-0.61; X Ni = 0.39-0.61, X Al = 0.38-0.60 and X Zr = 0.32-0.67, X Al = 0.32-0.66, respectively. And to the Zr-Ni-Al-Cu system with 66.67% Zr, the lowest Gibbs energy is obtained in the region of X Al = 0.63-0.80, X Ni = 0.14-0.24

Influence of the electrical power applied to the target on the optical and structural properties of ZrON films produced via RF magnetron sputtering in a reactive atmosphere

International Nuclear Information System (INIS)

Pinzón, M.J.; Alfonso, J.E.; Olaya, J.J.; Cubillos, G.I.; Romero, E.

2014-01-01

The influence of the variation of electrical power applied to the target on the morphology and optical properties of zirconium oxynitride - zirconium oxide (ZrON) films deposited via RF magnetron sputtering on common glass substrates in a reactive atmosphere of N 2 /O 2 , with a flow ratio ΦN 2 /ΦO 2 of 1.25 was investigated. The crystallographic structure of the films was established through X-ray diffraction (XRD), the morphology was evaluated through scanning electron microscopy (SEM) and atomic force microscopy (AFM), and the optical behavior was evaluated through transmittance measurements. The XRD analysis showed that the films grew with mixed crystalline structures: monoclinic (ZrO 2 ) and body-centered cubic (Zr 2 ON 2 ). SEM analysis showed that the films grew with a homogeneous morphology, and AFM results established that as the electrical power applied to the target increased, there were changes in the grain size and the roughness of the films. The thickness, refractive index, and absorption coefficient of the films were calculated using the values of the transmittance through the Swanepoel method. Additionally, the energy band gap was determined via analysis of the free interference region. - Highlights: • We growth zirconium oxynitride films by RF magnetron sputtering in reactive atmosphere. • We determine the influence of the electrical power applied at the target in optical and structural properties. • We determine the crystallite size, grain size and roughness of the zirconium oxynitride films. • We determine the optical parameters such refractive index of the zirconium oxynitride films through Swanepoel method. • We calculated the absorption coefficient and optical band gap of the zirconium oxynitride films

Influence of the electrical power applied to the target on the optical and structural properties of ZrON films produced via RF magnetron sputtering in a reactive atmosphere

Energy Technology Data Exchange (ETDEWEB)

Pinzón, M.J. [Grupo de Ciencia de Materiales y Superficies, Departamento de Física, Universidad Nacional de Colombia, AA 14490 Bogotá (Colombia); Alfonso, J.E., E-mail: jealfonsoo@unal.edu.co [Grupo de Ciencia de Materiales y Superficies, Departamento de Física, Universidad Nacional de Colombia, AA 14490 Bogotá (Colombia); Olaya, J.J. [Grupo de Ciencia de Materiales y Superficies, Departamento de Física, Universidad Nacional de Colombia, AA 14490 Bogotá (Colombia); Cubillos, G.I.; Romero, E. [Grupo de Materiales y Procesos Químicos, Universidad Nacional de Colombia, AA 14490 Bogotá (Colombia)

2014-12-01

The influence of the variation of electrical power applied to the target on the morphology and optical properties of zirconium oxynitride - zirconium oxide (ZrON) films deposited via RF magnetron sputtering on common glass substrates in a reactive atmosphere of N{sub 2}/O{sub 2}, with a flow ratio ΦN{sub 2}/ΦO{sub 2} of 1.25 was investigated. The crystallographic structure of the films was established through X-ray diffraction (XRD), the morphology was evaluated through scanning electron microscopy (SEM) and atomic force microscopy (AFM), and the optical behavior was evaluated through transmittance measurements. The XRD analysis showed that the films grew with mixed crystalline structures: monoclinic (ZrO{sub 2}) and body-centered cubic (Zr{sub 2}ON{sub 2}). SEM analysis showed that the films grew with a homogeneous morphology, and AFM results established that as the electrical power applied to the target increased, there were changes in the grain size and the roughness of the films. The thickness, refractive index, and absorption coefficient of the films were calculated using the values of the transmittance through the Swanepoel method. Additionally, the energy band gap was determined via analysis of the free interference region. - Highlights: • We growth zirconium oxynitride films by RF magnetron sputtering in reactive atmosphere. • We determine the influence of the electrical power applied at the target in optical and structural properties. • We determine the crystallite size, grain size and roughness of the zirconium oxynitride films. • We determine the optical parameters such refractive index of the zirconium oxynitride films through Swanepoel method. • We calculated the absorption coefficient and optical band gap of the zirconium oxynitride films.

Magnetic properties of FeZr{sub 2} and Fe{sub 2}Zr intermetallic compounds

Energy Technology Data Exchange (ETDEWEB)

Prajapat, C. L., E-mail: prajapat@barc.gov.in; Singh, M. R.; Mishra, P. K. [Technical Physics Division, Bhabha Atomic Research Centre, Mumbai, INDIA-400085 (India); Chattaraj, D. [Product Development Division, Bhabha Atomic Research Centre, Mumbai, INDIA-400085 (India); Mishra, R. [Chemistry Division, Bhabha Atomic Research Centre, Mumbai, INDIA-400085 (India); Ravikumar, G. [Scientific Information Resources Division, Bhabha Atomic Research Centre, Mumbai, INDIA-400085 (India)

2016-05-23

Magnetic properties of Fe-Zr system, viz., FeZr{sub 2} and Fe{sub 2}Zr have been studied. Both the compounds show soft ferromagnetic behavior. Curie temperature is well above the room temperature. Lower saturation magnetization for the zirconium rich sample, FeZr{sub 2}, could be due to possible donation of electrons from the Zr-rich neighbors to Fe atoms or diminution of long range magnetic order by defects.

Aqueous corrosion behaviour of Zr-1 Nb and Zr-20 Nb with different heat treatments

International Nuclear Information System (INIS)

Jaime Solis, F.; Bordoni, Roberto; Olmedo, Ana M.; Villegas, Marina; Miyagusuku, Marcela

2003-01-01

The corrosion behaviour of Zr-1 Nb and Zr-20 Nb coupons annealed at 850 C degrees during 1 hour and afterwards aged at different temperatures and time periods was studied. The Zr-1 Nb samples were aged at 400 and 500 C degrees and the Zr-20 Nb samples at 265 and 550 C degrees. The results have shown that ageing increases the corrosion resistance because the aged microstructure is somewhat closer to the equilibrium one. This was not the case of Zr-1 Nb aged 72 hs at 400 C degrees. The presence of the ω-phase does not have a deleterious effect in the corrosion behaviour of Zr-20 Nb. Also, an ageing of 2200 h at 265 C degrees induced a relevant decrease in the corrosion rate of Zr-20 Nb indicating a decomposition of the β- Zr phase. This effect was observed at the inlet of pressure tubes in CANDU reactors. The results obtained will be used to establish the relative importance of the α-Zr and β-Zr phases in the corrosion behaviour of pressure tubes. (author)

New results in low-energy fusion of 40Ca+Zr,9290

Science.gov (United States)

Stefanini, A. M.; Montagnoli, G.; Esbensen, H.; Čolović, P.; Corradi, L.; Fioretto, E.; Galtarossa, F.; Goasduff, A.; Grebosz, J.; Haas, F.; Mazzocco, M.; Soić, N.; Strano, E.; Szilner, S.

2017-07-01

Background: Near- and sub-barrier fusion of various Ca + Zr isotopic combinations have been widely investigated. A recent analysis of 40Ca+96Zr data has highlighted the importance of couplings to multiphonon excitations and to both neutron and proton transfer channels. Analogous studies of 40Ca+90Zr tend to exclude any role of transfer couplings. However, the lowest measured cross section for this system is rather high (840 μ b ). A rather complete data set is available for 40Ca+94Zr , while no measurement of 40Ca+92Zr fusion has been performed in the past. Purpose: Our aim is to measure the full excitation function of 40Ca+92Zr near the barrier and to extend downward the existing data on 40Ca+90Zr , in order to estimate the transfer couplings that should be used in coupled-channels calculations of the fusion of these two systems and of 40Ca+94Zr . Methods: 40Ca beams from the XTU Tandem accelerator of INFN-Laboratori Nazionali di Legnaro were used, bombarding thin metallic 90Zr (50 μ g /cm2 ) and 92ZrO2 targets (same thickness) enriched to 99.36 % and 98.06 % in masses 90 and 92, respectively. An electrostatic beam deflector allowed the detection of fusion evaporation residues (ER) at very forward angles, and angular distributions of ER were measured. Results: The excitation function of 40Ca+92Zr has been measured down to the level of ≃60 μ b . Coupled-channels (CC) calculations using a standard Woods-Saxon (WS) potential and following the line of a previous analysis of 40Ca+96Zr fusion data give a good account of the new data, as well as of the existing data for 40Ca+94Zr . The previous excitation function of 40Ca+90Zr has been extended down to 40 μ b . Conclusions: Transfer couplings play an important role in explaining the fusion data for 40Ca+92Zr and 40Ca+94Zr . The strength of the pair-transfer coupling is deduced by applying a simple recipe based on the value obtained for 40Ca+96Zr . The logarithmic slopes and the S factors for fusion are reproduced

Laser cladding of Zr on Mg for improved corrosion properties

International Nuclear Information System (INIS)

Subramanian, R.; Sircar, S.; Mazumder, J.

1989-01-01

This paper reports the results of laser cladding of Mg-2wt%Zr, and Mg-5wt%Zr powder mixture onto magnesium. The microstructure of the laser clad was studied. From the microstructural study, the epitaxial regrowth of the clad region on the underlying substrate was observed. Martensite plates of different size were observed in transmission electron microscope for MG-2wt%Zr and Mg-5wt%Zr laser clad. The corrosion properties of the laser clad were evaluated in sea water (3.5% NaCl). The position of the laser claddings in the galvanic series of metals in sea water, the anodic polarization characteristics of the laser claddings and the protective nature and the stability of the passivating film formed have been determined. The formation of pits on the surface of the laser clad subjected to corrosion is reported. The corrosion properties of the laser claddings are compared with that of the commercially used magnesium alloy AZ91B

Evolution of Zr/Hf/Zr trilayers during annealing studied by RBS

International Nuclear Information System (INIS)

Kling, A.; Soares, J.C.

2010-01-01

The Zr/Hf system is highly interesting due its various applications, e.g. formation of amorphous ternary alloys, superconductive properties and production of gate oxide layers with high dielectric coefficients by oxidation of Zr/Hf multilayers. In this work Zr/Hf/Zr trilayers with an individual layer thickness of approximately 50 nm were deposited by electron gun evaporation on a substrate consisting of silicon covered by a micrometer thick thermal oxide layer. Samples were subjected to annealing procedures at 500 and 1200 o C in flowing air atmosphere to promote oxidation and Zr/Hf interdiffusion effects. RBS studies of the as-deposited and annealed samples were performed at the van-de-Graaff accelerator of ITN using He + and H + beams with energies between 2.0 and 2.525 MeV in order to study compositional changes induced by the heat treatment. In the case of low-temperature annealing the layer system appears, besides the oxidation process starting from the surface, to be stable. On the other hand, high-temperature annealing leads to an asymmetric Hf-diffusion into the surface and interior Zr-layer provoked by anomalous diffusion due to a phase transition in Zr accompanied by an almost complete oxidation of the layer structure Oxygen and metal depth distributions obtained by RBS in the as-deposited and treated samples are provided.

Zirconium Zr and hafnium Hf

International Nuclear Information System (INIS)

Busev, A.I.; Tiptsova, V.G.; Ivanov, V.M.

1978-01-01

The basic methods for extracting and determining Zr(4) and Hf(4) are described. Diantipyrinemethane and its alkyl homologs selectively extract Zr and Hf from HNO 3 solutions in the presence of nitrates. Zr is selectively extracted with tetraethyldiamide of heptyl phosphoric acid (in benzene) as well as with 2-thenoyltrifluoroacetone (in an acid). The latter reagents is suitable for rapid determination of 95 Zr in a mixture with 95 Nb and other fragments. The complexometric determination of Zr is based on formation of a stable complex of Zr with EDTA. The titration is carried out in the presence of n-sulfobenzene-azo-pyrocatechol, eriochrome black T. The determination is hindered by Hf, fluoride-, phosphate-, oxalate- and tartrate-ions. The method is used for determining Zr in zircon and eudialyte ore. Zr is determined photometrically with the aid of xylenol orange, arsenazo 3 and pyrocatechol violet (in phosphorites). Hf is determined in the presence of Zr photometrically with the aid of xylenol orange or methyl-thymol blue. The method is based on Zr being masked with hydrogen peroxide in the presence of sulfate-ions

ZrC zone structure and features of electronic structure of solid solutions on the base ZrC, ZrN, TiC and TiN

International Nuclear Information System (INIS)

Mokhracheva, L.P.; Gel'd, P.V.; Tskhaj, V.A.

1983-01-01

The results of ZrC zone structure calculation conducted using the strong bond method in the three-centre variant are given. Essentially higher degree of M-C chemical bond ionicity than in TiC is shown to take place for it. Solid solution formation in TiC-ZrC, TiN-ZrC and ZrC-ZrN systems differing from TiC-TiN, TiN-ZrN and TiC-TiN is stated to be followed by essential deformation of component zone structures that, obviously, should prevent formation of solid solutions without vacancies in sublatices in these systems

Giant magnetoresistance effect in CoZr/Cu/Co spin-valve films (abstract)

Energy Technology Data Exchange (ETDEWEB)

Ben-Youssef, J. [CNRS-LMIMS, 92195 Meudon-Bellevue (France)]|[LPM Universite Mohammed V, Rabat (Morocco); Koshkina, O.; Le Gall, H. [CNRS-LMIMS, 92195 Meudon-Bellevue (France); Harfaoui, M.E. [LPMC Universite Ibn Tofail Kenitra (Morocco); Bouziane, K. [CNRS-LMIMS, 92195 Meudon-Bellevue (France); Yamani, M.E. [LPM Universite Mohammed V, Rabat (Morocco); Desvignes, J.M. [CNRS-LMIMS, 92195 Meudon-Bellevue (France)

1997-04-01

A high sensitivity of giant magnetoresistance (GMR) has been observed recently from soft magnetic layers such as NiFe, NiFeCo, and FeCoB. Amorphous CoZr alloys present ultrasoft properties compared to NiFe. GMR has been investigated for amorphous CoZr/Cu/Co thin films grown by rf diode sputtering using a target consisting of a Co disk partially covered with a Zr foil. The influence of the argon pressure on Cu layer deposition, Cu thickness, and Zr content on magnetic and transport properties was analyzed. The highest value of transverse GMR obtained along the easy axis is 3.6{percent} and the MR curve was saturated in a magnetic field of 100 Oe at room temperature. GMR shows scaling behavior with the sample composition. Very high sensitivity, around 1{endash}2{percent}/Oe was observed in a CoZr (3 nm)/Cu (3 nm)/Co (2 nm) sandwich. This study shows a large dependence of GMR on Cu thickness and the maximum of magnetoresistance strongly depending on the Ar pressure which modifies the interface roughness. The Zr content also influences the magnetotransport properties ({Delta}R/R and {Delta}R/R{Delta}H). The difference in coercivity between soft magnetic CoZr and hard magnetic Co layers induces antiferromagnetic alignment. Therefore a high MR ratio and field sensitivity are achieved by improving the magnetic properties of the CoZr layer.{copyright} {ital 1997 American Institute of Physics.}

Electrochemical characterization of Zr-based thin film metallic glass in hydrochloric aqueous solution

International Nuclear Information System (INIS)

Chuang, Ching-Yen; Liao, Yi-Chia; Lee, Jyh-Wei; Li, Chia-Lin; Chu, Jinn P.; Duh, Jenq-Gong

2013-01-01

Recently thin film metallic glass represents a class of promising engineering materials for structural applications. In this work, the Zr-based thin film metallic glass (TFMG) was fabricated on the Si and AISI 420 substrates using a Zr–Cu–Ni–Al alloy and pure Zr metal targets by a pulsed DC magnetron sputtering system. The chemical compositions, crystalline structures, microstructures and corrosion behavior in hydrochloric (HCl) aqueous solutions of Zr-based TFMGs were investigated. The results showed that the surface morphologies of Zr-based TFMG were very smooth. A compact and dense structure without columnar structure was observed. The amorphous structure of Zr-based TFMG was characterized by the X-ray diffractometer and transmission electron microscopy analyses. After the potentiodynamic polarization test, the better corrosion resistance was achieved for the Zr-based TFMG coated AISI 420 in 1 mM HCl aqueous solution. Based on the surface morphologies and chemical analysis results of the corroded surfaces, the pitting, crevice corrosion and filiform corrosion were found. The corrosion mechanisms of the Zr-based TFMG were discussed in this work. - Highlights: ► Zr-based thin film metallic glass with amorphous structure. ► Better corrosion resistance of Zr-based thin film metallic glass observed. ► Pitting, crevice and filiform corrosion reactions revealed. ► The Cu-rich corrosion products found in the pit. ► Nanowire and flaky corrosion products formed adjacent to the filiform corrosion path

Selective sorption of lead, cadmium and zinc ions by a polymeric cation exchanger containing nano-Zr(HPO3S)2.

Science.gov (United States)

Zhang, Qingrui; Pan, Bingcai; Pan, Bingjun; Zhang, Weiming; Jia, Kun; Zhang, Quanxing

2008-06-01

A novel polymeric hybrid sorbent, namely ZrPS-001, was fabricated for enhanced sorption of heavy metal ions by impregnating Zr(HPO3S)2 (i.e., ZrPS) nanoparticles within a porous polymeric cation exchanger D-001. The immobilized negatively charged groups bound to the polymeric matrix D-001 would result in preconcentration and permeation enhancement of target metal ions prior to sequestration, and ZrPS nanoparticles are expected to sequester heavy metals selectively through an ion-exchange process. Highly effective sequestration of lead, cadmium, and zinc ions from aqueous solution can be achieved by ZrPS-001 even in the presence of competing calcium ion at concentration several orders of magnitude greater than the target species. The exhausted ZrPS-001 beads are amenable to regeneration with 6 M HCI solution for repeated use without any significant capacity loss. Fixed-bed column treatment of simulated waters containing heavy metals at high or trace levels was also performed. The content of heavy metals in treated effluent approached or met the WHO drinking water standard.

Structure of zirconium-93 and zirconium-91 as shown by the reactions Zr-92(d,p)Zr-93 and Zr-92(d,t)Zr-91

Science.gov (United States)

Baron, N.; Leonard, R. F.; Stewart, W. M.; Fink, C. L.; Christensen, P. R.; Nickles, J.; Thorsteinsen, T. F.

1972-01-01

Deuterons of 13-MeV incident energy were scattered from Zr-92(d,p)Zr-93. The Zr-92(d,p)Zr-93 data analysis resulted in the location of 47 levels up to an excitation energy of 4.84 MeV, and the spins of 43 of these levels were identified. Essentially all the strength of the 2d5/2, 3s1/2, 2d3/2, and 1g7/2 shells was observed; and the excitation energy of their centroids was computed to be 0.00, 1.21, 2.23, and 2.37 MeV, respectively. Also, 43 percent of the 1h11/2 strength, 21 percent of the 2f7/2 strength, and 3 percent of the 3p3/2 strength were observed. In addition, the Zr-92(d,t)Zr-91 data analysis resulted in the location of 26 levels up to an excitation energy of 4.01 MeV, and the spins of 21 of these levels were identified. Most of the expected strength of the 2d5/2 and 1g9/2 shells was obtained, and the excitation energy of their centroids was computed to be 0.31 and 3.19 MeV, respectively. In addition, six l=1 states are populated belonging to either the 2p1/2 or 2p3/2 shells.

Structural study of Zr-based metallic glasses

International Nuclear Information System (INIS)

Matsubara, E.; Ichitsubo, T.; Saida, J.; Kohara, S.; Ohsumi, H.

2007-01-01

Structures of Zr 70 Ni 20 Al 10 , Zr 70 Cu 20 Al 10 , Zr 70 Cu 30 and Zr 70 Ni 30 amorphous alloys were analyzed by high-energy X-ray diffraction. The relatively stable Zr 2 Cu amorphous alloy shows a local atom arrangement different from the Zr 2 Cu crystalline phase. By contrast, the less stable Zr 70 Ni 30 amorphous alloy has a structure similar to Zr 2 Ni. In the Zr 70 Cu 20 Al 10 metallic glass, Zr-Al nearest neighbor pairs are introduced in the amorphous structure. In the Zr 70 Ni 20 Al 10 metallic glass, the strong correlation between Zr-Ni pairs is drastically modified by the formation of Zr-Al pairs. The presence of Zr-Al pairs in the ternary alloys suppresses the crystallization and stabilizes the glassy state

Direct flow separation strategy, to isolate no-carrier-added {sup 90}Nb from irradiated Mo or Zr targets

Energy Technology Data Exchange (ETDEWEB)

Radchenko, Valery; Roesch, Frank [Mainz Univ. (Germany). Inst. of Nuclear Chemistry; Filosofov, Dmitry V.; Dadakhanov, Jakhongir [Joint Institute of Nuclear Research, Dubna (Russian Federation). Dzhelepov Laboratory of Nuclear Problems; Karaivanov, Dimitar V. [Joint Institute of Nuclear Research, Dubna (Russian Federation). Dzhelepov Laboratory of Nuclear Problems; Bulgarian Academy of Sciences, Sofia (Bulgaria). Inst. for Nuclear Research and Nuclear Energy; Marinova, Atanaska [Joint Institute of Nuclear Research, Dubna (Russian Federation). Dzhelepov Laboratory of Nuclear Problems; Sofia Univ. (Bulgaria). Faculty of Chemistry and Pharmacy; Baimukhanova, Ayagoz [Joint Institute of Nuclear Research, Dubna (Russian Federation). Dzhelepov Laboratory of Nuclear Problems; Institute of Nuclear Physics of the Republic of Kazakhstan, Almaty (Kazakhstan)

2016-11-01

{sup 90}Nb has an intermediate half-life of 14.6 h, a high positron branching of 53% and optimal β{sup +} emission energy of only E{sub mean} 0.35 MeV per decay. These favorable characteristics suggest it may be a potential candidate for application in immuno-PET. Our recent aim was to conduct studies on distribution coefficients for Zr{sup IV} and Nb{sup V} in mixtures of HCl/H{sub 2}O{sub 2} and HCl/oxalic acid for anion exchange resin (AG 1 x 8) and UTEVA resin to develop a ''direct flow'' separation strategy for {sup 90}Nb. The direct flow concept refers to a separation accomplished using a single eluent on multiple columns, effectively streamlining the separation process and increasing the time efficiency. Finally, we also demonstrated that this separation strategy is applicable to the production of the positron emitter {sup 90}Nb via the irradiation of molybdenum targets and isolation of {sup 90}Nb from the irradiated molybdenum target.

Influence of the silicon concentration on the optical and electrical properties of reactively sputtered Zr-Si-N nanocomposite coatings

International Nuclear Information System (INIS)

Pilloud, D.; Pierson, J.F.; Pichon, L.

2006-01-01

Zr-Si-N films were deposited on silicon and X38CrMoV5 steel substrates by sputtering composite Zr-Si targets in reactive Ar-N 2 mixture. The silicon concentration in the deposited films was adjusted by the variation of the number of Si chips located on the target erosion zone. As a function of the silicon content, the films exhibited the following structures: insertion of Si into the ZrN lattice, nanocomposite (nc-ZrN/a-SiN x ) and an amorphous-like structure. Addition of silicon into ZrN-based coatings induced a lost of the golden aspect due to the decrease of the metallic behaviour. This result was confirmed by ellipsometric measurements. The films refractive index increased with the silicon concentration. On the other hand, a continuous decrease of the extinction coefficient was noticed. The effect of the silicon content on the optical properties of Zr-Si-N films was discussed as a function of the films structure and the occurrence of new optical absorptions due to the silicon chemical bonds. Finally, the evolution of the films electrical resistivity was discussed in connection to the films structure changes

Thermodynamic modeling of the Pt-Zr system

International Nuclear Information System (INIS)

Gao Yongliang; Guo Cuiping; Li Changrong; Du Zhenmin

2010-01-01

By means of the CALPHAD (CALculation of PHAse Diagram) technique, the Pt-Zr system was critically assessed. The solution phases (liquid, bcc, fcc and hcp) are described with the substitutional model. The intermetallic compounds Pt 4 Zr, Pt 4 Zr 3 , αPtZr and Pt 3 Zr 5 are treated as the formula (Pt,Zr) m (Pt,Zr) n by a two-sublattice model with the elements Pt and Zr on the first and the second sublattices, respectively. A two-sublattice model (Pt,Zr) 0.5 (Pt,Zr) 0.5 is applied to describe the compound βPtZr with CsCl-type structure (B2) in order to cope with the order-disorder transition between bcc solution (A2) and βPtZr (B2). Another two-sublattice model (Pt,Zr) 0.75 (Pt,Zr) 0.25 with Ni 3 Ti-type structure (D0 24 ) is applied to describe the compound Pt 3 Zr in order to cope with the order-disorder transition between hexagonal close-packed (A3) and Pt 3 Zr (D0 24 ). The compound Pt 10 Zr 7 is treated as a stoichiometric compound. A set of self-consistent thermodynamic parameters of the Pt-Zr system was obtained. (orig.)

Positron emission tomography imaging of CD105 expression with {sup 89}Zr-Df-TRC105

Energy Technology Data Exchange (ETDEWEB)

Hong, Hao; Yang, Yunan [University of Wisconsin - Madison, Department of Radiology, Madison, WI (United States); Severin, Gregory W.; Engle, Jonathan W.; Zhang, Yin; Barnhart, Todd E.; Nickles, Robert J. [University of Wisconsin - Madison, Department of Medical Physics, Madison, WI (United States); Liu, Glenn [University of Wisconsin - Madison, Department of Medicine, Madison, WI (United States); University of Wisconsin Carbone Cancer Center, Madison, WI (United States); Leigh, Bryan R. [TRACON Pharmaceuticals, Inc, San Diego, CA (United States); Cai, Weibo [University of Wisconsin - Madison, Department of Radiology, Madison, WI (United States); University of Wisconsin - Madison, Department of Medical Physics, Madison, WI (United States); University of Wisconsin Carbone Cancer Center, Madison, WI (United States)

2012-01-15

High tumor microvessel density correlates with a poor prognosis in multiple solid tumor types. The clinical gold standard for assessing microvessel density is CD105 immunohistochemistry on paraffin-embedded tumor specimens. The goal of this study was to develop an {sup 89}Zr-based PET tracer for noninvasive imaging of CD105 expression. TRC105, a chimeric anti-CD105 monoclonal antibody, was conjugated to p-isothiocyanatobenzyl-desferrioxamine (Df-Bz-NCS) and labeled with {sup 89}Zr. FACS analysis and microscopy studies were performed to compare the CD105 binding affinity of TRC105 and Df-TRC105. PET imaging, biodistribution, blocking, and ex-vivo histology studies were performed on 4T1 murine breast tumor-bearing mice to evaluate the pharmacokinetics and tumor-targeting of {sup 89}Zr-Df-TRC105. Another chimeric antibody, cetuximab, was used as an isotype-matched control. FACS analysis of HUVECs revealed no difference in CD105 binding affinity between TRC105 and Df-TRC105, which was further validated by fluorescence microscopy. {sup 89}Zr labeling was achieved with high yield and specific activity. Serial PET imaging revealed that the 4T1 tumor uptake of {sup 89}Zr-Df-TRC105 was 6.1 {+-} 1.2, 14.3 {+-} 1.2, 12.4 {+-} 1.5, 7.1 {+-} 0.9, and 5.2 {+-} 0.3 %ID/g at 5, 24, 48, 72, and 96 h after injection, respectively (n = 4), higher than all organs starting from 24 h after injection, which provided excellent tumor contrast. Biodistribution data as measured by gamma counting were consistent with the PET findings. Blocking experiments, control studies with {sup 89}Zr-Df-cetuximab, and ex-vivo histology all confirmed the in vivo target specificity of {sup 89}Zr-Df-TRC105. We report here the first successful PET imaging of CD105 expression with {sup 89}Zr as the radiolabel. Rapid, persistent, CD105-specific uptake of {sup 89}Zr-Df-TRC105 in the 4T1 tumor was observed. (orig.)

First principles and phonon calculations of ZrCo and ZrCo-H systems

International Nuclear Information System (INIS)

Chattaraj, D.; Parida, S.C.; Dash, Smruti; Majumder, C.

2012-01-01

The intermetallic ZrCo is a potential material for the storage and release of hydrogen isotopes because of its high gravimetric capacity and its low hydrogen equilibrium pressure. This intermetallic is a proposed material for the safe storage, supply and delivery of hydrogen isotope in the ITER project. To investigate the suitability of ZrCo as a getter material for the storage of hydrogen isotope it is essential to know in detail the structure-property relationships in both ZrCo and its hydride. Hence, in this study, we have investigated the structural, electronic, vibrational and thermodynamic properties of ZrCo and ZrCoH 3 using the first principles and phonon calculations

Structural study of Zr-based metallic glasses

Energy Technology Data Exchange (ETDEWEB)

Matsubara, E. [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan)]. E-mail: e.matsubara@materials.mbox.media.kyoto-u.ac.jp; Ichitsubo, T. [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan); Saida, J. [Center of Interdisciplinary Research, Tohoku University, Sendai 980-8578 (Japan); Kohara, S. [JASRI, SPring-8, Sayo-gun, Hyogo 679-5198 (Japan); Ohsumi, H. [JASRI, SPring-8, Sayo-gun, Hyogo 679-5198 (Japan)

2007-05-31

Structures of Zr{sub 70}Ni{sub 20}Al{sub 10}, Zr{sub 70}Cu{sub 20}Al{sub 10}, Zr{sub 70}Cu{sub 30} and Zr{sub 70}Ni{sub 30} amorphous alloys were analyzed by high-energy X-ray diffraction. The relatively stable Zr{sub 2}Cu amorphous alloy shows a local atom arrangement different from the Zr{sub 2}Cu crystalline phase. By contrast, the less stable Zr{sub 70}Ni{sub 30} amorphous alloy has a structure similar to Zr{sub 2}Ni. In the Zr{sub 70}Cu{sub 20}Al{sub 10} metallic glass, Zr-Al nearest neighbor pairs are introduced in the amorphous structure. In the Zr{sub 70}Ni{sub 20}Al{sub 10} metallic glass, the strong correlation between Zr-Ni pairs is drastically modified by the formation of Zr-Al pairs. The presence of Zr-Al pairs in the ternary alloys suppresses the crystallization and stabilizes the glassy state.

NATURAL BARRIERS TARGETED THRUST FY 2004 PROJECTS

International Nuclear Information System (INIS)

NA

2005-01-01

This booklet contains project descriptions of work performed by the Department of Energy (DOE), Office of Civilian Radioactive Waste Management (OCRWM), Office of Science and Technology and International's (OSTandI) Natural Barriers Targeted Thrust during Fiscal Year (FY) 2004. The Natural Barriers Targeted Thrust is part of OSTandI's Science and Technology Program which supports the OCRWM mission to manage and dispose of high-level radioactive waste and spent nuclear fuel in a manner that protects health, safety, and the environment; enhances national and energy security; and merits public confidence. In general, the projects described will continue beyond FY 2004 assuming that the technical work remains relevant to the proposed Yucca Mountain Repository and sufficient funding is made available to the Science and Technology Program

Zr-ZrO sub 2 cermet solar coatings designed by modelling calculations and deposited by dc magnetron sputtering

CERN Document Server

Zhang Qi Chu; Lee, K D; Shen, Y G

2003-01-01

High solar performance Zr-ZrO sub 2 cermet solar coatings were designed using a numerical computer model and deposited experimentally. The layer thickness and Zr metal volume fraction for the Zr-ZrO sub 2 cermet solar selective coatings on a Zr or Al reflector with a surface ZrO sub 2 or Al sub 2 O sub 3 anti-reflection layer were optimized to achieve maximum photo-thermal conversion efficiency at 80 deg. C under concentration factors of 1-20 using the downhill simplex method in multi-dimensions in the numerical calculation. The dielectric function and the complex refractive index of Zr-ZrO sub 2 cermet materials were calculated using Sheng's approximation. Optimization calculations show that Al sub 2 O sub 3 /Zr-ZrO sub 2 /Al solar coatings with two cermet layers and three cermet layers have nearly identical solar absorptance, emittance and photo-thermal conversion efficiency that are much better than those for films with one cermet layer. The optimized Al sub 2 O sub 3 /Zr-ZrO sub 2 /Al solar coating film w...

Microstructural evolution of Ni40Zr60 alloy during early stage of mechanical alloying of intermetallic compounds NiZr2 and Ni11Zr9

International Nuclear Information System (INIS)

Lee Peeyew; Koch, C.C.

1994-01-01

The microstructural change of Ni 40 Zr 60 alloy during mechanical alloying of mixtures of the intermetallic compounds NiZr 2 and Ni 11 Zr 9 has been studied by transmission electron microscopy. A specific ''cauliflower'' phase was formed during early stage of mechanical alloying process. It is suggested that the solid state reaction between intermetallic compounds NiZr 2 and Ni 11 Zr 9 is not the only origin for the formation of the ''cauliflower'' phase. ((orig.))

Structural, electrical and optical properties of nanostructured ZrO2 thin film deposited by SILAR method

Science.gov (United States)

Salodkar, R. V.; Belkhedkar, M. R.; Nemade, S. D.

2018-05-01

Successive Ionic Layer Adsorption and Reaction (SILAR) method has been employed to deposit nanocrystalline ZrO2 thin film of thickness 91 nm onto glass substrates using ZrOCl2.8H2O and NaOH as cationic and anionic precursors respectively. The structural and surface morphological characterizations have been carried out by means of X-ray diffraction and field emission scanning electron microscopy confirms the nanocrystalline nature of ZrO2 thin film. The direct optical band gap and activation energy of the ZrO2 thin film are found to be 4.74 and 0.80eV respectively.

Physical properties of molten core materials: Zr-Ni and Zr-Cr alloys measured by electrostatic levitation

Energy Technology Data Exchange (ETDEWEB)

Ohishi, Yuji, E-mail: ohishi@see.eng.osaka-u.ac.jp [Graduate School of Engineering, Osaka University (Japan); Kondo, Toshiki [Graduate School of Engineering, Osaka University (Japan); Ishikawa, Takehiko [Japan Aerospace Exploration Agency (Japan); SOKEN-DAI (Graduate University for Advanced Studies) (Japan); Okada, Junpei T. [Institute for Materials Research, Tohoku University (Japan); Watanabe, Yuki [Advanced Engineering Services Co. Ltd. (Japan); Muta, Hiroaki; Kurosaki, Ken [Graduate School of Engineering, Osaka University (Japan); Yamanaka, Shinsuke [Graduate School of Engineering, Osaka University (Japan); Research Institute of Nuclear Engineering, University of Fukui (Japan)

2017-03-15

It is important to understand the behaviors of molten core materials to investigate the progression of a core meltdown accident. In the early stages of bundle degradation, low-melting-temperature liquid phases are expected to form via the eutectic reaction between Zircaloy and stainless steel. The main component of Zircaloy is Zr and those of stainless steel are Fe, Ni, and Cr. Our group has previously reported physical property data such as viscosity, density, and surface tension for Zr-Fe liquid alloys using an electrostatic levitation technique. In this study, we report the viscosity, density, and surface tension of Zr-Ni and Zr-Cr liquid alloys (Zr{sub 1-x}Ni{sub x} (x = 0.12 and 0.24) and Zr{sub 0.77}Cr{sub 0.23}) using the electrostatic levitation technique. - Highlights: • The physical properties of Zr-Ni and Zr-Cr liquid alloys have been measured Zr{sub 1-x}Ni{sub x} (x = 0.12 and 0.24) and Zr{sub 77}Cr{sub 23}. • The measurement was conducted using the electrostatic levitation technique. • The density, viscosity, and surface tension of each liquid alloy were measured.

Physical properties of molten core materials: Zr-Ni and Zr-Cr alloys measured by electrostatic levitation

International Nuclear Information System (INIS)

Ohishi, Yuji; Kondo, Toshiki; Ishikawa, Takehiko; Okada, Junpei T.; Watanabe, Yuki; Muta, Hiroaki; Kurosaki, Ken; Yamanaka, Shinsuke

2017-01-01

It is important to understand the behaviors of molten core materials to investigate the progression of a core meltdown accident. In the early stages of bundle degradation, low-melting-temperature liquid phases are expected to form via the eutectic reaction between Zircaloy and stainless steel. The main component of Zircaloy is Zr and those of stainless steel are Fe, Ni, and Cr. Our group has previously reported physical property data such as viscosity, density, and surface tension for Zr-Fe liquid alloys using an electrostatic levitation technique. In this study, we report the viscosity, density, and surface tension of Zr-Ni and Zr-Cr liquid alloys (Zr 1-x Ni x (x = 0.12 and 0.24) and Zr 0.77 Cr 0.23 ) using the electrostatic levitation technique. - Highlights: • The physical properties of Zr-Ni and Zr-Cr liquid alloys have been measured Zr 1-x Ni x (x = 0.12 and 0.24) and Zr 77 Cr 23 . • The measurement was conducted using the electrostatic levitation technique. • The density, viscosity, and surface tension of each liquid alloy were measured.

Zr3NiSb7: a new antimony-enriched ZrSb2 derivative

Directory of Open Access Journals (Sweden)

V. Romaka

2008-08-01

Full Text Available Single crystals of trizirconium nickel heptaantimonide were synthesized from the constituent elements by arc-melting. The compound crystallizes in a unique structure type and belongs to the family of two-layer structures. All crystallographically unique atoms (3 × Zr, 1 × Ni and 7 × Sb are located at sites with m symmetry. The structure contains `Zr2Ni2Sb5' and `Zr4Sb9' fragments and might be described as a new ZrSb2 derivative with a high Sb content.

Diffusion and chemical activity of Zr-Sn and Zr-Ti systems

International Nuclear Information System (INIS)

Zee, R.H.; Watters, J.F.; Davidson, R.D.

1986-01-01

A modified evaporation method was used to determine the diffusion coefficients and the emission rates of Sn and Ti in Zr-Sn and Zr-Ti, respectively, at temperatures between 1605 and 1970 K. Results show that both Sn and Ti diffuse in their respective alloys via a vacancy mechanism. Comparison with data in the literature reveals that the activation energy for diffusion of Sn in Zr-Sn, with Sn content between 3 and 5 at.X is relatively constant from 1200 to 1970 K. From the measured emission rates, values of 103 and 98 kcal/mol were obtained for the enthalpies of sublimation for Sn and Ti in their alloys. With a comparison of the solute vapor pressures with those of the pure elements, partial molar free energies, entropies, and enthalpies for the two systems were determined in the temperature range investigated. The Zr-Sn system shows a very large negative heat of formation (-33 kcal/mol) whereas the Zr-Ti system behaves quite ideally, in agreement with phase-diagram predictions

Electronic structure and optical absorption spectra of Y2 and Zr2 dimers

International Nuclear Information System (INIS)

Gutsev, G.L.

1989-01-01

The electron structure, ionization potentials from valent levels and energies of optic transitions of Y 2 and Zr 2 dimers are calculated within the framework of discrete-variatin X α -method. It is shown that the symmetry state 1 Σ g + is the main state of Y 2 and Zr 2 dimers, and the atoms in dimers have high-spin 4d n+1 5s 1 configuration. The chemical binding in Y 2 has the dominating 5s-5s nature which is revealed in a considerable interatomic distance; binding of 4d-electrons brings about a significant decrease in the bond length in Zr 2 dimer. The theoretical spectrum of optical absorption of Zr 2 agrees well with the obtained experimental spectrum of this molecule isolated in the organ matrix

Multipass Target Search in Natural Environments.

Science.gov (United States)

Kuhlman, Michael J; Otte, Michael W; Sofge, Donald; Gupta, Satyandra K

2017-11-02

Consider a disaster scenario where search and rescue workers must search difficult to access buildings during an earthquake or flood. Often, finding survivors a few hours sooner results in a dramatic increase in saved lives, suggesting the use of drones for expedient rescue operations. Entropy can be used to quantify the generation and resolution of uncertainty. When searching for targets, maximizing mutual information of future sensor observations will minimize expected target location uncertainty by minimizing the entropy of the future estimate. Motion planning for multi-target autonomous search requires planning over an area with an imperfect sensor and may require multiple passes, which is hindered by the submodularity property of mutual information. Further, mission duration constraints must be handled accordingly, requiring consideration of the vehicle's dynamics to generate feasible trajectories and must plan trajectories spanning the entire mission duration, something which most information gathering algorithms are incapable of doing. If unanticipated changes occur in an uncertain environment, new plans must be generated quickly. In addition, planning multipass trajectories requires evaluating path dependent rewards, requiring planning in the space of all previously selected actions, compounding the problem. We present an anytime algorithm for autonomous multipass target search in natural environments. The algorithm is capable of generating long duration dynamically feasible multipass coverage plans that maximize mutual information using a variety of techniques such as ϵ -admissible heuristics to speed up the search. To the authors' knowledge this is the first attempt at efficiently solving multipass target search problems of such long duration. The proposed algorithm is based on best first branch and bound and is benchmarked against state of the art algorithms adapted to the problem in natural Simplex environments, gathering the most information in the

Optical properties of Ar ions irradiated nanocrystalline ZrC and ZrN thin films

Energy Technology Data Exchange (ETDEWEB)

Martin, C. [Ramapo College of New Jersey, Mahwah, NJ 07430 (United States); Miller, K.H. [NASA Goddard Space Flight Center, Greenbelt, MD 20771 (United States); Makino, H. [Research Institute, Kochi University of Technology, Kami, Kochi, 782-8502 (Japan); Craciun, D. [National Institute for Laser, Plasma, and Radiation Physics, Bucharest-Magurele (Romania); Simeone, D. [CEA/DEN/DANS/DM2S/SERMA/LEPP-LRC CARMEN CEN Saclay France & CNRS/ SPMS UMR8785 LRC CARMEN, Ecole Centrale de Paris, F92292, Chatenay Malabry (United States); Craciun, V., E-mail: valentin.craciun@inflpr.ro [National Institute for Laser, Plasma, and Radiation Physics, Bucharest-Magurele (Romania)

2017-05-15

Employing wide spectral range (0.06–6 eV) optical reflectance measurements and high energy X-ray photoemission spectroscopy (HE-XPS), we studied the effect of 800 keV Ar ion irradiation on optical and electronic properties of nanocrystalline ZrC and ZrN thin films, which were obtain by the pulsed laser deposition technique. Both in ZrC and ZrN, we observed that irradiation affects the optical properties of the films mostly at low frequencies, which is dominated by the free carriers response. In both materials, we found a significant reduction in the free carriers scattering rate and an increase of the zero frequency conductivity, i.e. possible increase in mobility, at higher irradiation fluence. This is consistent with our previous findings that irradiation affects the crystallite size and the micro-strain, but it does not induce major changes in the chemical bonding. HE-XPS investigations further confirms the stability of the Zr-C and Zr-N bonds, despite a small increase in the surface region of the Zr-O bonds fraction with increasing irradiation fluence.

Local atomic structure of Zr-Cu and Zr-Cu-Al amorphous alloys investigated by EXAFS method

International Nuclear Information System (INIS)

Antonowicz, J.; Pietnoczka, A.; Zalewski, W.; Bacewicz, R.; Stoica, M.; Georgarakis, K.; Yavari, A.R.

2011-01-01

Research highlights: → Coordination number, interatomic distances and mean square atomic displacement in Zr-Cu and Zr-Cu-Al glasses. → Icosahedral symmetry in local atomic structure. → Deviation from random mixing behavior resulting from Al addition. - Abstract: We report on extended X-ray absorption fine structure (EXAFS) study of rapidly quenched Zr-Cu and Zr-Cu-Al glassy alloys. The local atomic order around Zr and Cu atoms was investigated. From the EXAFS data fitting the values of coordination number, interatomic distances and mean square atomic displacement were obtained for wide range of compositions. It was found that icosahedral symmetry rather than that of corresponding crystalline analogs dominates in the local atomic structure of Zr-Cu and Zr-Cu-Al amorphous alloys. Judging from bonding preferences we conclude that addition of Al as an alloying element results in considerable deviation from random mixing behavior observed in binary Zr-Cu alloys.

Oxidation of Zr and thin (0.2-4 nm) Zr films on Ag: An ESCA investigation

International Nuclear Information System (INIS)

Steiner, P.; Sander, I.; Siegwart, B.; Huefner, S.

1987-01-01

The oxidation of polycrystalline Zr under 10 -8 -10 -3 mbar oxygen pressure in the temperature range 25 0 -350 0 C is obtained from ESCA experiments. Changes in the ESCA spectra for thin Zr films on Ag oxidized at 250 0 C are observed and compared to the bulk Zr-metal. Thin Ag overlayers on Zr show a catalytic increase of the room temperature oxidation of Zr. (orig.)

Creep properties of Nb-1Zr and Nb-1Zr-0.1C

International Nuclear Information System (INIS)

Horak, J.A.; Egner, L.K.

1994-12-01

In the early 1980s a compact, lithium cooled, fast-energy spectrum nuclear reactor was selected for space applications requiring prolonged uninterrupted electrical power. This reactor was to be capable of generating up to 100 kilowatts of electricity for times up to seven years in space and thus was given the acronym SP-100. The material selected for the fuel cladding, reactor heat transport systems and structural components was Nb-1 wt % Zr (Nb-1Zr). In addition to commercial Nb-1Zr, modified alloys containing 100--200 wt ppM each of carbon and nitrogen and 900 ± 150 wt ppM carbon were also included, Type B Nb-1Zr and PWC-11, respectively. The SP-100 reactor was designed to operate at temperatures of 1290--1425 K. At these temperatures the principal mode of deformation for Nb-1Zr is creep, and creep strain of the fuel cladding limits the useful reactor lifetime. To develop a creep data base for design, safety and reliability analyses, uniaxial creep testing of Nb-1Zr, Type B Nb-1Zr and PWC-11 was conducted from 1250--1450 K at stresses from 5.0 MPa to 41.4 MPa. Methodology and test results are presented

Atomic-scale microstructures of Zr2Al3C4 and Zr3Al3C5 ceramics

International Nuclear Information System (INIS)

Lin, Z.J.; Zhuo, M.J.; He, L.F.; Zhou, Y.C.; Li, M.S.; Wang, J.Y.

2006-01-01

The microstructures of bulk Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 ceramics have been investigated using transmission electron microscopy and scanning transmission electron microscopy. These two carbides were determined to have a point group 6/mmm and a space group P6 3 /mmc using selected-area electron diffraction and convergent beam electron diffraction. The atomic-scale microstructures of Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 were investigated through high-resolution imaging and Z-contrast imaging. Furthermore, intergrowth between Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 was identified. Stacking faults in Zr 3 Al 3 C 5 were found to result from the insertion of an additional Zr-C layer. Cubic ZrC was occasionally identified to be incorporated in elongated Zr 3 Al 3 C 5 grains. In addition, Al may induce a twinned ZrC structure and lead to the formation of ternary zirconium aluminum carbides

NATURAL BARRIERS TARGETED THRUST FY 2004 PROJECTS

Energy Technology Data Exchange (ETDEWEB)

NA

2005-07-27

This booklet contains project descriptions of work performed by the Department of Energy (DOE), Office of Civilian Radioactive Waste Management (OCRWM), Office of Science and Technology and International's (OST&I) Natural Barriers Targeted Thrust during Fiscal Year (FY) 2004. The Natural Barriers Targeted Thrust is part of OST&I's Science and Technology Program which supports the OCRWM mission to manage and dispose of high-level radioactive waste and spent nuclear fuel in a manner that protects health, safety, and the environment; enhances national and energy security; and merits public confidence. In general, the projects described will continue beyond FY 2004 assuming that the technical work remains relevant to the proposed Yucca Mountain Repository and sufficient funding is made available to the Science and Technology Program.

Microstructural differences between two Zr(C,N) coatings revealed by analytical transmission electron microscopy

International Nuclear Information System (INIS)

Dörfel, Ilona; Rooch, Heidemarie; Österle, Werner

2012-01-01

The microstructures of two samples of a Zr(C,N) coating on steel, which unexpectedly differed in their tribological properties, were investigated by analytical transmission electron microscopy. The samples were produced by a cathodic arc evaporation process in two commercial coating devices under similar coating conditions with the exception of the number of Zr targets. The source of the differing tribological properties of the samples was detected by analytical transmission electron microscopy (TEM) methods energy-dispersive X-ray spectroscopy (EDX), energy filtering TEM (EFTEM), electron diffraction, high resolution electron microscopy, and high angel annular dark field. The TEM preparation and the results of the TEM investigations are shown in detail. The origin of the unexpected behavior was determined to be a nano-scale multilayer structure that existed only in the tribologically superior specimen. EDX and EFTEM investigations indicated enrichment in oxygen at the interface between coating and steel substrate in the tribologically inferior sample. Findings of the microstructural configuration were obtained by taking a closer look at the structure and comparing the results of the several analytical TEM techniques. This allows the allocation of the concentration fluctuations in N, C, and Zr to the two thickness fractions of the nano multilayers and a local correlation of the identified minority phase Zr 3 (C,N) 4 to the higher N content in the narrower type of the multilayer fraction of the sample with the excellent tribological properties. The minority phase Zr 3 (C,N) 4 is randomly distributed in the sample with the defective tribological properties. Coating conditions are not topic of this work, but after discussion of the TEM results, the fact that one of the coating devices worked with one Zr target and the other one with two, could be identified as cause for the formation of the nano multilayer structure in the sample with the superior tribological

Comparative study of the core level photoemission of the ZrB{sub 2} and ZrB{sub 12}

Energy Technology Data Exchange (ETDEWEB)

Huerta, L. [Instituto de Investigaciones en Materiales, Universidad Nacional Autonoma de Mexico, 04510 Mexico D.F. (Mexico); Duran, A. [Centro de Nanociencias y Nanotecnologia, Universidad Nacional Autonoma de Mexico, Apartado Postal 2681, Ensenada, Baja California 22800 (Mexico); Falconi, R. [Division Academica de Ciencias Basicas, Universidad Juarez Autonoma de Tabasco, Cunduacan, Tabasco, CP 86690, AP 24 (Mexico); Flores, M. [Departamento de Ingenieria de Proyectos, CUCEI, Universidad de Guadalajara, AP 307, Zapopan Jal 45101 (Mexico); Escamilla, R., E-mail: rauleg@servidor.unam.m [Instituto de Investigaciones en Materiales, Universidad Nacional Autonoma de Mexico, 04510 Mexico D.F. (Mexico)

2010-05-01

X-ray photoelectron spectroscopy (XPS) and ultraviolet photoelectron spectroscopy (UPS) were used to investigate the binding energies and valence band for ZrB{sub 2} and ZrB{sub 12}. The Zr 3d and B 1s core levels were identified. The Zr 3d core level shows a spin-orbit split 3d{sub 5/2} and 3d{sub 3/2} while that for B 1s core level exhibited a single symmetric peak, these being typical of zirconium and boride signals. Comparing the Zr 3d and B 1s core levels with metallic Zr, B{sub 2}O{sub 3} and ZrO{sub 2} reference materials only a negative chemical shift for Zr 3d associated to ZrB{sub 2} was observed, which suggests that the charge transfer model based on the concept of electronegativity was not applicable to explain the superconductivity in the ZrB{sub 12} sample. The measured valence band using UPS is consistent with the band-structure calculations indicating a higher density of states (DOS) at E{sub F} for ZrB{sub 12} respect to ZrB{sub 2}. Finally, we found that the weak mixed B-p and Zr-d states for ZrB{sub 12} is crucial for the superconductivity due to the state population increased the DOS at the E{sub F}.

The preparation of Zr-deuteride and phase stability studies of the Zr-D system

Science.gov (United States)

Maimaitiyili, T.; Steuwer, A.; Bjerkén, C.; Blomqvist, J.; Hoelzel, M.; Ion, J. C.; Zanellato, O.

2017-03-01

Deuteride phases in the zirconium-deuterium system in the temperature range 25-286 °C have been studied in-situ by high resolution neutron diffraction. The study primarily focused on observations of δ→γ transformation at 180 °C, and the peritectoid reaction α + δ ↔ γ at 255 °C in commercial grade Zr powder that was deuterated to a deuterium/Zr ratio of one to one. A detailed description of the zirconium deuteride preparation route by high temperature gas loading is also described. The lattice parameters of α-Zr, δ-ZrDx and ε-ZrDx were determined by whole pattern crystal structure analysis, using Rietveld and Pawley refinements, and are in good agreement with values reported in the literature. The controversial γ-hydride phase was observed both in-situ and ex-situ in deuterated Zr powder after a heat treatment at 286 °C and slow cooling.

Numerical Simulation on Natural Convection Cooling of a FM Target

Energy Technology Data Exchange (ETDEWEB)

Park, Jong Pil; Park, Su Ki [KAERI, Daejeon (Korea, Republic of)

2016-05-15

The irradiated FM(Fission-Molly) target is unloaded from the irradiation hole during normal operation, and then cooled down in the reactor pool for a certain period of time. Therefore, it is necessary to identify the minimum decay time needed to cool down FM target sufficiently by natural convection. In the present work, numerical simulations are performed to predict cooling capability of a FM target cooled by natural convection using commercial computational fluid dynamics (CFD) code, CFX. The present study is carried out using CFD code to investigate cooling capability of a FM target cooled by natural convection. The steady state simulation as well as transient simulation is performed in the present work. Based on the transient simulation (T1), the minimum decay time that the maximum fuel temperature does not reach the design limit temperature (TONB-3 .deg. C) is around 15.60 seconds.

Virtual target screening to rapidly identify potential protein targets of natural products in drug discovery

Directory of Open Access Journals (Sweden)

Yuri Pevzner

2014-05-01

Full Text Available Inherent biological viability and diversity of natural products make them a potentially rich source for new therapeutics. However, identification of bioactive compounds with desired therapeutic effects and identification of their protein targets is a laborious, expensive process. Extracts from organism samples may show desired activity in phenotypic assays but specific bioactive compounds must be isolated through further separation methods and protein targets must be identified by more specific phenotypic and in vitro experimental assays. Still, questions remain as to whether all relevant protein targets for a compound have been identified. The desire is to understand breadth of purposing for the compound to maximize its use and intellectual property, and to avoid further development of compounds with insurmountable adverse effects. Previously we developed a Virtual Target Screening system that computationally screens one or more compounds against a collection of virtual protein structures. By scoring each compound-protein interaction, we can compare against averaged scores of synthetic drug-like compounds to determine if a particular protein would be a potential target of a compound of interest. Here we provide examples of natural products screened through our system as we assess advantages and shortcomings of our current system in regards to natural product drug discovery.

Virtual target screening to rapidly identify potential protein targets of natural products in drug discovery

Directory of Open Access Journals (Sweden)

Yuri Pevzner

2015-08-01

Full Text Available Inherent biological viability and diversity of natural products make them a potentially rich source for new therapeutics. However, identification of bioactive compounds with desired therapeutic effects and identification of their protein targets is a laborious, expensive process. Extracts from organism samples may show desired activity in phenotypic assays but specific bioactive compounds must be isolated through further separation methods and protein targets must be identified by more specific phenotypic and in vitro experimental assays. Still, questions remain as to whether all relevant protein targets for a compound have been identified. The desire is to understand breadth of purposing for the compound to maximize its use and intellectual property, and to avoid further development of compounds with insurmountable adverse effects. Previously we developed a Virtual Target Screening system that computationally screens one or more compounds against a collection of virtual protein structures. By scoring each compound-protein interaction, we can compare against averaged scores of synthetic drug-like compounds to determine if a particular protein would be a potential target of a compound of interest. Here we provide examples of natural products screened through our system as we assess advantages and shortcomings of our current system in regards to natural product drug discovery.

Structures, stabilities, and electronic properties of small-sized Zr{sub 2}Si{sub n} (n=1-11) clusters. A density functional study

Energy Technology Data Exchange (ETDEWEB)

Wu, Jing-He; Liu, Chang-Xin [Henan Institute of Education, Zhengzhou (China). Dept. of Physics; Wang, Ping; Zhang, Shuai; Lu, Cheng [Nanyang Normal Univ (China). Dept. of Physics; Yang, Gui [Anyang Normal Univ. (China). Dept. of Physics and Electrical Engineering

2015-07-01

Ab initio methods based on density functional theory at B3LYP level have been applied in investigating the equilibrium geometries, growth patterns, relative stabilities, and electronic properties of Zr{sub 2}-doped Si{sub n} clusters. The optimisation results shown that the lowest-energy configurations for Zr{sub 2}Si{sub n} clusters do not keep the corresponding silicon framework unchanged, which reflects that the doped Zr atoms dramatically affect the most stable structures of the Si{sub n} clusters. By analysing the relative stabilities, it is found that the doping of zirconium atoms reduces the chemical stabilities of silicon host. The Zr{sub 2}Si{sub 4} and Zr{sub 2}Si{sub 7} clusters are the magic numbers. The natural population and natural electronic configuration analyses indicated that the Zr atoms possess positive charge for n=1-6 and negative charge for n=7-11. In addition, the chemical hardness, chemical potential, infrared, and Raman spectra are also discussed.

KORELASI KOMPOSISI UNSUR TERHADAP SIFAT TERMAL SERBUK BAHAN BAKAR U-ZrHX

Directory of Open Access Journals (Sweden)

Masrukan Masrukan

2016-10-01

yaitu kapasitas panas diperoleh nilai kapasitas panas tertinggi pada serbuk U-35ZrHx, sedangkan dari pengujian transisi perubahan fasa diperoleh bahwa pada U-45ZrHx mengalami dua tahapan reaksi disertai perubahan fasa. Terdapat pengaruh komposisi terhadap sifat termalnya, dimana semakin tinggi kandungan Zr maka nilai kapaistas panas hidrida uranium zirkonium semakin rendah. Kata kunci: komposisi, sifat termal, bahan bakar, U-ZrHx. ABSTRACT COMPOSITION CORRECTION ON THE THERMAL PROPERTIES OF U-ZrHX FUEL POWDERS. Analysis has been conducted to determine the composition correlation on the thermal properties of the powder fuel U-ZrHx. U-ZrHx powder made from the process hidriding U-Zr ingot, where the ingot is the result of U-Zr and Zr U metal melting. In this experiment made three variations of powders, namely U-35ZrHx, U-45ZrHx, and U-55ZrHx. Need for determination of the thermal properties of Zr was to determine the effect of the nature of the transformation of Zr levels of heat from the fuel. At first, U and Zr metal is melted in electric arc furnaces to produce ingot U-Zr. U-Zr ingot then made powder with hidridring-milling techniques to produce U-Zr powder. U-Zr powder composition analyzed using techniques sepectroscopy atomic absorption (AAS and UV-Vis spectroscopy. The results of composition analysis showed that the analysis to determine the content of U and Zr nearly all the test samples analyzed have quite a big difference between the content of U and Zr as determined by the results of the analysis of U and Zr exception analysis result in powder U-45Zr which differ only 0.609%. From the analysis of impurities obtained that nearly all the impurities that exist still meet the requirements for fuel unless the elements Fe, where elements of the existing Fe amounted to 382.912 g/g while the requirement of £ 250 mg /µg. Testing conducted heat capacity in the temperature range 35 ° C to 437 ° C showed that the capacity were greatest powder 35ZrHx U-with a value heat

Effect of Ge Content on the Formation of Ge Nanoclusters in Magnetron-Sputtered GeZrOx-Based Structures

OpenAIRE

Khomenkova, L.; Lehninger, D.; Kondratenko, O.; Ponomaryov, S.; Gudymenko, O.; Tsybrii, Z.; Yukhymchuk, V.; Kladko, V.; von Borany, J.; Heitmann, J.

2017-01-01

Ge-rich ZrO2 films, fabricated by confocal RF magnetron sputtering of pure Ge and ZrO2 targets in Ar plasma, were studied by multi-angle laser ellipsometry, Raman scattering, Auger electron spectroscopy, Fourier transform infrared spectroscopy, and X-ray diffraction for varied deposition conditions and annealing treatments. It was found that as-deposited films are homogeneous for all Ge contents, thermal treatment stimulated a phase separation and a formation of crystalline Ge and ZrO2. The ?...

Ni-free Zr-Cu-Al-Nb-Pd bulk metallic glasses with different Zr/Cu ratios for biomedical applications.

Science.gov (United States)

Huang, Lu; Yokoyama, Yoshihiko; Wu, Wei; Liaw, Peter K; Pang, Shujie; Inoue, Akihisa; Zhang, Tao; He, Wei

2012-08-01

Zr-based bulk metallic glasses (BMGs) possess attractive properties for prospective biomedical applications. The present study designs Ni-free Zr-Cu-Al-Nb-Pd BMGs and investigates their in vitro biocompatibility by studying mechanical properties, bio-corrosion resistance, and cellular responses. The Ti-6Al-4V alloy is used as a reference material. It is found that the Zr-based BMGs exhibit good mechanical properties, including high strengths above 1600 MPa, high hardness over 4700 MPa, and low elastic moduli of 85-90 GPa. The Zr-based BMGs are corrosion resistant in a simulated body environment, as revealed by wide passive regions, low passive current densities, and high pitting overpotentials. The formation of ZrO(2)-rich surface passive films of the Zr-based BMGs contributes to their high corrosion resistance, whereas their pitting corrosion in the phosphate buffered saline solution can be attributed to the sensitivity of the ZrO(2) films to the chloride ion. The general biosafety of the Zr-based BMGs is revealed by normal cell adhesions and cell morphologies. Moreover, the Zr/Cu content ratio in the alloy composition affects the biocompatibility of the Zr-based BMGs, by increasing their corrosion resistance and surface wettability with the increase of the Zr/Cu ratio. Effects of Zr/Cu ratios can be used to guide the future design of biocompatible Zr-based BMGs. Copyright © 2012 Wiley Periodicals, Inc.

Development of the Ni/Al{sub 2}O{sub 3}/ZrO{sub 2} catalyst to steam reforming of the natural gas process; Desenvolvimento do catalisador Ni/Al2O3/ZrO2 para o processo de reforma do gas natural

Energy Technology Data Exchange (ETDEWEB)

Neiva, Laedna Souto; Ramalho, Melanea A.F.; Costa, Ana Cristina Figueiredo de Melo; Gama, Lucianna [Universidade Federal de Campina Grande (UFCG), PB (Brazil); Andrade, Heloysa M.C. [Universidade Federal da Bahia (UFBA), Salvador, BA (Brazil); Kiminami, Ruth Herta G.A. [Universidade Federal de Sao Carlos (UFSCAR), SP (Brazil)

2008-07-01

The aim of this work is to develop catalyst of the type Ni/{alpha}-Al{sub 2}O{sub 3} modified with 0.005 mol of ZrO{sub 2} and structural, morphologic and catalytic characterizations, aiming employ in the reforming process of the natural gas. The catalytic supports were obtained by synthesis method for combustion reaction according to the concepts of the propellants chemistry. The active species of the catalyst (nickel) was deposited over the support by humid impregnation method. The catalytic supports were characterized by XRD, morphologic analysis by SEM and TEM, textural analysis by BET method before and after of the impregnation with nickel and were done catalytic tests in laboratory. The catalytic supports shows structure without any secondary phase with crystallinity elevated degree and crystal size varying between 5.7 and 7.0 nm. The catalytic test shows that these catalysts promoted a conversion percentile considerable of the natural gas in syngas. (author)

Corrosion Behaviour of New Zr Alloys

DEFF Research Database (Denmark)

Tolksdorf, E.

1974-01-01

Corrosion studies have indicated that the most promising replacements for Zicaloy-2 are ZrCrFe, ZrVFe and probably ZrNbTa, provided they are in their optimized condition. These alloys are conventionally manufactured alloys. An internally oxidized ZrMgO alloy is even superior, from the corrosion...

Comparison of optical-model and Lane-model analyses of sub-Coulomb protons on /sup 92,94/Zr

International Nuclear Information System (INIS)

Schrils, R.; Flynn, D.S.; Hershberger, R.L.; Gabbard, F.

1979-01-01

Accurate proton elastic-scattering cross sections were measured with enriched targets of /sup 92,94/Zr from E/sub p/ = 2.0 to 6.5 MeV. The elastic-scattering cross sections, together with absorption cross sections, were analyzed with a Lane model which employed the optical potential of Johnson et al. The resulting parameters were compared with those obtained with a single-channel optical model and negligible differences were found. Significant differences between the 92 Zr and 94 Zr real diffusenesses resulted from the inclusion of the (p,p) data in the analyses

Deuterium absorption in CANDU Zr-2.5Nb pressure tubes

International Nuclear Information System (INIS)

Ploc, R.A.; McRae, G.A.

1999-12-01

Corrosion of CANDU Zr-2.5%Nb pressure tubes in heavy water results in the formation of an oxide film and the absorption of deuterium by the alloy. If deuterium concentrations are allowed to exceed the terminal solid solubility of the alloy, brittle deuterides can form, thereby limiting the service life of a component. In CANDU pressure tubes, ingress rates are largely determined by the metastable β-Zr that is present as a thin layer encasing the predominant α-Zr grains (approximately 90% by volume). The distribution and continuity of the corroded β-phase in the oxide provides a pervasive web for the development of interconnected porosity from the free surface to the oxide/metal interface. Changing the distribution of the β-phase in the alloy changes the nature of the oxide porosity, a technique that can be used to reduce deuterium ingress rates. (author)

Deuterium absorption in CANDU Zr-2.5Nb pressure tubes

Energy Technology Data Exchange (ETDEWEB)

Ploc, R.A.; McRae, G.A

1999-12-01

Corrosion of CANDU Zr-2.5%Nb pressure tubes in heavy water results in the formation of an oxide film and the absorption of deuterium by the alloy. If deuterium concentrations are allowed to exceed the terminal solid solubility of the alloy, brittle deuterides can form, thereby limiting the service life of a component. In CANDU pressure tubes, ingress rates are largely determined by the metastable {beta}-Zr that is present as a thin layer encasing the predominant {alpha}-Zr grains (approximately 90% by volume). The distribution and continuity of the corroded {beta}-phase in the oxide provides a pervasive web for the development of interconnected porosity from the free surface to the oxide/metal interface. Changing the distribution of the {beta}-phase in the alloy changes the nature of the oxide porosity, a technique that can be used to reduce deuterium ingress rates. (author)

Nano ZrO{sub 2} particles in nanocrystalline Fe–14Cr–1.5Zr alloy powders

Energy Technology Data Exchange (ETDEWEB)

Xu, W.Z.; Li, L.L.; Saber, M.; Koch, C.C.; Zhu, Y.T., E-mail: ytzhu@ncsu.edu; Scattergood, R.O.

2014-09-15

Here we report on the formation of nano ZrO{sub 2} particles in Fe–14Cr–1.5Zr alloy powders synthesized by mechanical alloying. The nano ZrO{sub 2} particles were found uniformly dispersed in the ferritic matrix powders with an average size of about 3.7 nm, which rendered the alloy powders so stable that it retained nanocrystalline structure after annealing at 900 °C for 1 h. The ZrO{sub 2} nanoparticles have a tetragonal crystal structure and the following orientation relationship with the matrix: (0 0 2){sub ZrO2}//(0 0 2){sub Matrix} and [0 1 0]{sub ZrO2}//[1 2 0]{sub Matrix}. The size and dispersion of the ZrO{sub 2} particles are comparable to those of Y–Ti–O enriched oxides reported in irradiation-resistant ODS alloys. This suggests a potential application of the new alloy powders for nuclear energy applications.

The potential of natural products for targeting PPARα

Directory of Open Access Journals (Sweden)

Daniela Rigano

2017-07-01

Full Text Available Peroxisome proliferator activated receptors (PPARs α, -γ and -β/δ are ligand-activated transcription factors and members of the superfamily of nuclear hormone receptor. These receptors play key roles in maintaining glucose and lipid homeostasis by modulating gene expression. PPARs constitute a recognized druggable target and indeed several classes of drugs used in the treatment of metabolic disease symptoms, such as dyslipidemia (fibrates, e.g. fenofibrate and gemfibrozil and diabetes (thiazolidinediones, e.g. rosiglitazone and pioglitazone are ligands for the various PPAR isoforms. More precisely, antidiabetic thiazolidinediones act on PPARγ, while PPARα is the main molecular target of antidyslipidemic fibrates. Over the past few years, our understanding of the mechanism underlying the PPAR modulation of gene expression has greatly increased. This review presents a survey on terrestrial and marine natural products modulating the PPARα system with the objective of highlighting how the incredible chemodiversity of natural products can provide innovative leads for this “hot” target.

Microstructural evolution and structure property correlation in Zr-1Nb and Zr-1Nb-1Sn-0.1Fe alloys

International Nuclear Information System (INIS)

Neogy, S.; Srivastava, D.; Chakravartty, J.K.; Dey, G.K.

2005-01-01

This study summarizes the evolution of microstructure and precipitation behavior in binary Zr-1Nb and quaternary Zr-1Nb-1Sn-0.1Fe alloys after different thermo mechanical processing. The processed microstructure and morphology of constituent phases and precipitates have been studied in detail using transmission electron microscopy (TEM). Microstructural studies have revealed the shape, size, size distribution and the nature of precipitate phases. Martensite formation and its tempering behavior have been studied in detail in both the alloys. Recrystallization studies on these alloys have been carried out with a view to understand the recrystallization mechanism. In case of the binary alloy the second phase recipitates were of the β type having composition varying from β I (20 wt% Nb) to β II (85 wt% Nb) depending on the heat treatment temperature and time. The second phase precipitates in the quaternary alloy were intermetallic Zr-Nb-Fe type and also β type rich in Zr. The orientation relationship existing between the precipitating phases and the a matrix were established in case of both the alloys. High resolution electron microscopy (HREM) of the martensitic microstructure and the recrystallized microstructure has revealed the internal structure and the interface structure of the martensite and the precipitating phases respectively. Structure-property correlation studies have been carried out on the heat-treated samples to evaluate the effect of the thermo mechanical processing on the microstructures and hence mechanical properties. (author)

Measurements of inner-shell characteristic X-ray yields of thick W, Mo and Zr targets by low-energy electron impact and comparison with Monte Carlo simulations

International Nuclear Information System (INIS)

Li, X.L.; Zhao, J.L.; Tian, L.X.; An, Z.; Zhu, J.J.; Liu, M.T.

2014-01-01

Highlights: •We measured characteristic X-ray yields of thick W, Mo, Zr by 5–29 keV electrons. •Our measured data are in general in good agreement with the MC results with ∼10%. •Error of 10% of characteristic X-ray yields will produce errors of 2–7% for BIXS. -- Abstract: Inner-shell characteristic X-ray yields are one of the important ingredients in the β-ray induced X-ray spectrometry (BIXS) technique which can be used to perform tritium content and depth distribution analyses in plasma facing materials (PLMs) and other tritium-containing materials, such as W, Mo, Zr. In this paper, the measurements of K, L, M-shell X-ray yields Y(E) of pure thick W (Z = 74), Mo (Z = 42) and Zr (Z = 40) element targets produced by electron impact in the energy range of 5–29 keV are presented. The experimental data for Y(E) are compared with the corresponding predictions from Monte Carlo (MC) calculations using the general purpose MC code PENELOPE. In general, a good agreement is obtained between the experiment and the MC calculations for the variation of Y(E) with the impact energy both in shape and in magnitude with ∼10%. The effect of uncertainty of inner-shell characteristic X-ray yields on the BIXS technique is also discussed

Biocompatible Ni-free Zr-based bulk metallic glasses with high-Zr-content: compositional optimization for potential biomedical applications.

Science.gov (United States)

Hua, Nengbin; Huang, Lu; Chen, Wenzhe; He, Wei; Zhang, Tao

2014-11-01

The present study designs and prepares Ni-free Zr60+xTi2.5Al10Fe12.5-xCu10Ag5 (at.%, x=0, 2.5, 5) bulk metallic glasses (BMGs) by copper mold casting for potential biomedical application. The effects of Zr content on the in vitro biocompatibility of the Zr-based BMGs are evaluated by investigating mechanical properties, bio-corrosion behavior, and cellular responses. It is found that increasing the content of Zr is favorable for the mechanical compatibility with a combination of low Young's modulus, large plasticity, and high notch toughness. Electrochemical measurements demonstrate that the Zr-based BMGs are corrosion resistant in a phosphate buffered saline solution. The bio-corrosion resistance of BMGs is improved with the increase in Zr content, which is attributed to the enrichment in Zr and decrease in Al concentration in the surface passive film of alloys. Regular cell responses of mouse MC3T3-E1 cells, including cell adhesion and proliferation, are observed on the Zr-Ti-Al-Fe-Cu-Ag BMGs, which reveals their general biosafety. The high-Zr-based BMGs exhibit a higher cell proliferation activity in comparison with that of pure Zr and Ti-6Al-4V alloy. The effects of Zr content on the in vitro biocompatibility can be used to guide the future design of biocompatible Zr-based BMGs. Copyright © 2014 Elsevier B.V. All rights reserved.

Biocompatible Ni-free Zr-based bulk metallic glasses with high-Zr-content: Compositional optimization for potential biomedical applications

Energy Technology Data Exchange (ETDEWEB)

Hua, Nengbin, E-mail: flower1982cn@126.com [Department of Materials Science and Engineering, Fujian University of Technology, 350118 Fuzhou (China); Department of Materials Science and Engineering, Fuzhou University, 350116 Fuzhou (China); Huang, Lu [Department of Materials Science and Engineering, The University of Tennessee, Knoxville, TN 37996-2100 (United States); Chen, Wenzhe [Department of Materials Science and Engineering, Fujian University of Technology, 350118 Fuzhou (China); Department of Materials Science and Engineering, Fuzhou University, 350116 Fuzhou (China); He, Wei [Department of Materials Science and Engineering, The University of Tennessee, Knoxville, TN 37996-2100 (United States); Department of Mechanical, Aerospace and Biomedical Engineering, The University of Tennessee, Knoxville, TN 37996-2200 (United States); Zhang, Tao [Key Laboratory of Aerospace Materials and Performance (Ministry of Education), School of Materials Science and Engineering, Beihang University, 100191 Beijing (China)

2014-11-01

The present study designs and prepares Ni-free Zr{sub 60+x}Ti{sub 2.5}Al{sub 10}Fe{sub 12.5−x}Cu{sub 10}Ag{sub 5} (at.%, x = 0, 2.5, 5) bulk metallic glasses (BMGs) by copper mold casting for potential biomedical application. The effects of Zr content on the in vitro biocompatibility of the Zr-based BMGs are evaluated by investigating mechanical properties, bio-corrosion behavior, and cellular responses. It is found that increasing the content of Zr is favorable for the mechanical compatibility with a combination of low Young's modulus, large plasticity, and high notch toughness. Electrochemical measurements demonstrate that the Zr-based BMGs are corrosion resistant in a phosphate buffered saline solution. The bio-corrosion resistance of BMGs is improved with the increase in Zr content, which is attributed to the enrichment in Zr and decrease in Al concentration in the surface passive film of alloys. Regular cell responses of mouse MC3T3-E1 cells, including cell adhesion and proliferation, are observed on the Zr–Ti–Al–Fe–Cu–Ag BMGs, which reveals their general biosafety. The high-Zr-based BMGs exhibit a higher cell proliferation activity in comparison with that of pure Zr and Ti-6Al-4V alloy. The effects of Zr content on the in vitro biocompatibility can be used to guide the future design of biocompatible Zr-based BMGs. - Highlights: • Ni-free Zr{sub 60+x}Ti{sub 2.5}Al{sub 10}Fe{sub 12.5−x}Cu{sub 10}Ag{sub 5} (at.%, x = 0, 2.5, 5) BMGs were fabricated. • Plasticity and notch toughness of BMGs are enhanced by high-Zr-content. • The high-Zr-based BMGs exhibit excellent bio-corrosion resistance in PBS solution. • The biosafety of BMGs is revealed by regular cell adhesion and proliferation. • High-Zr-bearing BMGs are favorable for potential applications as biomaterials.

ZrTiO4 nanowire growth using membrane-assisted Pechini route

Directory of Open Access Journals (Sweden)

P. R. de Lucena

2014-11-01

Full Text Available The high surface-to-volume ratio of nanowires makes them natural competitors as new device components. In this regard, a current major challenge is to produce quasi-one-dimensional nanostructures composed of well established oxide-based materials. This article reports the synthesis of ZrTiO4 nanowires on a silicon (100 wafer in a single-step deposition/thermal treatment. The template-directed membrane synthesis strategy was associated with the Pechini route and spin-coating deposition technique. ZrTiO4 nanowires were obtained at 700 ˚C with diameters in the range of 80-100 nm. FEG- SEM images were obtained to investigate ZrTiO4 nanowire formation on the silicon surface and energy dispersive x-ray detection (EDS and x-ray diffraction (XRD analyses were performed to confirm the oxide composition and structure.

ZrTiO4 Nanowire Growth Using Membrane-assisted Pechini Route

Directory of Open Access Journals (Sweden)

Poty Rodrigues de Lucena

2016-02-01

Full Text Available The high surface-to-volume ratio of nanowires makes them natural competitors as newer device components. In this regard, a current major challenge is to produce quasi-one-dimensional nanostructures composed of well-established oxide-based materials. This article reports the synthesis of ZrTiO4 nanowires on a silicon (100 wafer in a single-step deposition/thermal treatment. The template-directed membrane synthesis strategy was associated with the Pechini route and spin-coating deposition technique. ZrTiO4 nanowires were obtained at 700 °C with diameters in the range of 80-100 nm. FEGSEM images were obtained to investigate ZrTiO4 nanowire formation on the silicon surface and energy dispersive X-ray detection (EDS and X-ray diffraction (XRD analyses were performed to confirm the oxide composition and structure. 

Arsenic and fluoride removal from contaminated drinking water with Haix-Fe-Zr and Haix-Zr resin beads.

Science.gov (United States)

Phillips, Debra H; Sen Gupta, Bhaskar; Mukhopadhyay, Soumyadeep; Sen Gupta, Arup K

2018-06-01

The objective of the study was to carry-out batch tests to examine the effectiveness of Haix-Fe-Zr and Haix-Zr resin beads in the removal of As(III), As(V) and F - from groundwater with a similar geochemistry to a site where a community-based drinking water plant has been installed in West Bengal, India. The groundwater was spiked separately with ∼200 μg/L As(III) and As(V) and 5 mg/L F - . Haix-Zr resin beads were more effective than Haix-Fe-Zr resin beads in removing As(III) and As(V). Haix-Zr resin beads showed higher removal of As(V) compared to As(III). Haix-Zr resin beads removed As(V) below the WHO (10 μg/L) drinking water standards at 8.79 μg/L after 4 h of shaking, while As(III) was reduced to 7.72 μg/L after 8 h of shaking. Haix-Fe-Zr resin beads were more effective in removing F - from the spiked groundwater compared to Haix-Zr resin beads. Concentrations of F - decreased from 6.27 mg/L to 1.26 mg/L, which is below the WHO drinking water standards (1.5 mg/L) for F - , after 15 min of shaking with Haix-Fe-Zr resin beads. After 20 min of shaking in groundwater treated with Haix-Zr resin beads, F - concentrations decreased from 6.27 mg/L to 1.43 mg/L. In the removal of As(III), As(V), and F - from the groundwater, Haix-Fe-Zr and Haix-Zr resin beads fit the parabolic diffusion equation (PDE) suggesting that adsorption of these contaminants was consistent with inter-particle diffusion. Copyright © 2018 Elsevier Ltd. All rights reserved.

Mechanical properties and bio-tribological behaviors of novel beta-Zr-type Zr-Al-Fe-Nb alloys for biomedical applications.

Science.gov (United States)

Hua, Nengbin; Chen, Wenzhe; Zhang, Lei; Li, Guanghui; Liao, Zhenlong; Lin, Yan

2017-07-01

The present study prepares novel Zr 70+x Al 5 Fe 15-x Nb 10 (x=0, 5) alloys by arc-melting for potential biomedical application. The mechanical properties and bio-tribological behaviors of the Zr-based alloys are evaluated and compared with biomedical pure Zr. The as-prepared alloys exhibit a microstructure containing a micrometer-sized dendritic beta-Zr phase dispersed in a Zr 2 Fe-typed matrix. It is found that increasing the content of Zr is favorable for the mechanical compatibility with a combination of low Young's modulus, large plasticity, and high compressive strength. The wear resistance of the Zr-Al-Fe-Nb alloys in air and phosphate buffer saline (PBS) solution is superior to that of pure Zr. The wear mechanism of Zr-based alloys sliding in air is controlled by oxidation and abrasive wear whereas that sliding in PBS is controlled by synergistic effects of the abrasive and corrosive wear. Electrochemical measurements demonstrate that the Zr-based alloys are corrosion resistant in PBS. Their bio-corrosion resistance is improved with the increase in Zr content, which is attributed to the enrichment in Zr and decrease in Al concentration in the surface passive film of alloys. The Zr 75 Al 5 Fe 10 Nb 10 exhibits the best corrosion resistance in PBS, which contributes to its superior wear resistance in a simulated body environment. The combination of good mechanical properties, corrosion resistance, and biotribological behaviors of the Zr-Al-Fe-Nb alloys offers them potential advantages in biomedical applications. Copyright © 2017 Elsevier B.V. All rights reserved.

Competitive Heterogeneous Nucleation Between Zr and MgO Particles in Commercial Purity Magnesium

Science.gov (United States)

Peng, G. S.; Wang, Y.; Fan, Z.

2018-04-01

Grain refining of commercial purity (CP) Mg by Zr addition with intensive melt shearing prior to solidification has been investigated. Experimental results showed that, when intensive melt shearing is imposed prior to solidification, the grain structure of CP Mg exhibits a complex changing pattern with increasing Zr addition. This complex behavior can be attributed to the change of nucleating particles in terms of their crystal structure, size, and number density with varied Zr additions. Naturally occurring MgO particles are found to be {100} faceted with a cubic morphology and 50 to 300 nm in size. Such MgO particles are usually populated densely in a liquid film (usually referred as oxide film) and can be effectively dispersed by intensive melt shearing. It has been confirmed that the dispersed MgO particles can act as nucleating substrates resulting in a significant grain refinement of CP Mg when no other more potent particles are present in the melt. However, Zr particles in the Mg-Zr alloys are more potent than MgO particles for nucleation of Mg due to their same crystal structure and similar lattice parameters with Mg. With the addition of Zr, Zr and the MgO particles co-exist in the melt. Grain refining efficiency is closely related to the competition for heterogeneous nucleation between Zr and the MgO particles. The final solidified microstructure is mainly determined by the interplay of three factors: nucleation potency (measured by lattice misfit), particle size, and particle number density.

Competitive Heterogeneous Nucleation Between Zr and MgO Particles in Commercial Purity Magnesium

Science.gov (United States)

Peng, G. S.; Wang, Y.; Fan, Z.

2018-06-01

Grain refining of commercial purity (CP) Mg by Zr addition with intensive melt shearing prior to solidification has been investigated. Experimental results showed that, when intensive melt shearing is imposed prior to solidification, the grain structure of CP Mg exhibits a complex changing pattern with increasing Zr addition. This complex behavior can be attributed to the change of nucleating particles in terms of their crystal structure, size, and number density with varied Zr additions. Naturally occurring MgO particles are found to be {100} faceted with a cubic morphology and 50 to 300 nm in size. Such MgO particles are usually populated densely in a liquid film (usually referred as oxide film) and can be effectively dispersed by intensive melt shearing. It has been confirmed that the dispersed MgO particles can act as nucleating substrates resulting in a significant grain refinement of CP Mg when no other more potent particles are present in the melt. However, Zr particles in the Mg-Zr alloys are more potent than MgO particles for nucleation of Mg due to their same crystal structure and similar lattice parameters with Mg. With the addition of Zr, Zr and the MgO particles co-exist in the melt. Grain refining efficiency is closely related to the competition for heterogeneous nucleation between Zr and the MgO particles. The final solidified microstructure is mainly determined by the interplay of three factors: nucleation potency (measured by lattice misfit), particle size, and particle number density.

Effect of Si and Zr on the Microstructure and Properties of Al-Fe-Si-Zr Alloys

Directory of Open Access Journals (Sweden)

Anna Morozova

2017-11-01

Full Text Available The effects of Si and Zr on the microstructure, microhardness and electrical conductivity of Al-Fe-Si-Zr alloys were studied. An increase in the Zr content over 0.3 wt. % leads to the formation of primary Al3Zr inclusions and also decreases mechanical properties. Therefore, the Zr content should not be more than 0.3 wt. %, although the smaller content is insufficient for the strengthening by the secondary Al3Zr precipitates. The present results indicate that high content of Si significantly affects the hardness and electrical conductivity of the investigated alloys. However, the absence of Si led to the formation of harmful needle-shaped Al3Fe particles in the microstructure of the investigated alloys after annealing. Therefore, the optimum amount of Si was 0.25–0.50 wt. % due to the formation of the Al8Fe2Si phase with the preferable platelet morphology. The maximum microhardness and strengthening effects in Al-1% Fe-0.25% Si-0.3% Zr were observed after annealing at 400–450 °C due to the formation of nanosized coherent Al3Zr (L12 dispersoids. The effect of the increasing of the electrical conductivity can be explained by the decomposition of the solid solution. Thus, Al-1% Fe-0.25% Si-0.3% Zr alloy annealed at 450 °C has been studied in detail as the most attractive with respect to the special focus on transmission line applications.

Synthesis and characterization of a polyborosilazane/Cp2ZrCl2 hybrid precursor for the Si-B-C-N-Zr multinary ceramic.

Science.gov (United States)

Long, Xin; Shao, Changwei; Wang, Hao; Wang, Jun

2015-09-21

A novel zirconium-contained polyborosilazane (PBSZ-Zr) was synthesized by chemical modification of a liquid polyborosilazane (LPBSZ) with Cp2ZrCl2. A Si-B-C-N-Zr multinary ceramic was prepared via pyrolysis of PBSZ-Zr. The properties and the ceramization process of PBSZ-Zr, as well as the microstructural development and properties of the derived SiBCN-Zr ceramic, were well studied. The active Si-H and N-H groups in LPBSZ react with Zr-Cl in Cp2ZrCl2 to form PBSZ-Zr polymers. The Zr content of the SiBCN-Zr ceramic was 3.39 wt% when the weight ratio of Cp2ZrCl2 to LPBSZ was 20 : 100. The SiBCN-Zr ceramic remains amorphous when pyrolyzed below 1600 °C, but the crystal phases of Zr2CN, ZrC, BN, SiC, and Si3N4 were detected from a 1600 °C treated sample. Due to the low activity of free carbon at the interface of the SiBCN-Zr ceramic, the oxidation resistance of the SiBCN-Zr ceramic under air was improved compared with the SiBCN ceramic.

Effect of natural ageing on microstructure and mechanical properties of Mg–10Gd–2Y–0.8Zr Alloy

Energy Technology Data Exchange (ETDEWEB)

Yang, Z., E-mail: yz750925@163.com; Duan, H.B.; Wang, Z.H.; Guo, Y.C.; Gao, P.H.; Li, J.P., E-mail: jp_li0416@163.com

2015-11-11

The effect of natural aging on the microstructure and mechanical properties of Mg–10 wt%Gd–2 wt%Y–0.5 wt%Zn–0.5 wt%Zr alloy (GW102) was investigated via optical microscopy (OM), field emission gun scanning electron microscopy (FEGSEM), high-resolution transmission electron microscopy (HRTEM), and differential scanning calorimetry (DSC). The results indicated that the natural placement had a significant effect on the microstructure, mechanical properties, and subsequent artificial aging behaviors of the extruded GW102 alloy. The α(Mg) isometric crystal of the as-extruded alloy was composed entirely of deformation structures, formed by several types of cross-slip. However, the deformation structure within α(Mg) was significantly reduced by performing a 3-year natural aging treatment after extrusion. Many strain-free zones were observed near the grain boundary. Moreover, the β″ phase precipitated within the α(Mg) crystalline grains. The alloy was subjected to a 3-year natural aging treatment, followed by artificial aging at 200 °C; the resulting hardness and tensile strength were relatively high during the early stage, but decreased significantly at peak aging and the time required to reach peak aging was shortened. In addition, an aging peak platform (44–132 h) was observed. Moreover, the formation of β″ and the reduction of the deformation zone at natural aging process promoted the subsequent artificial aging process.

Effect of natural ageing on microstructure and mechanical properties of Mg–10Gd–2Y–0.8Zr Alloy

International Nuclear Information System (INIS)

Yang, Z.; Duan, H.B.; Wang, Z.H.; Guo, Y.C.; Gao, P.H.; Li, J.P.

2015-01-01

The effect of natural aging on the microstructure and mechanical properties of Mg–10 wt%Gd–2 wt%Y–0.5 wt%Zn–0.5 wt%Zr alloy (GW102) was investigated via optical microscopy (OM), field emission gun scanning electron microscopy (FEGSEM), high-resolution transmission electron microscopy (HRTEM), and differential scanning calorimetry (DSC). The results indicated that the natural placement had a significant effect on the microstructure, mechanical properties, and subsequent artificial aging behaviors of the extruded GW102 alloy. The α(Mg) isometric crystal of the as-extruded alloy was composed entirely of deformation structures, formed by several types of cross-slip. However, the deformation structure within α(Mg) was significantly reduced by performing a 3-year natural aging treatment after extrusion. Many strain-free zones were observed near the grain boundary. Moreover, the β″ phase precipitated within the α(Mg) crystalline grains. The alloy was subjected to a 3-year natural aging treatment, followed by artificial aging at 200 °C; the resulting hardness and tensile strength were relatively high during the early stage, but decreased significantly at peak aging and the time required to reach peak aging was shortened. In addition, an aging peak platform (44–132 h) was observed. Moreover, the formation of β″ and the reduction of the deformation zone at natural aging process promoted the subsequent artificial aging process.

Mechanical and dynamical behaviors of ZrSi and ZrSi{sub 2} bulk metallic glasses: A molecular dynamics study

Energy Technology Data Exchange (ETDEWEB)

Ju, Shin-Pon, E-mail: jushin-pon@mail.nsysu.edu.tw [Department of Mechanical and Electro-Mechanical Engineering, National Sun Yat-sen University, Kaohsiung 804, Taiwan (China); Department of Medicinal and Applied Chemistry, Kaohsiung Medical University, Kaohsiung 807, Taiwan (China); Wu, Tsang-Yu; Liu, Shih-Hao [Department of Mechanical and Electro-Mechanical Engineering, National Sun Yat-sen University, Kaohsiung 804, Taiwan (China)

2015-03-14

The mechanical and dynamical properties of ZrSi and ZrSi{sub 2} bulk metallic glasses (BMGs) have been investigated by molecular dynamics simulation. The Honeycutt-Anderson (HA) index analysis indicates that the major indexes in ZrSi and ZrSi{sub 2} bulk metallic glasses are 1551, 1541, and 1431, which refers to the liquid structure. For uniaxial tension, the results show that the ZrSi and ZrSi{sub 2} BMGs are more ductile than their crystal counterparts. The evolution of the distribution of atomic local shear strain clearly shows the initialization of shear transformation zones (STZs), the extension of STZs, and the formation of shear bands along a direction 45° from the tensile direction when the tensile strain gradually increases. The self-diffusion coefficients of ZrSi and ZrSi{sub 2} BMGs at temperatures near their melting points were calculated by the Einstein equation according to the slopes of the MSD profiles at the long-time limit. Because the HA fraction summation of icosahedral-like structures of ZrSi BMG is higher than that of ZrSi{sub 2} BMG, and these local structures are more dense, the self-diffusion coefficients of the total, Zr, and Si atoms of ZrSi{sub 2} BMG are larger than those of ZrSi BMG. This can be attributed to the cage effect, where a denser local structure has a higher possibility of atoms jumping back to form a backflow and then suppress atomic diffusivity. For ZrSi{sub 2} BMG, the self-diffusion coefficient of Si increases with temperature more significantly than does that of Zr, because more open packing rhombohedra structures are formed by the Si-Si pair.

Moessbauer spectroscopy of the Zr-rich region in Zr-Nb-Fe alloys with low Nb content

International Nuclear Information System (INIS)

Ramos, C.; Saragovi, C.; Granovsky, M.; Arias, D.

1999-01-01

Intermetallic phases and solid solutions in the Zr-rich region of the Zr-Nb-Fe system with low Nb content are studied by Moessbauer spectroscopy complemented with X-ray diffraction, optical and scanning electron microscopy and electron microprobe analysis. The phases found in each sample were those expected from the corresponding binary Zr-Fe system. Furthermore, one of the samples showed a ternary cubic Ti 2 Ni type phase with a similar stoichiometry to the tetragonal Zr 2 Fe compound. Moessbauer parameters were suggested to this phase (IS: - 0.12 mm/s, QS: 0.30 mm/s), to the bcc Zr(β) phase (IS: (-0.11 α 0.01) mm/s, QS: (0.23 α 0.02) mm/s), and to the hcp Zr(β T ) phase (IS: (-0.24 α 0.02) mm/s, QS: (0.45 α 0.02) mm/s)

Microstructure control of Zr-Nb-Sn alloy with Mo addition for HWR pressure tube application

International Nuclear Information System (INIS)

Hwang, S. K.; Kim, M. H.; Kim, J. H.; Kwon, S. I.; Kim, Y. S.

1997-01-01

As a basic research to develop the material for heavy water reactor pressure tube application the effect of Mo addition to Zr-Nb-Sn alloy was studied for the purpose of minimizing the amount of cold working while maintaining a high strength. To select the target alloy system we first designed various alloy compositions and chose Zr-Nb-Sn and Zr-Nb-Mo through multi-regression analysis of the relationship between the basic properties and the compositions. Plasma arc melting was used to produce the alloys and the microstructure change introduced by the processing steps including hot forging, beta-heat treatment, hot rolling, cold rolling and recrystallization heat treatment was investigated. Recrystallization of Zr-Nb-Sn was retarded by adding Mo and this resulted in a fine grain structure in Zr-Nb-Sn-Mo alloy. Beside the retarding effect recrystallization, Mo increased the amount of residual beta phase and showed an indication of precipitation hardening, which added up to the possibility of applying the alloy for the desired usage. (author)

The preparation of Zr-deuteride and phase stability studies of the Zr-D system

Energy Technology Data Exchange (ETDEWEB)

Maimaitiyili, T., E-mail: tuerdi.maimaitiyili@mah.se [Materials Science and Applied Mathematics, Malmö University, Nordenskiöldsgatan 1, 20506 Malmö (Sweden); Steuwer, A. [Nelson Mandela Metropolitan University, Gardham Avenue, 6031 Port Elizabeth (South Africa); Bjerkén, C.; Blomqvist, J. [Materials Science and Applied Mathematics, Malmö University, Nordenskiöldsgatan 1, 20506 Malmö (Sweden); Hoelzel, M. [Forschungsneutronenquelle Heinz-Maier-Leibnitz (FRM II), Technische Universität Muünchen, Lichtenbergstr. 1, D-85747 Garching (Germany); Ion, J.C. [Materials Science and Applied Mathematics, Malmö University, Nordenskiöldsgatan 1, 20506 Malmö (Sweden); Zanellato, O. [PIMM, Ensam - Cnam - CNRS, 151 Boulevard de l' Hôpital, 75013 Paris (France)

2017-03-15

Deuteride phases in the zirconium-deuterium system in the temperature range 25–286 °C have been studied in-situ by high resolution neutron diffraction. The study primarily focused on observations of δ→γ transformation at 180 °C, and the peritectoid reaction α + δ ↔ γ at 255 °C in commercial grade Zr powder that was deuterated to a deuterium/Zr ratio of one to one. A detailed description of the zirconium deuteride preparation route by high temperature gas loading is also described. The lattice parameters of α-Zr, δ-ZrD{sub x} and ε-ZrD{sub x} were determined by whole pattern crystal structure analysis, using Rietveld and Pawley refinements, and are in good agreement with values reported in the literature. The controversial γ-hydride phase was observed both in-situ and ex-situ in deuterated Zr powder after a heat treatment at 286 °C and slow cooling. - Highlights: • Controversial γ phase observed both in-situ and ex-situ after heat treatments. • γ-ZrD is observed at room temperature after 5 h of heat treatment at 286 °C. • Presence of α + δ ↔ γ at 255 °C was not observed. • It was observed that there is a δ → γ transformation present around 150 °C.

{sup 89}Zr-labeled nivolumab for imaging of T-cell infiltration in a humanized murine model of lung cancer

Energy Technology Data Exchange (ETDEWEB)

England, Christopher G.; Ehlerding, Emily B.; Ellison, Paul A.; Hernandez, Reinier; Barnhart, Todd E. [University of Wisconsin - Madison, Department of Medical Physics, Madison, WI (United States); Jiang, Dawei [Health Science Center, Shenzhen University, Guangdong Key Laboratory for Biomedical Measurements and Ultrasound Imaging, School of Biomedical Engineering, Guangzhou (China); University of Wisconsin - Madison, Department of Radiology, Madison, WI (United States); Rekoske, Brian T. [University of Wisconsin - Madison, Department of Medicine, Madison, WI (United States); McNeel, Douglas G. [University of Wisconsin - Madison, Department of Medicine, Madison, WI (United States); University of Wisconsin Carbone Cancer Center, Madison, WI (United States); Huang, Peng [Health Science Center, Shenzhen University, Guangdong Key Laboratory for Biomedical Measurements and Ultrasound Imaging, School of Biomedical Engineering, Guangzhou (China); Cai, Weibo [University of Wisconsin - Madison, Department of Medical Physics, Madison, WI (United States); University of Wisconsin - Madison, Department of Radiology, Madison, WI (United States); University of Wisconsin Carbone Cancer Center, Madison, WI (United States)

2018-01-15

Nivolumab is a human monoclonal antibody specific for programmed cell death-1 (PD-1), a negative regulator of T-cell activation and response. Acting as an immune checkpoint inhibitor, nivolumab binds to PD-1 expressed on the surface of many immune cells and prevents ligation by its natural ligands. Nivolumab is only effective in a subset of patients, and there is limited evidence supporting its use for diagnostic, monitoring, or stratification purposes. {sup 89}Zr-Df-nivolumab was synthesized to map the biodistribution of PD-1-expressing tumor infiltrating T-cells in vivo using a humanized murine model of lung cancer. The tracer was developed by radiolabeling the antibody with the positron emitter zirconium-89 ({sup 89}Zr). Imaging results were validated by ex vivo biodistribution studies, and PD-1 expression was validated by immunohistochemistry. Data obtained from PET imaging were used to determine human dosimetry estimations. The tracer showed elevated binding to stimulated PD-1 expressing T-cells in vitro and in vivo. PET imaging of {sup 89}Zr-Df-nivolumab allowed for clear delineation of subcutaneous tumors through targeting of localized activated T-cells expressing PD-1 in the tumors and salivary glands of humanized A549 tumor-bearing mice. In addition to tumor uptake, salivary and lacrimal gland infiltration of T-cells was noticeably visible and confirmed via histological analysis. These data support our claim that PD-1-targeted agents allow for tumor imaging in vivo, which may assist in the design and development of new immunotherapies. In the future, noninvasive imaging of immunotherapy biomarkers may assist in disease diagnostics, disease monitoring, and patient stratification. (orig.)

Potentiodynamic polarization studies of bulk amorphous alloy Zr57Cu15.4Ni12.6Al10Nb5 and Zr59Cu20Ni8Al10Ti3 in aqueous HNO3 media

International Nuclear Information System (INIS)

Sharma, Poonam; Dhawan, Anil; Jayraj, J.; Kamachi Mudali, U.

2013-01-01

The potentiodynamic polarization studies were carried out on Zr based bulk amorphous alloy Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 and Zr 59 Cu 20 Ni 8 Al 10 Ti 3 in solutions of 1 M, 6 M and 11.5 M HNO 3 aqueous media at room temperature. As received specimens of Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 (5 mm diameter rod) and Zr 59 Cu 20 Ni 8 Al 10 Ti 3 (3 mm diameter rod) were polished with SiC paper before testing them for potentiodynamic polarization studies. The amorphous nature of the specimens was checked by X-ray diffraction. The bulk amorphous alloy Zr 59 Cu 20 Ni 8 Al 10 Ti 3 shows the better corrosion resistance than Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 alloy in the aqueous HNO 3 media as the value of the corrosion current density (I corr ) for Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 alloy were found to be more than Zr 59 Cu 20 Ni 8 Al 10 Ti 3 alloy in aqueous HNO 3 media. The improved corrosion resistance of Zr 59 Cu 20 Ni 8 Al 10 Ti 3 alloy is possibly due to the presence of Ti and formation of TiO 2 during anodic oxidation. Both Zr based bulk amorphous alloys shows wider passive range at lower concentration of nitric acid and the passive region gets narrowed down with the increase in concentration. A comparison of data obtained from both the Zr-based bulk amorphous alloys is made and results are discussed in the paper. (author)

Creep properties of annealed Zr-Nb-O and stress-relieved Zr-Nb-Sn-Fe cladding tubes and their performance comparison

International Nuclear Information System (INIS)

Ko, S.; Hong, S.I.; Kim, K.T.

2010-01-01

Creep properties of annealed Zr-Nb-O and stress-relieved Zr-Nb-Sn-Fe cladding tubes were studied and compared. The creep rates of the annealed Zr-Nb-O alloy were found to be greater than those of the stress-relieved Zr-Nb-Sn-Fe alloy. Zr-Nb-O alloy was found to have stress exponents of 5-7 independent of stress level whereas Zr-Nb-Sn-Fe alloy exhibited the transition of the stress exponent from 6.5 to 7.5 in the lower stress region to ∼4.2 in the higher stress region. The reduction of stress exponent at high stresses in Zr-Nb-Sn-Fe can be explained in terms of the dynamic solute-dislocation effect caused by Sn atoms. The constancy of stress exponent without the transition was observed in Zr-Nb-O alloy, supporting that the decrease of the stress exponent with increasing stress in Zr-Nb-Sn-Fe is associated with Sn atoms. The difference of creep life between annealed Zr-Nb-O and stress-relieved Zr-Nb-Sn-Fe is not large considering the large difference of strength level between annealed Zr-Nb-O and annealed stress-relieved Zr-Nb-Sn-Fe. The better-than-expected creep life of annealed Zr-Nb-O alloy can be attributable to the combined effects of creep ductility enhancement associated with softening and the decreased contribution of grain boundary diffusion due to the increased grain size.

Simulation of the Atomic and Electronic Structure of Oxygen Vacancies and Polyvacancies in ZrO2

Science.gov (United States)

Perevalov, T. V.

2018-03-01

Cubic, tetragonal, and monoclinic phases of zirconium oxide with oxygen vacancies and polyvacancies are studied by quantum chemical modeling of the atomic and electronic structure. It is demonstrated that an oxygen vacancy in ZrO2 may act as both an electron trap and a hole one. An electron added to the ZrO2 structure with an oxygen vacancy is distributed between two neighboring Zr atoms and is a bonding orbital by nature. It is advantageous for each subsequent O vacancy to form close to the already existing ones; notably, one Zr atom has no more than two removed O atoms related to it. Defect levels from oxygen polyvacancies are distributed in the bandgap with preferential localization in the vicinity of the oxygen monovacancy level.

Investigation of electronic, magnetic and thermoelectric properties of Zr{sub 2}NiZ (Z = Al,Ga) ferromagnets

Energy Technology Data Exchange (ETDEWEB)

Yousuf, Saleem, E-mail: nengroosaleem17@gmail.com; Gupta, Dinesh C., E-mail: sosfizix@gmail.com

2017-05-01

Systematic investigation of impact of electronic structure and magnetism, on the thermoelectric properties of new Zr{sub 2}NiZ (Z = Al, Ga) Heusler alloys are determined using density functional theory calculations. Half-metallicity with ferromagnetic character is supported by their 100% spin polarizations at the Fermi level. Magnetic moment of ∼3 μ{sub B} is according to the Slater-Puling rule, enables their practical applications. Electron density plots are used to analyse the nature of bonding and chemical composition. Boltzmann's theory is conveniently employed to investigate the thermoelectric properties of these compounds. The analysis of the thermal transport properties specifies the Seebeck coefficient as 25.6 μV/K and 18.6 μV/K at room temperature for Zr{sub 2}NiAl and Zr{sub 2}NiGa, respectively. The half-metallic nature with efficient thermoelectric coefficients suggests the likelihood of these materials to have application in designing spintronic devices and imminent thermoelectric materials. - Highlights: • The compounds are half-metallic ferromagnets. • 100% spin-polarized compounds for spintronics. • Increasing Seebeck coefficient over a wide temperature range. • Zr{sub 2}NiAl is efficient thermoelectric material than Zr{sub 2}NiGa.

Moessbauer spectroscopy of the Zr-rich region in Zr-Nb-Fe alloys with low Nb content

Energy Technology Data Exchange (ETDEWEB)

Ramos, C. [Universidad de Buenos, Facultad de Ciencias Exactas y Naturales (Argentina); Saragovi, C. [Departamento de Fisica, Comision Nacional de Energia Atomica (Argentina); Granovsky, M.; Arias, D. [Departamento de Materiales, Comision Nacional de Energia Atomica (Argentina)

1999-11-15

Intermetallic phases and solid solutions in the Zr-rich region of the Zr-Nb-Fe system with low Nb content are studied by Moessbauer spectroscopy complemented with X-ray diffraction, optical and scanning electron microscopy and electron microprobe analysis. The phases found in each sample were those expected from the corresponding binary Zr-Fe system. Furthermore, one of the samples showed a ternary cubic Ti{sub 2}Ni type phase with a similar stoichiometry to the tetragonal Zr{sub 2}Fe compound. Moessbauer parameters were suggested to this phase (IS: - 0.12 mm/s, QS: 0.30 mm/s), to the bcc Zr({beta}) phase (IS: (-0.11 {alpha} 0.01) mm/s, QS: (0.23 {alpha} 0.02) mm/s), and to the hcp Zr({beta}{sup T}) phase (IS: (-0.24 {alpha} 0.02) mm/s, QS: (0.45 {alpha} 0.02) mm/s)

89Zr-Oxine Complex PET Cell Imaging in Monitoring Cell-based Therapies

Science.gov (United States)

Wu, Haitao; Asiedu, Kingsley O.; Szajek, Lawrence P.; Griffiths, Gary L.; Choyke, Peter L.

2015-01-01

Purpose To develop a clinically translatable method of cell labeling with zirconium 89 (89Zr) and oxine to track cells with positron emission tomography (PET) in mouse models of cell-based therapy. Materials and Methods This study was approved by the institutional animal care committee. 89Zr-oxine complex was synthesized in an aqueous solution. Cell labeling conditions were optimized by using EL4 mouse lymphoma cells, and labeling efficiency was examined by using dendritic cells (DCs) (n = 4), naïve (n = 3) and activated (n = 3) cytotoxic T cells (CTLs), and natural killer (NK) (n = 4), bone marrow (n = 4), and EL4 (n = 4) cells. The effect of 89Zr labeling on cell survival, proliferation, and function were evaluated by using DCs (n = 3) and CTLs (n = 3). Labeled DCs (444–555 kBq/[5 × 106] cells, n = 5) and CTLs (185 kBq/[5 × 106] cells, n = 3) transferred to mice were tracked with microPET/CT. In a melanoma immunotherapy model, tumor targeting and cytotoxic function of labeled CTLs were evaluated with imaging (248.5 kBq/[7.7 × 106] cells, n = 4) and by measuring the tumor size (n = 6). Two-way analysis of variance was used to compare labeling conditions, the Wilcoxon test was used to assess cell survival and proliferation, and Holm-Sidak multiple tests were used to assess tumor growth and perform biodistribution analyses. Results 89Zr-oxine complex was synthesized at a mean yield of 97.3% ± 2.8 (standard deviation). It readily labeled cells at room temperature or 4°C in phosphate-buffered saline (labeling efficiency range, 13.0%–43.9%) and was stably retained (83.5% ± 1.8 retention on day 5 in DCs). Labeling did not affect the viability of DCs and CTLs when compared with nonlabeled control mice (P > .05), nor did it affect functionality. 89Zr-oxine complex enabled extended cell tracking for 7 days. Labeled tumor-specific CTLs accumulated in the tumor (4.6% on day 7) and induced tumor regression (P cell tracking technique for use with PET that is

(89)Zr-Oxine Complex PET Cell Imaging in Monitoring Cell-based Therapies.

Science.gov (United States)

Sato, Noriko; Wu, Haitao; Asiedu, Kingsley O; Szajek, Lawrence P; Griffiths, Gary L; Choyke, Peter L

2015-05-01

To develop a clinically translatable method of cell labeling with zirconium 89 ((89)Zr) and oxine to track cells with positron emission tomography (PET) in mouse models of cell-based therapy. This study was approved by the institutional animal care committee. (89)Zr-oxine complex was synthesized in an aqueous solution. Cell labeling conditions were optimized by using EL4 mouse lymphoma cells, and labeling efficiency was examined by using dendritic cells (DCs) (n = 4), naïve (n = 3) and activated (n = 3) cytotoxic T cells (CTLs), and natural killer (NK) (n = 4), bone marrow (n = 4), and EL4 (n = 4) cells. The effect of (89)Zr labeling on cell survival, proliferation, and function were evaluated by using DCs (n = 3) and CTLs (n = 3). Labeled DCs (444-555 kBq/[5 × 10(6)] cells, n = 5) and CTLs (185 kBq/[5 × 10(6)] cells, n = 3) transferred to mice were tracked with microPET/CT. In a melanoma immunotherapy model, tumor targeting and cytotoxic function of labeled CTLs were evaluated with imaging (248.5 kBq/[7.7 × 10(6)] cells, n = 4) and by measuring the tumor size (n = 6). Two-way analysis of variance was used to compare labeling conditions, the Wilcoxon test was used to assess cell survival and proliferation, and Holm-Sidak multiple tests were used to assess tumor growth and perform biodistribution analyses. (89)Zr-oxine complex was synthesized at a mean yield of 97.3% ± 2.8 (standard deviation). It readily labeled cells at room temperature or 4°C in phosphate-buffered saline (labeling efficiency range, 13.0%-43.9%) and was stably retained (83.5% ± 1.8 retention on day 5 in DCs). Labeling did not affect the viability of DCs and CTLs when compared with nonlabeled control mice (P > .05), nor did it affect functionality. (89)Zr-oxine complex enabled extended cell tracking for 7 days. Labeled tumor-specific CTLs accumulated in the tumor (4.6% on day 7) and induced tumor regression (P cell tracking technique for use with PET that is applicable to a broad range of

Thermoactivation processes in PbI2:Zr and PbI2 crystals

International Nuclear Information System (INIS)

Panasyuk, M.R.; Kapustyanik, V.B.; Tsibul's'kij, V.S.; Dubov, Yu.G.; Pasternak, R.M.

2007-01-01

The X-ray luminescence, thermal emission and thermally stimulated depolarisation spectra as well as the influence of IR-illumination on the thermal emission and thermally stimulated depolarisation spectra of the PbI 2 :Zr and PbI 2 crystals have been studied. There were found the hole traps in the PbI 2 :Zr crystals that are absent in PbI 2 . For the observed traps the activation energy has been calculated. The mechanisms describing the traps' nature and that of thermally stimulated depolarisation currents have been proposed

Skin effect suppression for Cu/CoZrNb multilayered inductor

Science.gov (United States)

Sato, Noriyuki; Endo, Yasushi; Yamaguchi, Masahiro

2012-04-01

The Cu/Co85Zr3Nb12 multilayer is studied as a conductor of a spiral inductor to suppress the skin effect at the 5 GHz range (matches IEEE 802.11 a standard) using negative-permeability in CoZrNb films beyond the ferromagnetic resonance frequency. The skin effect suppression becomes remarkable when the thickness of Cu in each period of the multilayer, tCu, is less than the skin depth of Cu at the targeting frequency. For the 5 GHz operation, tCu ≤ 750 nm. The resistance of the Cu/CoZrNb multilayered spiral inductor decreases as much as 8.7%, while keeping the same inductance of 1.1 nH as that of a similar air core. Accordingly, Q = 16. Therefore, the proposed method can contribute to realize a high-Q spiral inductor. We also study the potentially applicable frequency of this method. Given a soft magnetic material with Ms = 105 emu/cc and Hk = 5 Oe, the method can be applied at 700 MHz, the lowermost carrier frequency band for the 4th generation cellular phone system.

Thermodynamic description of the Ta-W-Zr system

International Nuclear Information System (INIS)

Guo, Cuiping; Li, Changrong; Du, Zhenmin; Shang, Shunli

2014-01-01

The Ta-W, W-Zr and Ta-W-Zr systems are critically reviewed and modeled using the CALPHAD technique. The enthalpy of formation of the stoichiometric compound W 2 Zr in the W-Zr system is predicted from first-principles calculations. The solution phases (liquid, bcc and hcp) are modeled by the substitutional solution model. The compound W 2 Zr is treated with the formula (Ta,W) 2 Zr in the Ta-W-Zr system because of a significant solid solubility of Ta in W 2 Zr. All experimental data, including the Gibbs energy of formation, enthalpy of formation, activity of Ta and W of bcc phase at 1 200 K, Ta-W and W-Zr phase diagrams, and three isothermal sections of the Ta-W-Zr system at 1 073, 1 098, and 1 873 K, are reproduced in the present work. A set of self-consistent thermodynamic parameters of the Ta-W-Zr system is obtained.

Arc melting and homogenization of ZrC and ZrC + B alloys

Science.gov (United States)

Darolia, R.; Archbold, T. F.

1973-01-01

A description is given of the methods used to arc-melt and to homogenize near-stoichiometric ZrC and ZrC-boron alloys, giving attention to the oxygen contamination problem. The starting material for the carbide preparation was ZrC powder with an average particle size of 4.6 micron. Pellets weighing approximately 3 g each were prepared at room temperature from the powder by the use of an isostatic press operated at 50,000 psi. These pellets were individually melted in an arc furnace containing a static atmosphere of purified argon. A graphite resistance furnace was used for the homogenization process.

Ternary semiconductors NiZrSn and CoZrBi with half-Heusler structure: A first-principles study

Science.gov (United States)

Fiedler, Gregor; Kratzer, Peter

2016-08-01

The ternary semiconductors NiZrSn and CoZrBi with C 1b crystal structure are introduced by calculating their basic structural, electronic, and phononic properties using density functional theory. Both the gradient-corrected PBE functional and the hybrid functional HSE06 are employed. While NiZrSn is found to be a small-band-gap semiconductor (Eg=0.46 eV in PBE and 0.60 eV in HSE06), CoZrBi has a band gap of 1.01 eV in PBE (1.34 eV in HSE06). Moreover, effective masses and deformation potentials are reported. In both materials A B C , the intrinsic point defects introduced by species A (Ni or Co) are calculated. The Co-induced defects in CoZrBi are found to have a higher formation energy compared to Ni-induced defects in NiZrSn. The interstitial Ni atom (Nii) as well as the VNiNii complex introduce defect states in the band gap, whereas the Ni vacancy (VNi) only reduces the size of the band gap. While Nii is electrically active and may act as a donor, the other two types of defects may compensate extrinsic doping. In CoZrBi, only the VCoCoi complex introduces a defect state in the band gap. Motivated by the reported use of NiZrSn for thermoelectric applications, the Seebeck coefficient of both materials, both in the p -type and the n -type regimes, is calculated. We find that CoZrBi displays a rather large thermopower of up to 500 μ V /K when p doped, whereas NiZrSn possesses its maximum thermopower in the n -type regime. The reported difficulties in achieving p -type doping in NiZrSn could be rationalized by the unintended formation of Nii2 + in conjunction with extrinsic acceptors, resulting in their compensation. Moreover, it is found that all types of defects considered, when present in concentrations as large as 3%, tend to reduce the thermopower compared to ideal bulk crystals at T =600 K. For NiZrSn, the calculated thermodynamic data suggest that additional Ni impurities could be removed by annealing, leading to precipitation of a metallic Ni2ZrSn phase.

Collectivity of high spin states in {sup 84}Zr

Energy Technology Data Exchange (ETDEWEB)

Lister, C.J.; Blumenthal, D.; Crowell, B. [and others

1995-08-01

{sup 84}Zr is one of the most extensively studied of the A {approximately} 80 rotors, both from theoretical and experimental approaches. It was predicted to be a good candidate to support superdeformation, and to show interesting spectroscopic properties including saturation of its shell-model space at lower spin. We performed an experiment using Gammasphere in its early implementation phase. The reaction of {sup 29}Si on {sup 58}Ni was used to strongly populate {sup 84}Zr at high spin. Thin and thick targets were used to allow the extraction of transitional matrix elements at very high spin, and to allow a sensitive search for superdeformed states. Data analysis is in progress. The large data set allowed us to extend the previously known bands considerably. Candidates for a staggered M1-band, found previously {sup 86}Zr, were located. To date, no evidence for superdeformed bands was found. Analysis was slowed by the relocation of all the participants in this experiment, but we hope to complete the lifetime analysis this year. This analysis has become especially topical, due to reported measurements of superdeformation in this region.

Biological Properties of Ti-Nb-Zr-O Nanostructures Grown on Ti35Nb5Zr Alloy

Directory of Open Access Journals (Sweden)

Zhaohui Li

2012-01-01

Full Text Available Surface modification of low modulus implant alloys with oxide nanostructures is one of the important ways to achieve favorable biological behaviors. In the present work, amorphous Ti-Nb-Zr-O nanostructures were grown on a peak-aged Ti35Nb5Zr alloy through anodization. Biological properties of the Ti-Nb-Zr-O nanostructures were investigated through in vitro bioactivity testings, stem cell interactions, and drug release experiments. The Ti-Nb-Zr-O nanostructures demonstrated a good capability of inducing apatite formation after immersion in simulated body fluids (SBFs. Drug delivery experiment based on gentamicin and the Ti-Nb-Zr-O nanostructures indicated that a high drug loading content could result in a prolonged release process and a higher quantity of drug residues in the oxide nanostructures after drug release. Quick stem cell adhesion and spreading, as well as fast formation of extracellular matrix materials on the surfaces of the Ti-Nb-Zr-O nanostructures, were found. These findings make it possible to further explore the biomedical applications of the Ti-Nb-Zr-O nanostructure modified alloys especially clinical operation of orthopaedics by utilizing the nanostructures-based drug-release system.

Study on technology for laboratory scale production of Zirconium Chloride (ZrCl4) by chlorinating Zirconium dioxide (ZrO2)

International Nuclear Information System (INIS)

Nguyen Van Sinh

2007-01-01

ZrCl 4 is used as a main material for producing metallic zirconium. There are four methods for obtaining ZrCl 4 . The method of chlorination of ZrO 2 was selected and some instruments have been made for the study (to produce ZrCl 4 in laboratory scale). A procedure of preparing ZrCl 4 on the obtained instruments was set up and a small amount of ZrCl 4 was successfully obtained. (author)

Oxidation study of Ta–Zr coatings

Energy Technology Data Exchange (ETDEWEB)

Chen, Yung-I, E-mail: yichen@mail.ntou.edu.tw; Chen, Sin-Min

2013-02-01

Refractory metal alloy coatings, such as Mo–Ru and Ta–Ru coatings, have been developed to protect glass molding dies. Forming intermetallic compounds in the coatings inhibits grain growth in high temperature environments when mass producing optical components. After annealing in oxygen containing atmospheres, a surface roughening of the Mo–Ru coatings and a soft oxide layer on the Ta–Ru coatings have been observed in our previous works. Oxidation resistance becomes critical in high-temperature applications. In this study, Ta–Zr coatings were deposited with a Ti interlayer on silicon wafers using direct current magnetron sputtering at 400 °C. The as-deposited Ta–Zr coatings possessed nanocrystallite or amorphous states, depending on the chemical compositions. The annealing treatments were conducted at 600 °C under atmospheres of 50 ppm O{sub 2}–N{sub 2} or 1% O{sub 2}–Ar, respectively. After the annealing treatment, this study investigated variations in crystalline structure, hardness, surface roughness, and chemical composition profiles. Preferential oxidation of Zr in the Ta–Zr coatings was verified using X-ray photoelectron spectroscopy, and the microstructure was observed using transmission electron microscopy. - Highlights: ►The as-deposited Ta-rich Ta–Zr coatings revealed an amorphous structure. ►The Zr-rich coatings presented a crystalline β-Zr phase and an amorphous matrix. ►Zr oxidized preferentially as Ta–Zr coatings annealed at 600 °C. ►The hardness of coatings revealed a parabolic relationship with the oxygen content. ►A protective oxide scale formed on the surface of the crystallized Zr-rich coatings.

Production of Y-86 and other radiometals for research purposes using a solution target system

International Nuclear Information System (INIS)

Oehlke, Elisabeth; Hoehr, Cornelia; Hou, Xinchi; Hanemaayer, Victoire; Zeisler, Stefan; Adam, Michael J.; Ruth, Thomas J.; Celler, Anna; Buckley, Ken; Benard, Francois; Schaffer, Paul

2015-01-01

Introduction: Diagnostic radiometals are typically obtained from cyclotrons by irradiating solid targets or from radioisotope generators. These methods have the advantage of high production yields, but require additional solid target handling infrastructure that is not readily available to many cyclotron facilities. Herein, we provide an overview of our results regarding the production of various positron-emitting radiometals using a liquid target system installed on a 13 MeV cyclotron at TRIUMF. Details about the production, purification and quality control of 89 Zr, 68 Ga and for the first time 86 Y are discussed. Methods: Aqueous solutions containing 1.35–1.65 g/mL of natural-abundance zinc nitrate, yttrium nitrate, and strontium nitrate were irradiated on a 13 MeV cyclotron using a standard liquid target. Different target body and foil materials were investigated for corrosion. Production yields were calculated using theoretical cross-sections from the EMPIRE code and compared with experimental results. The radioisotopes were extracted from irradiated target material using solid phase extraction methods adapted from previously reported methods, and used for radiolabelling experiments. Results: We demonstrated production quantities that are sufficient for chemical and biological studies for three separate radiometals, 89 Zr (A sat = 360 MBq/μA and yield = 3.17 MBq/μA), 86 Y (A sat = 31 MBq/μA and yield = 1.44 MBq/μA), and 68 Ga (A sat = 141 MBq/μA and yield = 64 MBq/μA) from one hour long irradiations on a typical medical cyclotron. 68 Ga yields were sufficient for potential clinical applications. In order to avoid corrosion of the target body and target foil, nitrate solutions were chosen as well as niobium as target-body material. An automatic loading system enabled up to three production runs per day. The separation efficiency ranged from 82 to 99%. Subsequently, 68 Ga and 86 Y were successfully used to radiolabel DOTA-based chelators while

Structural and mechanical properties of ZrSiN thin films prepared by reactive magnetron sputtering

International Nuclear Information System (INIS)

Freitas, F.G.R.; Conceicao, A.G.S.; Vitoria, E.R.; Carvalho, R.G.; Tentardini, E.K.; Hübler, R.; Soares, G.

2014-01-01

Zirconium silicon nitride (ZrSiN) thin films were deposited by reactive magnetron sputtering in order to verify the silicon influence on coating morphology and mechanical properties. The Si/(Zr+Si) ratio was adjusted between 0 to 14.5% just modifying the power applied on the silicon target. Only peaks associated to ZrN crystalline structure were observed in XRD analysis, since Si_3N_4 phase was amorphous. All samples have (111) preferred orientation, but there is a peak intensity reduction and a broadening increase for the sample with the highest Si/(Zr+Si) ratio (14.5%), demonstrating a considerable loss of crystallinity or grain size reduction (about 8 nm calculated by Scherrer). It was also observed that the texture coefficient for (200) increases with silicon addition. Chemical composition and thickness of the coatings were determined by RBS analysis. No significant changes in nano hardness with increasing Si content were found. The thin film morphology observed by SEM presents columnar and non columnar characteristics. The set of results suggests that Si addition is restricting the columnar growth of ZrN thin films. This conclusion is justified by the fact that Si contributes to increase the ZrN grains nucleation during the sputtering process. (author)

Neutron separation energies of Zr isotopes

International Nuclear Information System (INIS)

Gomes, L.C.; Dietzsch, O.

1976-01-01

Q values are reported for (d,t) reactions on all the stable isotopes of zirconium. The neutron separation energies of 94 Zr and 96 Zr differ greatly (by 27.5 and 22.1 keV, respectively) from the values in the 1971 Atomic Mass Evaluation. These results combined with those from other authors seem to indicate that the 1971 values for the masses of 93 Zr and 95 Zr are in error. (orig.) [de

Structure and superconducting properties of Nb-Zr alloy films made by a high-rate sputtering

International Nuclear Information System (INIS)

Sekine, Hisashi; Inoue, Kiyoshi; Tachikawa, Kyoji

1978-01-01

Superconducting Nb-Zr alloy films have been prepared by a continuous high-rate sputtering on tantalum substrates. A deposition rate of 330 nm/min has been attained. The compositional profile in the Nb-Zr film is quite uniform and the film has nearly the same composition as that of the target. The films deposited in a pure argon atmosphere show a columnar structure grown perpendicular to the substrate. The grain size strongly depends on the substrate temperature. The phase transformations in the Nb-Zr film become more apparent and the structure becomes closer to the equilibrium state as the film is deposited in higher atmosphere pressures and/or at lower target voltages. The superconducting transition temperature T sub(c) of the films is about the same as that of bulk samples. The dependence of T sub(c) on the substrate temperature is explainable on the phase transformations in the film. Critical current density J sub(c) and its anisotropy is closely related to the grain structure of the film. Grain boundaries seem to act as the most predominant flux pinning centers in the films. Effects of oxygen in the sputtering atmosphere on the structure and superconducting properties of the Nb-Zr films have been also investigated. Oxygen significantly decreases the grain size of the film. Oxygen increases J sub(c) but decreases T sub(c) of the film. (auth.)

Study of the effect of the silver content on the structural and mechanical behavior of Ag–ZrCN coatings for orthopedic prostheses

Energy Technology Data Exchange (ETDEWEB)

Ferreri, I., E-mail: isabelferreri@gmail.com [GRF-CFUM, University of Minho, Campus of Azurém, 4800-058 Guimarães (Portugal); CEB, Centre for Biological Engineering, University of Minho, Campus of Gualtar, 4700-057 (Portugal); Lopes, V. [GRF-CFUM, University of Minho, Campus of Azurém, 4800-058 Guimarães (Portugal); Calderon V, S. [GRF-CFUM, University of Minho, Campus of Azurém, 4800-058 Guimarães (Portugal); SEG-CEMUC, Mechanical Engineering Department, University of Coimbra, 3030-788 Coimbra (Portugal); Tavares, C.J. [GRF-CFUM, University of Minho, Campus of Azurém, 4800-058 Guimarães (Portugal); Cavaleiro, A. [SEG-CEMUC, Mechanical Engineering Department, University of Coimbra, 3030-788 Coimbra (Portugal); Carvalho, S. [GRF-CFUM, University of Minho, Campus of Azurém, 4800-058 Guimarães (Portugal); SEG-CEMUC, Mechanical Engineering Department, University of Coimbra, 3030-788 Coimbra (Portugal)

2014-09-01

With the increase of elderly population and health problems that are arising nowadays, hip joint prostheses are being widely used. However, it is estimated that 20% of hip replacement surgeries simply fails after few years, mainly due to wear fatigue. Bearing this in mind, this work reports on the development of new coatings that are able to sustain long and innocuous life inside the patient, which will confer to the usual biomaterials improved physical, mechanical and tribological properties. In particular, the development of multifunctional coatings based on Ag-ZrCN, prepared by DC reactive magnetron sputtering using two targets, Zr and a modified Zr target, in an Ar + C{sub 2}H{sub 2} + N{sub 2} atmosphere. Silver pellets were placed in the erosion area of the alloyed Zr target in order to obtain a silver content up to 8 at.%. The structural results obtained by x-ray diffraction show that the coatings crystallize in a NaCl crystal structure typical of ZrC{sub 1-x}N{sub x}. The increase of Ag content promoted the formation of an additional a-CN{sub x} amorphous phase, besides a silver crystalline phase. Hardness is decreasing, as increasing silver content. Despite the low thicknesses, adhesion values (L{sub C3}) can be considered as good. Dynamic fatigue results suggest that these coatings system can be a real asset in terms of mechanical properties, by improving the performance of usual Stainless Steel 316 L biomaterials. - Highlights: • ZrCN, silver and carbon based amorphous phases, form the structure of the coatings. • Ag–ZrCN coatings have a high capacity to withstand an impact load without fracturing. • Silver incorporation reduces the fatigue failures of the coatings. • The films possess mechanical resistance and biocompatibility, required in prostheses.

Al2TiO5-ZrTiO4-ZrO2 composites

International Nuclear Information System (INIS)

Parker, F.J.

1990-01-01

The characterization and properties of ceramic composites containing the phases Al 2 TiO 5 , ZrTiO 4 , and ZrO 2 are described. The low thermal expansions are apparently due to a combination of microcracking by the titanate phases and a contractive phase transformation by the ZrO 2 . The crystal chemistry and microstructure of the product are processing dependent. Although the composites represent a complex microcracking system, the low thermal expansions and high-temperature stability make them potential candidates for commercial application requiring thermal shock resistance

Observations of a Cast Cu-Cr-Zr Alloy

Science.gov (United States)

Ellis, David L.

2006-01-01

Prior work has demonstrated that Cu-Cr-Nb alloys have considerable advantages over the copper alloys currently used in regeneratively cooled rocket engine liners. Observations indicated that Zr and Nb have similar chemical properties and form very similar compounds. Glazov and Zakharov et al. reported the presence of Cr2Zr in Cu-Cr-Zr alloys with up to 3.5 wt% Cr and Zr though Zeng et al. calculated that Cr2Zr could not exist in a ternary Cu-Cr-Zr alloy. A cast Cu-6.15 wt% Cr-5.25 wt% Zr alloy was examined to determine if the microstructure developed would be similar to GRCop-84 (Cu-6.65 wt% Cr-5.85 wt% Nb). It was observed that the Cu-Cr-Zr system did not form any Cr2Zr even after a thermal exposure at 875 C for 176.5 h. Instead the alloy consisted of three phases: Cu, Cu5Zr, and Cr.

Ultra-thin zirconia films on Zr-alloys

Energy Technology Data Exchange (ETDEWEB)

Choi, Joong Il Jake; Mayr-Schmoelzer, Wernfried; Mittendorfer, Florian; Redinger, Josef; Diebold, Ulrike; Schmid, Michael [Institute of Applied Physics, Vienna University of Technology (Austria); Li, Hao; Rupprechter, Guenther [Institute of Materials Chemistry, Vienna University of Technology (Austria)

2014-07-01

Zirconia ultra-thin films have been prepared by oxidation of Pt{sub 3}Zr(0001) and showed a structure equivalent to (111) of cubic zirconia. Following previous work, we have prepared ultra-thin zirconia by oxidation of a different alloy, Pd{sub 3}Zr(0001), which resulted in a similar structure with a slightly different lattice parameter, 351.2 ±0.4 pm. Unlike the oxide on Pt{sub 3}Zr, where Zr of the oxide binds to Pt in the substrate, here the oxide binds to substrate Zr via oxygen. This causes stronger distortion of the oxide structure, i.e. a stronger buckling of Zr in the oxide. After additional oxidation of ZrO{sub 2}/Pt{sub 3}Zr, a different ultra-thin zirconia phase is observed. A preliminary structure model for this film is based on (113)-oriented cubic zirconia. 3D oxide clusters are also present after growing ultra-thin zirconia films. They occur at the step edges, and the density is higher on Pd{sub 3}Zr. These clusters also appear on terraces after additional oxidation. XPS reveals different core level shifts of the oxide films, bulk, and oxide clusters.

Enhancing Natural Killer Cell Mediated Targeting and Responses to Myeloid Leukemias

Science.gov (United States)

2017-10-01

AWARD NUMBER: W81XWH-16-1-0380 TITLE: Enhancing Natural Killer Cell Mediated Targeting and Responses to Myeloid Leukemias PRINCIPAL...2017 4. TITLE AND SUBTITLE 5a. CONTRACT NUMBER Enhancing Natural Killer Cell Mediated Targeting and Responses to Myeloid Leukemias 5b. GRANT NUMBER...leukemias still have poor prognosis, particularly in the elderly, and require hematopoietic cell transplants to fully kill the tumor, which is both

Influence of Temperature to Thermal Properties of U-Zr Alloy With The Zr Content Variation

International Nuclear Information System (INIS)

Aslina-Br-Ginting; Masrukan; M-Husna-Al-Hasa

2007-01-01

Have been done thermal of characteristic covering heat stability, heat capacities, enthalpy and also phase changes from uranium, zirkonium and U-Zr alloy with the Zr content variation of Zr 2 %, 6 %, 10% and 14% weight. Change of the temperature and composition anticipated will cause the characteristic of thermal to uranium metal, zirkonium and also U-Zr alloy. Therefore at this research was conducted using analysis influence of temperature to thermal of characteristic of uranium, zirkonium and U-Zr alloy with the Zr content variation by using DTA and DSC. Result of analysis indicate that the uranium metal at temperature 662 o C stable in phase α. Above at temperature, uranium metal experience of the phase change indicated by formed the thermochemical reaction as much 3 endothermic peak. At temperature 667.16 o C, happened by the phase change of α become the phase β with the enthalpy 2,3034 cal/g, at temperature 773.05 o C happened by the phase change β becoming phase γ 2,8725 cal/g and also at temperature 1125.26 the o C uranium metal experience the phenomenon become to melt with the enthalpy 2,1316 cal/g. (author)

Microstructures and mechanical properties of Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) ceramics

Energy Technology Data Exchange (ETDEWEB)

Ma, Lei [Key Laboratory for Anisotropy and Texture of Materials (Ministry of Education), Northeastern University, Shenyang, Liaoning 110819 (China); Key Laboratory for Advanced Ceramics and Application of Shenyang, Shenyang University of Chemical Technology, Shenyang, Liaoning 110142 (China); Ma, Weimin, E-mail: maleisy2003@163.com [Key Laboratory for Advanced Ceramics and Application of Shenyang, Shenyang University of Chemical Technology, Shenyang, Liaoning 110142 (China); Sun, Xudong, E-mail: xdsun@mail.neu.edu.cn [Key Laboratory for Anisotropy and Texture of Materials (Ministry of Education), Northeastern University, Shenyang, Liaoning 110819 (China); Ji, Lianyong; Liu, Jianan; Hang, Kai [Key Laboratory for Advanced Ceramics and Application of Shenyang, Shenyang University of Chemical Technology, Shenyang, Liaoning 110142 (China)

2015-09-25

Highlights: • Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composites were prepared using vacuum sintering. • The phase composition and microstructure are studied. • Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) materials show superior mechanical properties. • The solid solution strengthening and stress-induced phase transformation toughening mechanism are proposed. • Two kinds of mechanisms explain the improvement of mechanical properties. - Abstract: Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composite ceramics were prepared by vacuum sintering using Gd{sub 2}Zr{sub 2}O{sub 7} and ZrO{sub 2}(3Y) nanoparticles. The ceramics were characterized using X-ray diffraction (XRD), scanning electron microscopy (SEM), energy dispersive spectrometer (EDS), the three-point-bending technique and single-edge-notched-beam tests. The effect of various proportions of ZrO{sub 2}(3Y) on the phase composition, microstructure, bending strength and fracture toughness of the final Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composite ceramics was also analyzed. The change from m-ZrO{sub 2} to t-ZrO{sub 2} phase contents, before and after fracture, was measured using XRD quantitative phase analysis. The results confirm that, with the increasing content of ZrO{sub 2}(3Y), a phase transition from solid solution to saturated precipitation occurs and the bending strength and fracture toughness of the samples increase gradually. When the content of ZrO{sub 2}(3Y) reached 95 vol.%, the Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composite ceramics had a bending strength of 547 MPa and a fracture toughness of 5.5 MPa m{sup 1/2}, indicating that stress-induced phase transformation toughening was an efficient way to increase the mechanical properties of the Gd{sub 2}Zr{sub 2}O{sub 7} ceramics.

The effect of Zr content on the microstructure, mechanical properties and cell attachment of Ti-35Nb-xZr alloys

International Nuclear Information System (INIS)

Ning Congqin; Zhai Wanyin; Chen Lei; Ding Dongyan; Dai Kerong

2010-01-01

β-type low elastic modulus alloys of the Ti-Nb-Zr system have recently attracted much attention for both orthopedic and dental applications. In the present study, meta-stable β alloys of Ti-35Nb-xZr with different Zr contents were developed. The effect of Zr content on the microstructure, mechanical properties and cell attachment was investigated. It was found that the addition of Zr improved the tensile strength and elongation of Ti-35Nb-xZr alloys, and simultaneously reduced the elastic modulus. Moreover, the Zr element helped to stabilize the β phase. Cell culture work indicated that the addition of Zr enhanced the attachment and spreading of bone marrow stem cells. Cell attachment and spreading on the surface of titanium alloys were dominated not only by the wettability but also by the inherent biocompatibility of alloying elements. The peak-aged alloy with 5 wt% Zr had a highest tensile strength of 874 MPa, while its elastic modulus was only 65 GPa, presenting a much higher strength/modulus ratio than Ti-6Al-4V. The Ti-35Nb-5Zr alloy exhibited a great potential for orthopedic and dental applications.

Synthetic of Zr2Al3C5 material

International Nuclear Information System (INIS)

Leela-Adisorn, U.; Yamaguchi, A.

2005-01-01

Synthesis method of Zr 2 Al 3 C 5 via solid state reaction between Al, ZrC and carbon powder was studied. Al-ZrC-C compact with equivalent mol ratio of Zr 2 Al 3 C 5 was heated up to 1600 C in Ar atmosphere for 1 h and 4 h but ZrC phase still existed as major phase with very small amount of Zr 2 Al 3 C 5 . Because ZrC started to oxidize at low temperature under very low oxygen partial pressure, the same mol ratio of Al-ZrC-C compact was heated at 1600 C in vacuum for 1 h as parallel test. After firing in vacuum, some carbon still exist with small amount of AlZrC 2 occurred with Zr 2 Al 3 C 5 as a main phase, but no ZrC was found. Different result from firing in Ar atmosphere and in vacuum had been discussed here. It was believed that very small amount of impurities in Ar had some effect on the formation of Al-Zr-C compound. The effect of very small amount of impurities in Ar was studied by thermal analysis (DTA/TG) and XRD. It was found that very small amount of impurities in Ar has effect on the reaction between Al, ZrC and carbon by diffusion through the surface and form Zr-C-O-N solid solution. This solid solution cannot differentiate from ZrC by XRD. With help of thermal analysis method (DTA/TG), Zr-C-O-N solid solution can be differentiated from ZrC. Therefore, synthesis of Al-Zr-C compound should be done in vacuum. Zr 2 Al 3 C 5 can be prepared from mixture of Al-ZrC-C with excess amount of Al at 1600 C for 1 h. (orig.)

Measurement of astrophysical S-factors and electron screening potentials for d(d,n)3He reaction in ZrD2, TiD2 and TaD0.5 targets in the ultralow energy region using plasma accelerator

International Nuclear Information System (INIS)

Bystritsky, V.M.; Bystritskii, Vit.M.; Dudkin, G.N.; Filipowicz, M.; Gazi, S.; Huran, J.; Kobzev, A.P.; Mesyats, G.A.; Nechaev, B.A.; Padalko, V.N.; Parzhitskii, S.S.; Pen'kov, F.M.; Philippov, A.V.; Kaminskii, V.L.; Tuleushev, Yu.Zh.; Wozniak, J.

2012-01-01

The present paper is devoted to the study of the electron screening effect influence on the rate of d(d,n) 3 He reaction in the ultralow deuteron collision energy range in the deuterated metals (ZrD 2 , TiD 2 and TaD 0.5 ). The ZrD 2 , TiD 2 and TaD0.5 targets were fabricated via magnetron sputtering of titanium, zirconium and tantalum in gas (deuterium) environment. The experiments have been carried out using the high-current pulsed Hall plasma accelerator (NSR TPU, Russia). The detection of neutrons with energy of 2.5 MeV from the dd reaction was done with plastic scintillation spectrometers. As a result of the experiments, the energy dependences of the astrophysical S-factor for the dd reaction in the deuteron collision energy range of 2-7 keV and the values of the electron screening potential U e of the interacting deuterons have been measured for the above targets: U e (ZrD 2 )=(205±35) eV; U e (TiD 2 )=(125±34) eV; U e (TaD 0.5 )=(313±58) eV. Our results are compared with the other published experimental and calculated data.

The factors affecting the 95Nb/95Zr and 140La/95Zr-cooling time correlations

International Nuclear Information System (INIS)

Haddad, Kh

2005-03-01

The factors affecting the 95 Nb/ 95 Zr and 140 La/ 95 Zr-cooling time correlations were studied by analysing the gamma scanning results of the IRT fuel assemblies. the results showed that, these ratios are stable along the fuel assembly regardless of the position of the measured section. This allow to limit gamma scanning of the whole assembly on the measurement of the central section. The effects of irradiation history and conditions, burnup, control rods on the 95 Nb/ 95 Zr and 140 La/ 95 Zr-cooling time correlations were studied. The results showed the following: the identical irradiation history and conditions during the last irradiation, whose period is comparable with half lives of the used fission products, is fundamental condition for fission product ratio-cooling time correlation. The background resulting from burnup cause high systematic error in the measured results and it does not cause arbitrary error; whereas control rods cause high arbitrary error. The 95 Nb/ 95 Zr-cooling time correlation is more sensitive than the 140 La/ 95 Zr-cooling time correlation. (author)

The preparation and testing of Nb-Zr and Nb-ZrO2 single crystals for deformation studies

International Nuclear Information System (INIS)

Botta Filho, W.J.; Christian, J.W.; Taylor, G.

1987-01-01

The difficulties to obtain adequate single crystals of Nb-Zr and Nb-ZrO 2 alloys for deformation studies are discussed. Low-temperature internal oxidation of Nb-Zr alloys followed by ageing at higher temperatures resulted in the precipitation of ZrO 2 particles. However, the effect of this treatment on the particles size and distribution and on the crystallographic structure of the particle was not completely understood. Compression tests in the temperature range 4.2K to 373K showed a small effect of zirconia particles on the mechanical properties of Nb-Zr solid solutions and a significative effect of the amount of oxygen remaining in solid solution after the oxidation treatment. (author) [pt

Zr-Sn-Nb alloys. Preliminary studies

International Nuclear Information System (INIS)

Danon, C.A.; Arias, D.E.

1993-01-01

Studies of the Zr-Sn-Nb diagram have been started, focussing on the Zr-rich corner, near the composition of Zirlo commercial alloy, Zr-1Sn-1Nb, and with Fe and O contents usual in nuclear grade materials. Three alloys were melted, namely Zr-4Sn-2.4Nb (A), Zr-1Sn-3Nb (B) and Zr-2.1Sn-1Nb (C). α/β transformation temperatures were measured through the variation of electrical resistivity(p) vs temperature (T). Values of 560 deg C, 670 deg C and 750 deg C were measured for the α→α+β reaction and 980 deg C, 910 deg C and 1000 deg C for the α+β→β reaction, for the A, B and C alloys, respectively in that order. Some samples were submitted to heat treatments (62 and 216 hours at 825 deg C, 120 hours at 875 deg C). Optical and scanning electronic microscopy of those samples confirmed our resistivity results. (Author)

Effect of the Zr elements with thermal properties changes of U-7Mo-xZr/Al dispersion fuel

International Nuclear Information System (INIS)

Supardjo; Agoeng Kadarjono; Boybul; Aslina Br Ginting

2016-01-01

Thermal properties data of nuclear fuel is required as input data to predict material properties change phenomenon during the fabrication process and irradiated in a nuclear reactor. Study the influence of Zr element in the U-7Mo-xZr/Al (x = 1%, 2% and 3%) fuel dispersion to changes in the thermal properties at various temperatures have been stiffened. Thermal analysis includes determining the melting temperature, enthalpy, and phase changes made using Differential Thermal Analysis (DTA) in the temperature range between 30 °C up to 1400 °C, while the heat capacity of U-7Mo-xZr alloy and U-7Mo-xZr/Al dispersion fuel using Differential Scanning Calorimeter (DSC) at room temperature up to 450 °C. Thermal analyst data DTA shows that Zr levels of all three compositions showed a similar phenomenon. At temperatures between 565.60 °C - 584.98 °C change becomes α + δ to α + γ phase and at 649.22 °C – 650.13 °C happen smelting Al matrix Occur followed by a reaction between Al matrix with U-7Mo-xZr on 670.38 °C - 673.38 °C form U (Al, Mo)x Zr. Furthermore a phase change α + β becomes β + γ Occurs at temperatures 762.08 °C - 776.33 °C and diffusion between the matrix by U-7Mo-xZr/Al on 853.55 °C - 875.20 °C. Every phenomenon that Occurs, enthalpy posed a relative stable. Consolidation of uranium Occur in 1052.42 °C - 1104.99 °C and decomposition reaction of U (Al, Mo)x and U (Al, Zr)_x becomes (UAl_4, UAl_3, UAl_2), U-Mo, and UZr on 1328,34 °C - 1332,06 °C , The existence of Zr in U-Mo alloy increases the heat capacity of the U-7Mo-xZr/Al, dispersion fuel and the higher heat capacity of Zr levels increased due to interactions between the atoms of Zr with Al matrix so that the heat absorbed by the fuel increase. (author)

Site preference of Zr in Ti 3 Al and phase stability of Ti 2 ZrAl

Indian Academy of Sciences (India)

Calculated values of equilibrium lattice parameters, heat of formation and bulk modulus of Ti2ZrAl are presented. The basis for the structural stability and bonding are analysed in terms of the density of states. Between the two possible 2-like structures, Ti2ZrAl shows enhanced stability for the one where Zr is substituted in ...

Mechanical Properties of TiTaHfNbZr High-Entropy Alloy Coatings Deposited on NiTi Shape Memory Alloy Substrates

Science.gov (United States)

Motallebzadeh, A.; Yagci, M. B.; Bedir, E.; Aksoy, C. B.; Canadinc, D.

2018-04-01

TiTaHfNbZr high-entropy alloy (HEA) thin films with thicknesses of about 750 and 1500 nm were deposited on NiTi substrates by RF magnetron sputtering using TiTaHfNbZr equimolar targets. The thorough experimental analysis on microstructure and mechanical properties of deposited films revealed that the TiTaHfNbZr films exhibited amorphous and cauliflower-like structure, where grain size and surface roughness increased concomitant with film thickness. More importantly, the current findings demonstrate that the TiTaHfNbZr HEA films with mechanical properties of the same order as those of the NiTi substrate constitute promising biomedical coatings effective in preventing Ni release.

Mechanical Properties of TiTaHfNbZr High-Entropy Alloy Coatings Deposited on NiTi Shape Memory Alloy Substrates

Science.gov (United States)

Motallebzadeh, A.; Yagci, M. B.; Bedir, E.; Aksoy, C. B.; Canadinc, D.

2018-06-01

TiTaHfNbZr high-entropy alloy (HEA) thin films with thicknesses of about 750 and 1500 nm were deposited on NiTi substrates by RF magnetron sputtering using TiTaHfNbZr equimolar targets. The thorough experimental analysis on microstructure and mechanical properties of deposited films revealed that the TiTaHfNbZr films exhibited amorphous and cauliflower-like structure, where grain size and surface roughness increased concomitant with film thickness. More importantly, the current findings demonstrate that the TiTaHfNbZr HEA films with mechanical properties of the same order as those of the NiTi substrate constitute promising biomedical coatings effective in preventing Ni release.

Effect of Ge Content on the Formation of Ge Nanoclusters in Magnetron-Sputtered GeZrOx-Based Structures.

Science.gov (United States)

Khomenkova, L; Lehninger, D; Kondratenko, O; Ponomaryov, S; Gudymenko, O; Tsybrii, Z; Yukhymchuk, V; Kladko, V; von Borany, J; Heitmann, J

2017-12-01

Ge-rich ZrO 2 films, fabricated by confocal RF magnetron sputtering of pure Ge and ZrO 2 targets in Ar plasma, were studied by multi-angle laser ellipsometry, Raman scattering, Auger electron spectroscopy, Fourier transform infrared spectroscopy, and X-ray diffraction for varied deposition conditions and annealing treatments. It was found that as-deposited films are homogeneous for all Ge contents, thermal treatment stimulated a phase separation and a formation of crystalline Ge and ZrO 2 . The "start point" of this process is in the range of 640-700 °C depending on the Ge content. The higher the Ge content, the lower is the temperature necessary for phase separation, nucleation of Ge nanoclusters, and crystallization. Along with this, the crystallization temperature of the tetragonal ZrO 2 exceeds that of the Ge phase, which results in the formation of Ge crystallites in an amorphous ZrO 2 matrix. The mechanism of phase separation is discussed in detail.

Annotating STEAP1 regulation in prostate cancer with 89Zr immuno-PET.

Science.gov (United States)

Doran, Michael G; Watson, Philip A; Cheal, Sarah M; Spratt, Daniel E; Wongvipat, John; Steckler, Jeffrey M; Carrasquillo, Jorge A; Evans, Michael J; Lewis, Jason S

2014-12-01

Antibodies and antibody-drug conjugates targeting the cell surface protein 6 transmembrane epithelial antigen of prostate 1 (STEAP1) are in early clinical development for the treatment of castration-resistant prostate cancer (PCa). In general, antigen expression directly affects the bioactivity of therapeutic antibodies, and the biologic regulation of STEAP1 is unusually complicated in PCa. Paradoxically, STEAP1 can be induced or repressed by the androgen receptor (AR) in different human PCa models, while also expressed in AR-null PCa. Consequently, there is an urgent need to translate diagnostic strategies to establish which regulatory mechanism predominates in patients to situate the appropriate therapy within standard of care therapies inhibiting AR. To this end, we prepared and evaluated (89)Zr-labeled MSTP2109A ((89)Zr-2109A), a radiotracer for PET derived from a fully humanized monoclonal antibody to STEAP1 in preclinical PCa models. (89)Zr-2109A specifically localized to the STEAP1-positive human PCa models CWR22Pc, 22Rv1, and PC3. Moreover, (89)Zr-2109A sensitively measured treatment-induced changes (∼66% decline) in STEAP1 expression in CWR22PC in vitro and in vivo, a model we showed to express STEAP1 in an AR-dependent manner. These findings highlight the ability of immuno-PET with (89)Zr-2109A to detect acute changes in STEAP1 expression and argue for an expansion of ongoing efforts to image PCa patients with (89)Zr-2109A to maximize the clinical benefit associated with antibodies or antibody-drug conjugates to STEAP1. © 2014 by the Society of Nuclear Medicine and Molecular Imaging, Inc.

Influence of ion bombardment on structure and properties of TiZrN thin film

Energy Technology Data Exchange (ETDEWEB)

Lin, Yu-Wei, E-mail: james722@itrc.narl.org.tw [Instrument Technology Research Center, National Applied Research Laboratories Taiwan (China); Huang, Jia-Hong; Yu, Ge-Ping [Department of Engineering and System Science, National Tsing Hua University, Taiwan (China); Hsiao, Chien-Nan; Chen, Fong-Zhi [Instrument Technology Research Center, National Applied Research Laboratories, Taiwan (China)

2015-11-01

Highlights: • (Ti,Zr)N thin films were produced using dual guns with Ti and Zr targets. • Ti{sub 0.5}Zr{sub 0.5}N shows excellent hardness of 37.8 GPa with exhibiting (1 1 1) preferred orientation. • Resistivity is inverse proportional to the packing density. • Hardness is proportional to the packing density. - Abstract: The study is focused on the characterization of TiZrN thin film by controlling the behavior of ion bombardment. Thin films are grown using radio frequency magnetron sputtering process on Si wafer. The negative bias voltage ranging from −20 V to −130 V was applied to the substrate. The ion current density increases rapidly as substrate bias is lower than −60 V, then slightly increases as the critical value about −60 V is exceeded. At the substrate bias of −60 V, the ion current density is close to 0.56 mA/cm{sup 2}. The resistivity measured by four-point probe decreases from conditions −20 V to −60 V and then increases for substrate bias increases from −60 V to −130 V. The resistivity of TiZrN films is contributed from the packing factor. The N/TiZr ratios about 1 were measured by Rutherford backscattering spectrometer, and the packing factors of TiZrN films can also be obtained by the results of RBS. Field Emission scanning electron microscope (FEG-SEM) is used to characterize the thickness and structure of the deposited TiZrN film. X-ray diffraction (XRD) is used to determine the preferred orientation and lattice parameter. The precursor results of XRD show that all the coating samples exhibited (1 1 1) preferred orientation, and the hardness values of TiZrN films were ranging from 20 to 40 GPa. To sum up the precursor studies, the TiZrN films which can improve the properties from TiN and ZrN is a new ceramic material with higher potential. Following the advance process and analysis research, the structure and properties can be correlated and as a reference for industry application.

Study of oxidation behaviour of Zr-based bulk amorphous alloy Zr 65 ...

Indian Academy of Sciences (India)

The oxidation behaviour of Zr-based bulk amorphous alloy Zr65Cu17.5Ni10Al7.5 has been studied in air environment at various temperatures in the temperature range 591–684 K using a thermogravimetric analyser (TGA). The oxidation kinetics of the alloy in the amorphous phase obeys the parabolic rate law for oxidation ...

A multi-component Zr alloy with comparable strength and Higher plasticity than Zr-based bulk metallic glasses

International Nuclear Information System (INIS)

Liang, S.X.; Yin, L.X.; Ma, M.Z.; Jing, R.; Yu, P.F.; Zhang, Y.F.; Wang, B.A.; Liu, R.P.

2013-01-01

Zirconium (Zr)-based bulk metallic glass possesses the highest potential as a structural material among metallic glasses. Although Zr-based bulk metallic glass exhibits extremely high strength, its potential application has been restricted by a number of issues, such as fragility, small size, difficult fabrication into different shapes and poisonous beryllium content, among others. In this paper, a Zr-based crystal alloy with comparable strength and higher plasticity than Zr-based bulk metallic glass is presented. The proposed Zr-based alloy has a tensile strength greater than 1600 MPa. That value is comparable to the 1500 MPa to 2000 MPa strength of Zr-based bulk metallic glasses (BMGs). The ductility in terms of elongation reached 6.2%; at the same time, the 1400 MPa tensile strength was retained. This phenomenon is not possible for Zr-based BMGs. XRD results show that the proposed ultrahigh-strength Zr-based crystal alloy has two-phase structures: an hcp-structured α phase and a bcc-structured β phase. The forged specimen exhibits a typical basket-weave microstructure, which is characterised by the interlaced plate α phase separated from the β phase matrix. Fine, short bar-shaped α phases precipitated along the original β grain boundary together with ultrafine dot-shaped α phases that presented inside the original β grain when the ageing temperature was between 500 °C and 525 °C. As the ageing temperature increased, the dot-shaped α phase grew into plate shapes, decreasing the material's strength and increasing its plasticity. The ultrafine dot-shaped and short bar-shaped α phases in the original β phase matrix are the main strengthening mechanisms of the ultrahigh-strength Zr-based crystal alloy.

Degradation of Zr-based bulk metallic glasses used in load-bearing implants: A tribocorrosion appraisal.

Science.gov (United States)

Zhao, Guo-Hua; Aune, Ragnhild E; Mao, Huahai; Espallargas, Nuria

2016-07-01

Owing to the amorphous structure, Bulk Metallic Glasses (BMGs) have been demonstrating attractive properties for potential biomedical applications. In the present work, the degradation mechanisms of Zr-based BMGs with nominal compositions Zr55Cu30Ni5Al10 and Zr65Cu18Ni7Al10 as potential load-bearing implant material were investigated in a tribocorrosion environment. The composition-dependent micro-mechanical and tribological properties of the two BMGs were evaluated prior to the tribocorrosion tests. The sample Zr65-BMG with a higher Zr content exhibited increased plasticity but relatively reduced wear resistance during the ball-on-disc tests. Both BMGs experienced abrasive wear after the dry wear test under the load of 2N. The cross-sectional subsurface structure of the wear track was examined by Focused Ion Beam (FIB). The electrochemical properties of the BMGs in simulated body fluid were evaluated by means of potentiodynamic polarization and X-ray Photoelectron Spectroscopy (XPS). The spontaneous passivation of Zr-based BMGs in Phosphate Buffer Saline solution was mainly attributed to the highly concentrated zirconium cation (Zr(4+)) in the passive film. The tribocorrosion performance of the BMGs was investigated using a reciprocating tribometer equipped with an electrochemical cell. The more passive nature of the Zr65-BMG had consequently a negative influence on its tribocorrosion resistance, which induced the wear-accelerated corrosion and eventually speeded-up the degradation process. It has been revealed the galvanic coupling was established between the depassivated wear track and the surrounding passive area, which is the main degradation mechanism for the passive Zr65-BMG subjected to the tribocorrosion environment. Copyright © 2015 Elsevier Ltd. All rights reserved.

Density functional study of vibrational, thermodynamic and elastic properties of ZrCo and ZrCoX3 (X = H, D and T) compounds

International Nuclear Information System (INIS)

Chattaraj, D.; Parida, S.C.; Dash, Smruti; Majumder, C.

2015-01-01

Highlights: • The physico-chemical properties of ZrCo and its hydrides were studied. • The isotope effect on vibrational and thermodynamic properties was investigated. • The changes in elastic properties due to hydrogenation of ZrCo were investigated. • Thermodynamics properties of ZrCo and its hydrides were calculated. - Abstract: The dynamical, thermodynamic and elastic properties of ZrCo and its hydrides ZrCoX 3 (X = H, D and T) are reported. While the electronic structure calculations are performed using plane wave pseudopotential approach, the effect of isotopes on the vibrational and thermodynamic properties has been demonstrated through frozen phonon approach. The results reveal significant difference between the ZrCoH 3 and its isotopic analogs in terms of phonon frequencies and zero point energies. For example, the energy gap between optical and acoustic modes reduces in the order of ZrCoT 3 > ZrCoD 3 > ZrCoH 3 . The vibrational properties shows that the intermetallic ZrCo is dynamically stable whereas ZrCoX 3 (X = H, D and T) are dynamically unstable. The calculated formation energies of ZrCoX 3 , including the ZPE, are −146.7, −158.3 and −164.1 kJ/(mole of ZrCoX 3 ) for X = H, D and T, respectively. In addition, the changes in elastic properties of ZrCo upon hydrogenation have also been investigated. The results show that both ZrCo and ZrCoH 3 are mechanically stable at ambient pressure. The Debye temperatures of both ZrCo and ZrCoH 3 are determined using the calculated elastic moduli

Valence electron structure and properties of stabilized ZrO2

Institute of Scientific and Technical Information of China (English)

LI JinPing; HAN JieOai; MENG SongHe; ZHANG XingHong

2008-01-01

To reveal the properties of stabilizers in ZrO2 on nanoscopic levels,the valence elec-tron structures of four stable ZrO2 phases and c-ZrO2 were analyzed on the basis of the empirical electron theory of solids and molecules.The results showed that the hybridization levels of Zr atoms in c-ZrO2 doped with Ca and Mg dropped from B17 to B13,the hybridization levels of Zr atoms in c-ZrO2 doped with Y and Ce dropped from B17 to B15,and that the four stabilizing atoms all made the hybridization levels of O atoms drop from level 4 to level 2.The numbers of covalent electrons in the strongest covalent bond in the descending order are c-ZrO2>ZrCeO2>ZrYOZrMgO>ZrCaO.The bond energies of the strongest covalent bond and the melting points of the solid solutions in the descending order are ZrCeO2>c-ZrO2>ZrYO>ZrMgO>ZrCaO.The percent-ages of the total number of covalent electrons in the descending order arec-ZrO2>ZrYO> ZrCeO2>ZrMgO> ZrCaO.From the above analysis,it can be concluded that the stabilizing degrees of the four stabilizers in the descending order are CaO> MgO>Y2O3>CeO2.

89Zr-huJ591 immuno-PET imaging in patients with advanced metastatic prostate cancer

International Nuclear Information System (INIS)

Pandit-Taskar, Neeta; Solomon, Stephen B.; Durack, Jeremy C.; Carrasquillo, Jorge A.; Lefkowitz, Robert A.; Osborne, Joseph R.; O'Donoghue, Joseph A.; Beylergil, Volkan; Ruan, Shutian; Cheal, Sarah M.; Lyashchenko, Serge; Gonen, Mithat; Lewis, Jason S.; Holland, Jason P.; Reuter, Victor E.; Loda, Massimo F.; Smith-Jones, Peter M.; Weber, Wolfgang A.; Larson, Steven M.; Bander, Neil H.; Scher, Howard I.; Morris, Michael J.

2014-01-01

Given the bone tropism of prostate cancer, conventional imaging modalities poorly identify or quantify metastatic disease. 89 Zr-huJ591 positron emission tomography (PET) imaging was performed in patients with metastatic prostate cancer to analyze and validate this as an imaging biomarker for metastatic disease. The purpose of this initial study was to assess safety, biodistribution, normal organ dosimetry, and optimal imaging time post-injection for lesion detection. Ten patients with metastatic prostate cancer received 5 mCi of 89 Zr-huJ591. Four whole-body scans with multiple whole-body count rate measurements and serum activity concentration measurements were obtained in all patients. Biodistribution, clearance, and lesion uptake by 89 Zr-huJ591 immuno-PET imaging was analyzed and dosimetry was estimated using MIRD techniques. Initial assessment of lesion targeting of 89 Zr-huJ591 was done. Optimal time for imaging post-injection was determined. The dose was well tolerated with mild chills and rigors seen in two patients. The clearance of 89 Zr-huJ591 from serum was bi-exponential with biological half-lives of 7 ± 4.5 h (range 1.1-14 h) and 62 ± 13 h (range 51-89 h) for initial rapid and later slow phase. Whole-body biological clearance was 219 ± 48 h (range 153-317 h). The mean whole-body and liver residence time was 78.7 and 25.6 h, respectively. Dosimetric estimates to critical organs included liver 7.7 ± 1.5 cGy/mCi, renal cortex 3.5 ± 0.4 cGy/mCi, and bone marrow 1.2 ± 0.2 cGy/mCi. Optimal time for patient imaging after injection was 7 ± 1 days. Lesion targeting of bone or soft tissue was seen in all patients. Biopsies were performed in 8 patients for a total 12 lesions, all of which were histologically confirmed as metastatic prostate cancer. One biopsy-proven lesion was not positive on 89 Zr-huJ591, while the remaining 11 lesions were 89 Zr-huJ591 positive. Two biopsy-positive nodal lesions were noted only on 89 Zr-huJ591 study, while the

Experimental phases diagram Zr-Fe and Zr-Sn-Fe of the Fe rich zone at a temperature of 1100oC

International Nuclear Information System (INIS)

Nieva, N.; Jimenez, J.; Gomez, A; Granovsky, M.S

2010-01-01

Zr-based alloys are frequently used in the nuclear energy industry; among these are the Zr-based Zircaloys whose main alloys are Sn and Fe. In order to experimentally evaluate part of the diagram of the binary Zr-Fe phases and the ternary Zr-Sn-Fe in the Fe-rich zone, different binary alloys in the area closest to the composition of the ZrFe 2 and Zr 6 Fe 23 compounds were designed as well as a ternary alloy of Zr-Sn-Fe in the Fe-rich region of the ternary system. All the alloys underwent a two month heat treatment at a temperature of 1100 o C. Later the phases that were present were identified using different complementary techniques (mainly X-ray diffraction and microanalysis). The clear presence of the Zr 6 Fe 23 phase was not observed in any of the alloys. A new ternary phase consisting approximately of Zr 2 0Sn 14 Fe 66 was verified in the ternary alloy

Evidence of icosahedral short-range order in Zr70Cu30 and Zr70Cu29Pd1 metallic glasses

DEFF Research Database (Denmark)

Saksl, K.; Franz, H.; Jovari, P.

2003-01-01

Change in local atomic environment during crystallization of Zr-based glassy alloys was studied by extended x-ray absorption fine structure (EXAFS) spectroscopy. The formation of icosahedral quasicrystalline phase followed by crystallization of tetragonal CuZr2 has been observed in the Zr70Cu29Pd1...... glassy alloy during annealing up to 850 K. On the other hand, the binary Zr70Cu30 alloy shows a single glassy to crystalline CuZr2 phase transformation. The local atomic environment of as-quenched Zr70Cu30 alloy is matched to an icosahedral local atomic configuration, which is similar to that of the as......-quenched Zr70Cu29Pd1 alloy and the alloy annealed at 593 K containing icosahedral phase. Considering that the supercooled liquid region appears prior to crystallization in the Zr70Cu30 glassy alloy, the observed results support the theory claiming a strong correlation between the existence of local...

Superconducting properties of Zr1+xNi2-xGa and Zr1-xNi2+xGa Heusler compounds

Directory of Open Access Journals (Sweden)

Saad Alzahrani

2017-05-01

Full Text Available The superconducting properties of a series of Zr1+xNi2-xGa and Zr1-xNi2+xGa compounds have been investigated by x-ray diffraction, electrical resistivity, dc magnetization, and ac susceptibility measurements. While the parent compound, ZrNi2Ga, exhibited the cubic L21 Heusler structure, multiple non-cubic structures formed in the Zr and Ni rich doped materials. For x ≤ 0.3, all Zr1-xNi2+xGa compounds demonstrated superconducting behavior, but no superconductivity was observed in the Zr1+xNi2-xGa alloys for x > 0.2. The magnetization data revealed that all materials in both Zr1+xNi2-xGa and Zr1-xNi2+xGa series exhibited type-II superconductivity. With increasing doping concentration x, the paramagnetic ordering were enhanced in both systems while the superconducting properties were found to weaken. The observations are discussed considering the structural disorders in the systems.

Anodic Fabrication of Ti-Nb-Zr-O Nanotube Arrays

Directory of Open Access Journals (Sweden)

Qiang Liu

2014-01-01

Full Text Available Highly ordered Ti-Nb-Zr-O nanotube arrays were fabricated through pulse anodic oxidation of Ti-Nb-Zr alloy in 1 M NaH2PO4 containing 0.5 wt% HF electrolytes. The effect of anodization parameters and Zr content on the microstructure and composition of Ti-Nb-Zr-O nanotubes was investigated using a scanning electron microscope equipped with energy dispersive X-ray analysis. It was found that length of the Ti-Nb-Zr-O nanotubes increased with increase of Zr contents. The diameter and the length of Ti-Nb-Zr-O nanotubes could be controlled by pulse voltage. XRD analysis of Ti-Nb-Zr-O samples annealed at 500°C in air indicated that the (101 diffraction peaks shifted from 25.78° to 25.05° for annealed Ti-Nb-Zr-O samples with different Zr contents because of larger lattice parameter of Ti-Nb-Zr-O compared to that of undoped TiO2.

Sintering of ZrC by hot isostatic pressing (HIP) and spark plasma sintering (SPS). Effect of impurities

International Nuclear Information System (INIS)

Allemand, Alexandre; Le Flem - Dormeval, Marion; Guillard, Francois

2005-01-01

Carbides are generally used as structural materials for high temperature applications. Particularly, ZrC because of low activation, neutronic transparency, cubic structure (isotropic behaviour) and good thermal conductivity, is one of the candidates under consideration for structural materials in the core of new high temperature nuclear reactors (Generation IV). Just a few studies about densification of monolithic ZrC exist. They mainly involve natural sintering or hot pressing at high temperature (until 2700 deg. C). Unfortunately those processes induce grain growth and do not lead to fully densified ZrC. The aim of this study is to compare the characteristics and the properties of ZrC sintered by HIP and by SPS. Fully dense ZrC can be reached either by HIP or by SPS, grain size being more or less controlled. Microstructural observations and mechanical testing of several ZrC grades shows that powder impurities play an important role in the quality of the grain boundaries and consequently in the mechanical properties. In particular, the porosity falls from 17% to 3 % just by reducing the free carbon content in starting ZrC powder. The densification process of dense monolithic ZrC was improved by combining a HIP at 1600 deg. C (titanium canning) followed by a post-HIP at 1900 deg. C (no canning required). Four-point bending tests are in progress to confirm the improvement of fracture strength. (authors)

Time-temperature-transformation diagram of Zr-based Zr-Al-Cu-Ni metallic glasses

International Nuclear Information System (INIS)

Goh, T.T.; Li, Y.; Ng, S.C.

1996-01-01

The critical cooling rates R c for glass formation in four Zr-based Zr-Al-Cu-Ni alloys were determined using techniques developed by Uhlmann based on theories of homogeneous nucleation, crystal growth and transformation kinetics. It involves the construction of a time-temperature-transformation curve which requires the knowledge of the viscosity-temperature curve of the alloys. Two types of viscosity-temperature expressions, namely Andrade expression and Doolittle expression, were used to model the viscosity of the Zr-based alloys and the choice of the viscosity-temperature expression which gives the best estimate of the calculated time-temperature-transformation curve is discussed. (author)

A Comparative Discussion of the Catalytic Activity and CO2-Selectivity of Cu-Zr and Pd-Zr (Intermetallic Compounds in Methanol Steam Reforming

Directory of Open Access Journals (Sweden)

Norbert Köpfle

2017-02-01

Full Text Available The activation and catalytic performance of two representative Zr-containing intermetallic systems, namely Cu-Zr and Pd-Zr, have been comparatively studied operando using methanol steam reforming (MSR as test reaction. Using an inverse surface science and bulk model catalyst approach, we monitored the transition of the initial metal/intermetallic compound structures into the eventual active and CO2-selective states upon contact to the methanol steam reforming mixture. For Cu-Zr, selected nominal stoichiometries ranging from Cu:Zr = 9:2 over 2:1 to 1:2 have been prepared by mixing the respective amounts of metallic Cu and Zr to yield different Cu-Zr bulk phases as initial catalyst structures. In addition, the methanol steam reforming performance of two Pd-Zr systems, that is, a bulk system with a nominal Pd:Zr = 2:1 stoichiometry and an inverse model system consisting of CVD-grown ZrOxHy layers on a polycrystalline Pd foil, has been comparatively assessed. While the CO2-selectivity and the overall catalytic performance of the Cu-Zr system is promising due to operando formation of a catalytically beneficial Cu-ZrO2 interface, the case for Pd-Zr is different. For both Pd-Zr systems, the low-temperature coking tendency, the high water-activation temperature and the CO2-selectivity spoiling inverse WGS reaction limit the use of the Pd-Zr systems for selective MSR applications, although alloying of Pd with Zr opens water activation channels to increase the CO2 selectivity.

Simulation of Zr content in TiZrCuNi brazing filler metal for Ti6Al4V alloy

International Nuclear Information System (INIS)

Yue, Xishan; Xie, Zonghong; Jing, Yongjuan

2017-01-01

To optimize the Zr content in Ti-based filler metal, the covalent electron on the nearest atoms bond in unit cell (n_A"u"-"v) with Ti-based BCC structure was calculated, in which the brazing temperature was considered due to its influence on the lattice parameter. Based on EET theory (The Empirical Electron Theory for solid and molecules), n_A"u"-"v represents the strength of the unit cell with defined element composition and structure, which reflects the effect from solid solution strengthening on the strength of the unit cell. For Ti-Zr-15Cu-10Ni wt% filler metal, it kept constant as 0.3476 with Zr as 37.5 ∝ 45 wt% and decreased to 0.333 with Zr decreasing from 37.5 to 25 wt%. Finally, it increased up to 0.3406 with Zr as 2 ∝ 10 wt%. Thus, Ti-based filler metal with Zr content being 2 ∝ 10 wt% is suggested based on the simulation results. Moreover, the calculated covalent electron of n_A"u"-"v showed good agreement with the hardness of the joint by filler 37.5Zr and 10Zr. The composition of Ti-10Zr-15Cu-10Ni wt% was verified in this study with higher tensile strength of the brazing joint and uniform microstructure of the interface. (orig.)

Simulation of Zr content in TiZrCuNi brazing filler metal for Ti6Al4V alloy

Energy Technology Data Exchange (ETDEWEB)

Yue, Xishan [Northwestern Polytechnical University, School of Astronautics, Xi' an (China); AVIC Beijing Aeronautical Manufacturing Technology Research Institute, Aeronautical Key Laboratory for Welding and Joining Technology, Beijing (China); Xie, Zonghong [Northwestern Polytechnical University, School of Astronautics, Xi' an (China); Jing, Yongjuan [AVIC Beijing Aeronautical Manufacturing Technology Research Institute, Aeronautical Key Laboratory for Welding and Joining Technology, Beijing (China)

2017-07-15

To optimize the Zr content in Ti-based filler metal, the covalent electron on the nearest atoms bond in unit cell (n{sub A}{sup u-v}) with Ti-based BCC structure was calculated, in which the brazing temperature was considered due to its influence on the lattice parameter. Based on EET theory (The Empirical Electron Theory for solid and molecules), n{sub A}{sup u-v} represents the strength of the unit cell with defined element composition and structure, which reflects the effect from solid solution strengthening on the strength of the unit cell. For Ti-Zr-15Cu-10Ni wt% filler metal, it kept constant as 0.3476 with Zr as 37.5 ∝ 45 wt% and decreased to 0.333 with Zr decreasing from 37.5 to 25 wt%. Finally, it increased up to 0.3406 with Zr as 2 ∝ 10 wt%. Thus, Ti-based filler metal with Zr content being 2 ∝ 10 wt% is suggested based on the simulation results. Moreover, the calculated covalent electron of n{sub A}{sup u-v} showed good agreement with the hardness of the joint by filler 37.5Zr and 10Zr. The composition of Ti-10Zr-15Cu-10Ni wt% was verified in this study with higher tensile strength of the brazing joint and uniform microstructure of the interface. (orig.)

Influence of ZrO2 nanoparticles and thermal treatment on the properties of PMMA/ZrO2 hybrid coatings

International Nuclear Information System (INIS)

Reyes-Acosta, M.A.; Torres-Huerta, A.M.; Domínguez-Crespo, M.A.; Flores-Vela, A.I.; Dorantes-Rosales, H.J.; Ramírez-Meneses, E.

2015-01-01

Highlights: • PMMA/ZrO 2 nanocomposites were prepared by melt blending in a single screw extruder. • The nanoparticles of m-, t-ZrO 2 were successfully synthesized using sol–gel technique. • The prepared PMMA/ZrO 2 nanocomposites have better UV protection than pure PMMA. • The thermal stability of the PMMA increases with low amount of ZrO 2 nanoparticles. • PMMA/ZrO 2 nanocomposites show superior values of elastic modulus and hardness. - Abstract: In this work, ZrO 2 nanoparticles were synthesized by the sol–gel method, treated thermally at different temperatures (400, 600 and 800 °C), and added to a polymer matrix in two different weight percentages (0.5 and 1) by single screw extrusion in order to determine the influence of these parameters on the thermal stability and UV radiation resistance of PMMA/ZrO 2 composites. Fourier transform infrared spectroscopy (FT-IR), nuclear magnetic resonance (NMR), X-ray diffraction (XRD), transmission electron microscopy (TEM), confocal laser scanning microscopy (CLSM), ultraviolet–visible spectroscopy (UV–Vis), thermogravimetric analysis (TGA) and nanoindentation techniques were used to evaluate the structural, morphological, optical, thermal and mechanical properties of as-prepared composites. The average crystallite sizes for ZrO 2 sintered at 600 and 800 °C were about 17 and 26 nm, respectively. It was found that the incorporation of a low percentage of ZrO 2 nanoparticles increased the thermal properties of PMMA as well as its hardness and elastic modulus. The degradation temperature at 10 wt.% loss of the PMMA/ZrO 2 (0.5 wt.%, 400 °C) nanocomposite was approximately 48 °C higher than that of pure PMMA. The absorption in the UV region was increased according to the ZrO 2 heat treatment temperature and amount added to the polymer matrix

(6Li,d) reaction on sd-, fp- and g-shell nuclei in ZR- and FR-DWBA formalisms

International Nuclear Information System (INIS)

Rahman, M.A.; Mecking, M.; Strohbusch, U.

1991-06-01

( 6 Li,d) reaction angular distributions on target nuclei 16 ≤ A ≤ 90 have been analyzed using both ZR- and FR-DWBA formalisms. The most prevalent method of analysis of alpha-transfer reactions such as( 6 Li,d) and its reverse (d, 6 Li) (where the wave function at zero distance in the p-state of relative cluster motion in the A = 6 nuclei will not have node) is the ZR-DWBA calculations due to the relatively short time of computation. It is of particular interest to verify whether FR-DWBA calculations result in similar S α - values to those of ZR-DWBA or not. It is found that to derive similar S α -values as in FR-DWBA calculations, one requires relatively large real well depth in ZR-DWBA calculations. Qualitative discussions have been made in this direction. (author). 12 refs, 3 figs, 2 tabs

Role of anionic and cationic surfactants on the structural and dielectric properties of ZrO{sub 2} nanoparticles

Energy Technology Data Exchange (ETDEWEB)

Sidhu, Gaganpreet Kaur; Kumar, Rajesh, E-mail: rajeshbaboria@gmail.com

2017-01-15

Highlights: • Synthesis of Zirconia nanoparticles with and without surfactants by co- precipitation method. • Surface modification of ZrO{sub 2} nanoparticles. • Phase transition with different concentration of surfactants. • Dielectric behavior of bare, CTAB assisted and SDS assisted ZrO{sub 2} nanoparticles. - Abstract: In the present paper, we report the synthesis of Cetyltrimethylammonium Bromide (CTAB) and Sodium dodecyl sulfate (SDS) assisted Zirconia (ZrO{sub 2}) nanoparticles by co-precipitation method. The effect of surfactant concentration on the structural and dielectric properties has been extensively studied. X-ray diffraction studies reveal the formation of tetragonal phase in the ZrO{sub 2} nanoparticles prepared by lower CTAB concentration. However, for higher concentration of CTAB some traces of monoclinic phase appeared along with tetragonal phase. SDS assisted nanoparticles shows crystalline tetragonal phase with lower concentration of SDS and amorphous nature with higher concentrations of SDS. FTIR results show the presence of Zr–O symmetrical stretching vibrations at tetrahedral site. The dielectric properties of all samples have been studied from 10 Hz to 1 MHz, revealing the low value of dielectric constant with CTAB and very high value with SDS as compared to bare ZrO{sub 2} nanoparticles. The dielectric behaviour of the bare and surfactant assisted nanoparticles has been correlated with the phase transition, size of nanoparticles and the nature of surfactants.

Use of Naturally Available Reference Targets to Calibrate Airborne Laser Scanning Intensity Data

Directory of Open Access Journals (Sweden)

Paula Litkey

2009-04-01

Full Text Available We have studied the possibility of calibrating airborne laser scanning (ALS intensity data, using land targets typically available in urban areas. For this purpose, a test area around Espoonlahti Harbor, Espoo, Finland, for which a long time series of ALS campaigns is available, was selected. Different target samples (beach sand, concrete, asphalt, different types of gravel were collected and measured in the laboratory. Using tarps, which have certain backscattering properties, the natural samples were calibrated and studied, taking into account the atmospheric effect, incidence angle and flying height. Using data from different flights and altitudes, a time series for the natural samples was generated. Studying the stability of the samples, we could obtain information on the most ideal types of natural targets for ALS radiometric calibration. Using the selected natural samples as reference, the ALS points of typical land targets were calibrated again and examined. Results showed the need for more accurate ground reference data, before using natural samples in ALS intensity data calibration. Also, the NIR camera-based field system was used for collecting ground reference data. This system proved to be a good means for collecting in situ reference data, especially for targets with inhomogeneous surface reflection properties.

Zn{sub x}Zr{sub y}O{sub z} thin films grown by DC magnetron sputtering

Energy Technology Data Exchange (ETDEWEB)

Sanchez, O. [Instituto de Ciencia de Materiales de Madrid (CSIC), Madrid (Spain); Hernandez-Velez, M. [Departamento de Fisica Aplicada, Universidad Autonoma de Madrid (Spain)

2017-10-15

The structural and optical properties of thin films deposited by DC reactive magnetron co-sputtering using Zn and Zr targets in argon and oxygen gas mixtures at room temperature are reported. The power applied to the Zr cathode was kept constant, while that applied to the Zn cathode was varied between 0 and 150 W to produce very different Zn{sub x}Zr{sub y}O{sub z} ternary compounds with Zn/Zr atomic ratios in the range of 0.1-10. The composition, crystalline structure, and optical properties of the samples were determined by EDX, XRD, FTIR, and UV-visible spectroscopies. The grown films are polycrystalline, and the preferred crystallographic orientation depends on the Zn atomic concentration in the film. The optical transmission in the UV-visible range is approximately 80% in all cases, and as the Zn atomic content increases, the absorption edge shifts to longer wavelengths. The optical band gap, E{sub g}, shifted from 5.5 to 3.5 eV when the Zn/Zr atomic ratio was increased. The results indicate the potential use of these materials in optoelectronic applications. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Synthesis and characterization of nanostructured CaZrO{sub 3} and BaZrO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Ibiapino, Amanda Laura; Figueiredo, Laysa Pires de [Departamento de Quimica, Instituto de Ciencias Exatas e da Terra, Universidade Federal do Mato Grosso, MT (Brazil); Lascalea, Gustavo E. [LISAMEN/CONICET, Ciudad de Mendoza (Argentina); Prado, Rogerio Junqueira, E-mail: rjprado@ufmt.br [Instituto de Fisica, Universidade Federal do Mato Grosso, Cuiaba - MT (Brazil)

2013-09-01

In this work, nanostructured samples of barium zirconate (BaZrO{sub 3}) and calcium zirconate (CaZrO{sub 3}) were synthesized by the gel-combustion method, using glycine as fuel. The ceramic powders were calcined at 550 Degree-Sign C for 2 h and subsequently heat treated at 1350 Degree-Sign C for 10 min (fast-firing). The X-ray diffraction technique was employed to identify and characterize the crystalline phases present in the synthesized powders, using the Rietveld method. Monophasic nanostructured samples of BaZrO{sub 3} and CaZrO{sub 3} presenting average crystallite sizes of around 8.5 and 10.3 nm, respectively, were found after fast-firing. (author)

A quantum mechanical study of La-doped Pb(Zr,Ti)O3

International Nuclear Information System (INIS)

Stashans, Arvids; Maldonado, Frank

2007-01-01

Lanthanum-modified Pb(Zr,Ti)O 3 (PZT) crystals have been investigated applying a quantum-mechanical approach based on the Hartree-Fock theory. A morphotropic phase boundary (MPB), PbZr 0.53 Ti 0.47 O 3 , of the crystal was considered throughout the study. The obtained results show the outward atomic displacements with respect to the La impurity within the defective region and also the increase of covalent nature in the chemical bonding of the material. These outcomes are discussed and analyzed in light of the available experimental data. The occurrence of Jahn-Teller self-trapped electron polarons is predicted in the present report

Valence electron structure and properties of stabilized ZrO2

Institute of Scientific and Technical Information of China (English)

2008-01-01

To reveal the properties of stabilizers in ZrO2 on nanoscopic levels, the valence electron structures of four stable ZrO2 phases and c-ZrO2 were analyzed on the basis of the empirical electron theory of solids and molecules. The results showed that the hybridization levels of Zr atoms in c-ZrO2 doped with Ca and Mg dropped from B17 to B13, the hybridization levels of Zr atoms in c-ZrO2 doped with Y and Ce dropped from B17 to B15, and that the four stabilizing atoms all made the hybridization levels of O atoms drop from level 4 to level 2. The numbers of covalent electrons in the strongest covalent bond in the descending order are c-ZrO2>Zr0.82Ce0.18O2> Zr0.82Y0.18O1.91>Zr0.82Mg0.18O1.82>Zr0.82Ca0.18O1.82. The bond energies of the strongest covalent bond and the melting points of the solid solutions in the descending order are Zr0.82Ce0.18O2> c-ZrO2>Zr0.82Y0.18O1.91>Zr0.82Mg0.18O1.82>Zr0.82Ca0.18O1.82. The percent-ages of the total number of covalent electrons in the descending order are c-ZrO2>Zr0.82Y0.18O1.91> Zr0.82Ce0.18O2>Zr0.82Mg0.18O1.82> Zr0.82Ca0.18O1.82. From the above analysis, it can be concluded that the stabilizing degrees of the four stabilizers in the descending order are CaO> MgO>Y2O3>CeO2.

Density functional study of vibrational, thermodynamic and elastic properties of ZrCo and ZrCoX{sub 3} (X = H, D and T) compounds

Energy Technology Data Exchange (ETDEWEB)

Chattaraj, D., E-mail: debchem@barc.gov.in [Product Development Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Parida, S.C.; Dash, Smruti [Product Development Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Majumder, C. [Chemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India)

2015-04-25

Highlights: • The physico-chemical properties of ZrCo and its hydrides were studied. • The isotope effect on vibrational and thermodynamic properties was investigated. • The changes in elastic properties due to hydrogenation of ZrCo were investigated. • Thermodynamics properties of ZrCo and its hydrides were calculated. - Abstract: The dynamical, thermodynamic and elastic properties of ZrCo and its hydrides ZrCoX{sub 3} (X = H, D and T) are reported. While the electronic structure calculations are performed using plane wave pseudopotential approach, the effect of isotopes on the vibrational and thermodynamic properties has been demonstrated through frozen phonon approach. The results reveal significant difference between the ZrCoH{sub 3} and its isotopic analogs in terms of phonon frequencies and zero point energies. For example, the energy gap between optical and acoustic modes reduces in the order of ZrCoT{sub 3} > ZrCoD{sub 3} > ZrCoH{sub 3}. The vibrational properties shows that the intermetallic ZrCo is dynamically stable whereas ZrCoX{sub 3} (X = H, D and T) are dynamically unstable. The calculated formation energies of ZrCoX{sub 3}, including the ZPE, are −146.7, −158.3 and −164.1 kJ/(mole of ZrCoX{sub 3}) for X = H, D and T, respectively. In addition, the changes in elastic properties of ZrCo upon hydrogenation have also been investigated. The results show that both ZrCo and ZrCoH{sub 3} are mechanically stable at ambient pressure. The Debye temperatures of both ZrCo and ZrCoH{sub 3} are determined using the calculated elastic moduli.

Phase Competition Induced Bio-Electrochemical Resistance and Bio-Compatibility Effect in Nanocrystalline Zr x -Cu100-x Thin Films.

Science.gov (United States)

Badhirappan, Geetha Priyadarshini; Nallasivam, Vignesh; Varadarajan, Madhuri; Leobeemrao, Vasantha Priya; Bose, Sivakumar; Venugopal, Elakkiya; Rajendran, Selvakumar; Angleo, Peter Chrysologue

2018-07-01

Nano-crystalline Zrx-Cu100-x (x = 20-100 at.%) thin films with thickness ranging from 50 to 185 nm were deposited by magnetron co-sputtering with individual Zr and Cu targets. The as-sputtered thin films were characterized by Field Emission Scanning Electron Microscope (FE-SEM), Atomic Force Microscopy (AFM) and Glancing Incidence X-ray Diffraction (GIXRD) for structural and morphological properties. The crystallite size was found to decrease from 57 nm to 37 nm upon increasing the Zr content from 20 to 30 at.% with slight increase in the lattice strain from 0.17 to 0.33%. Further, increase in Zr content to 40 at.% leads to increase in the crystallite size to 57 nm due to stabilization of C10Zr7 phase along with the presence of nanocrystalline Cu-Zr phase. A bimodal distribution of grain size was observed from FE-SEM micrograph was attributed to the highest surface roughness in Zr30Cu70 thin films comprised of Cu10Zr7, Cu9Zr2, Cu-Zr intermetallic phases. In-vitro electrochemical behaviors of nano-crystalline Zrx-Cu100-x thin films in simulated body fluid (SBF) were investigated using potentiodynamic polarization studies. Electrochemical impedance spectroscopy (EIS) data fitting by equivalent electrical circuit fit model suggests that inner bulk layer contributes to high bio-corrosion resistance in Zrx-Cu100-x thin films with increase in Zr content. The results of cyto-compatibility assay suggested that Zr-Cu thin film did not introduce cytotoxicity to osteoblast cells, indicating its suitability as a bio-coating for minimally invasive medical devices.

Diffusion studies in amorphous NiZr alloys

International Nuclear Information System (INIS)

Hahn, H.; Averback, R.S.; Hoshino, K.; Rothman, S.J.

1987-06-01

Tracer impurity and self diffusion measurements have been made on amorphous (a-) NiZr alloys using radioactive tracer, Secondary Ion Mass Spectrometry and Rutherford backscattering techniques. The temperature dependence of diffusion in a-NiZr can be represented in the form D = D 0 exp(-Q/kT), with no structural relaxation effects being observed. The mobility of an atom in a-NiZr increased dramatically with decreasing atomic radius of the diffusing atom and also with decreasing Ni content for Ni concentrations below ≅40 at. %. These diffusion characteristics in a-NiZr are remarkably similar to those in α-Zr and α-Ti. These mechanisms assume that Zr and Ti provide a close packed structure, either crystalline or amorphous, through which small atoms diffuse by an interstitial mechanism and large atoms diffuse by a vacancy mechanism. 12 refs., 2 figs., 2 tabs

{sup 89}Zr-huJ591 immuno-PET imaging in patients with advanced metastatic prostate cancer

Energy Technology Data Exchange (ETDEWEB)

Pandit-Taskar, Neeta; Solomon, Stephen B.; Durack, Jeremy C.; Carrasquillo, Jorge A.; Lefkowitz, Robert A.; Osborne, Joseph R. [Memorial Sloan Kettering Cancer Center, Department of Radiology, New York, NY (United States); Weill Cornell Medical College, Department of Radiology, New York, NY (United States); O' Donoghue, Joseph A. [Memorial Sloan Kettering Cancer Center, Department of Medical Physics, New York, NY (United States); Beylergil, Volkan; Ruan, Shutian; Cheal, Sarah M. [Memorial Sloan Kettering Cancer Center, Department of Radiology, New York, NY (United States); Lyashchenko, Serge [Memorial Sloan Kettering Cancer Center, Department of Radiochemistry and Molecular Imaging Probes Core, New York, NY (United States); Gonen, Mithat [Memorial Sloan Kettering Cancer Center, Department of Epidemiology and Biostatistics, New York, NY (United States); Lewis, Jason S. [Memorial Sloan Kettering Cancer Center, Department of Radiology, New York, NY (United States); Memorial Sloan Kettering Cancer Center, Department of Radiochemistry and Molecular Imaging Probes Core, New York, NY (United States); Memorial Sloan Kettering Cancer Center, Program in Molecular Pharmacology and Chemistry, New York, NY (United States); Weill Cornell Medical College, Department of Radiology, New York, NY (United States); Holland, Jason P. [Memorial Sloan Kettering Cancer Center, Department of Radiology, New York, NY (United States); Harvard Medical School, Department of Radiology of Massachusetts General Hospital, Boston, MA (United States); Reuter, Victor E. [Memorial Sloan Kettering Cancer Center, Department of Pathology, New York, NY (United States); Weill Cornell Medical College, Department of Pathology, New York, NY (United States); Loda, Massimo F. [Dana-Farber Cancer Institute, Boston, MA (United States); Broad Institute of Harvard and MIT, Cambridge, MA (United States); Smith-Jones, Peter M. [Memorial Sloan Kettering Cancer Center, Department of Radiology, New York, NY (United States); Department of Psychiatry and Behavioral Science of Stony Brook University, Stony Brook, NY (United States); Weber, Wolfgang A.; Larson, Steven M. [Memorial Sloan Kettering Cancer Center, Department of Radiology, New York, NY (United States); Memorial Sloan Kettering Cancer Center, Program in Molecular Pharmacology and Chemistry, New York, NY (United States); Weill Cornell Medical College, Department of Radiology, New York, NY (United States); Bander, Neil H. [Memorial Sloan Kettering Cancer Center, Department of Surgery, New York, NY (United States); Weill Cornell Medical College, Department of Urology, New York, NY (United States); Scher, Howard I.; Morris, Michael J. [Memorial Sloan Kettering Cancer Center, Department of Medicine, New York, NY (United States); Weill Cornell Medical College, Department of Medicine, New York, NY (United States)

2014-11-15

Given the bone tropism of prostate cancer, conventional imaging modalities poorly identify or quantify metastatic disease. {sup 89}Zr-huJ591 positron emission tomography (PET) imaging was performed in patients with metastatic prostate cancer to analyze and validate this as an imaging biomarker for metastatic disease. The purpose of this initial study was to assess safety, biodistribution, normal organ dosimetry, and optimal imaging time post-injection for lesion detection. Ten patients with metastatic prostate cancer received 5 mCi of {sup 89}Zr-huJ591. Four whole-body scans with multiple whole-body count rate measurements and serum activity concentration measurements were obtained in all patients. Biodistribution, clearance, and lesion uptake by {sup 89}Zr-huJ591 immuno-PET imaging was analyzed and dosimetry was estimated using MIRD techniques. Initial assessment of lesion targeting of {sup 89}Zr-huJ591 was done. Optimal time for imaging post-injection was determined. The dose was well tolerated with mild chills and rigors seen in two patients. The clearance of {sup 89}Zr-huJ591 from serum was bi-exponential with biological half-lives of 7 ± 4.5 h (range 1.1-14 h) and 62 ± 13 h (range 51-89 h) for initial rapid and later slow phase. Whole-body biological clearance was 219 ± 48 h (range 153-317 h). The mean whole-body and liver residence time was 78.7 and 25.6 h, respectively. Dosimetric estimates to critical organs included liver 7.7 ± 1.5 cGy/mCi, renal cortex 3.5 ± 0.4 cGy/mCi, and bone marrow 1.2 ± 0.2 cGy/mCi. Optimal time for patient imaging after injection was 7 ± 1 days. Lesion targeting of bone or soft tissue was seen in all patients. Biopsies were performed in 8 patients for a total 12 lesions, all of which were histologically confirmed as metastatic prostate cancer. One biopsy-proven lesion was not positive on {sup 89}Zr-huJ591, while the remaining 11 lesions were {sup 89}Zr-huJ591 positive. Two biopsy-positive nodal lesions were noted only on

Microstructural investigation of as-cast uranium rich U–Zr alloys

Energy Technology Data Exchange (ETDEWEB)

Zhang, Yuting, E-mail: zhangyuting@caep.cn [Science and Technology on Surface Physics and Chemistry Laboratory, Jiangyou 621908, Sichuan (China); School of Nuclear Science and Technology, National Synchrotron Radiation Laboratory, University of Science and Technology of China, Hefei 230029, Anhui (China); Wang, Xin [Science and Technology on Surface Physics and Chemistry Laboratory, Jiangyou 621908, Sichuan (China); Zeng, Gang [Institute of Materials, China Academy of Engineering Physics, Jiangyou 621908, Sichuan (China); Wang, Hui [Science and Technology on Surface Physics and Chemistry Laboratory, Jiangyou 621908, Sichuan (China); Jia, Jianping [Institute of Materials, China Academy of Engineering Physics, Jiangyou 621908, Sichuan (China); Sheng, Liusi [School of Nuclear Science and Technology, National Synchrotron Radiation Laboratory, University of Science and Technology of China, Hefei 230029, Anhui (China); Zhang, Pengcheng, E-mail: zpc113@sohu.com [Science and Technology on Surface Physics and Chemistry Laboratory, Jiangyou 621908, Sichuan (China)

2016-04-01

The present study evaluates the microstructure in as-cast uranium rich U–Zr alloys, an important subsystem of U–Pu–Zr ternary metallic nuclear reactor fuel, as a function of the Zr content, from 2wt.% to 15wt.%Zr. It has been previously suggested that the unique intermetallic compound δ phase in U–Zr alloys is only present in as-cast U–Zr alloys with a Zr content exceeding 10wt.%Zr. However, our analysis of transmission electron microscopy (TEM) data shows that the δ phase is common to all as-cast alloys studied in this work. Furthermore, specific coherent orientation relationship is found between the α and δ phases, consistent with previous findings, and a third variant is discovered in this paper. - Highlights: • Initially, lattice parameter of as-cast U–Zr alloys decrease with the increasing Zr content, and then increase. • XRD data show the presence of δ-UZr{sub 2} phase in as-cast U–Zr alloys with a Zr content of more than 8wt.% Zr. • Finding δ-UZr{sub 2} phase exists in all as-cast uranium rich U–Zr alloys, even for alloys with a lean Zr content. • Three kinds of preferential orientations of the δ phase grow.

Design lateral heterostructure of monolayer ZrS2 and HfS2 from first principles calculations

Science.gov (United States)

Yuan, Junhui; Yu, Niannian; Wang, Jiafu; Xue, Kan-Hao; Miao, Xiangshui

2018-04-01

The successful fabrication of two-dimensional lateral heterostructures (LHS's) has opened up unprecedented opportunities in material science and device physics. It is therefore highly desirable to search for more suitable materials to create such heterostructures for next-generation devices. Here, we investigate a novel lateral heterostructure composed of monolayer ZrS2 and HfS2 based on density functional theory. The phonon dispersion and ab initio molecular dynamics analysis indicate its good kinetic and thermodynamic stability. Remarkably, we find that these lateral heterostructures exhibit an indirect to direct bandgap transition, in contrast to the intrinsic indirect bandgap nature of ZrS2 and HfS2. The type-II alignment and chemical bonding across the interline have also been revealed. The tensile strain is proved to be an efficient way to modulate the band structure. Finally, we further discuss other three stable lateral heterostructures: (ZrSe2)2(HfSe2)2 LHS, (ZrS2)2(ZrSe2)2 LHS and (HfS2)2(HfSe2)2 LHS. Generally, the lateral heterostructures of monolayer ZrS2 and HfS2 are of excellent electrical properties, and may find potential applications for future electronic devices.

Highly resolving Rutherford-scattering spectrometry for the study of ZrO{sub 2} layer growth in the beginning stage; Hochaufloesende Rutherford-Streuspektrometrie zur Untersuchung von ZrO{sub 2}-Schichtwachstum im Anfangsstadium

Energy Technology Data Exchange (ETDEWEB)

Vieluf, Maik

2010-06-15

By means of High Resolution Rutherford Backscattering Spectrometry (HR-RBS) the diffusion behaviour and layer growth of ZrO{sub 2} on SiO{sub 2} and TiN in the initial regime were investigated. The analysis of concentration profiles in ultrathin layers and interfaces was the focus of this work, made possible by the excellent depth resolution of less than 0.3 nm near the surface. For the first time a two-dimensional position sensitive semiconductor detector was implemented and characterized in the setup of the HR-RBS for the improvement of the quality of the measurement results. Furthermore, a measurement procedure was put into operation that allowed the reduction of ion induced damage. Through the optimization of the experimental conditions and the development of a program package for the support of the analyst, an efficient measurement procedure could be routinely ensured. At the time of a binary collision between the incident ion and the target element with a small impact factor, the charge state changes frequently, especially due to the abruptly decreasing ion velocity of the projectile and the overlapping of the electron clouds. For HR-RBS with an energy-separating dipole magnet, the charge state distribution of the scattered ions must be known for the interpretation of the measured spectra. For the first time a significant dependence of the charge state distribution of the scattered C ions on the layer thickness as well as atomic number of the detected target elements, here from the fourth subgroup, was demonstrated. This new knowledge allowed systematic investigations of the ZrO{sub 2} layer growth in the initial regime. The ZrO{sub 2} layers were produced by means of the atomic layer deposition (ALD). Based on the evidence for agglomeration of ZrO{sub 2} on SiO{sub 2} a method was introduced, which takes local thickness variations into account during the simulation of the HR-RBS spectra. An accurate statement about the ZrO{sub 2}/SiO{sub 2} interface was

A two-phase model to describe the dissolution of ZrO2 by molten Zr

International Nuclear Information System (INIS)

Belloni, J.; Fichot, F.; Goyeau, B.; Gobin, D.; Quintard, M.

2007-01-01

In case of a hypothetical severe accident in a nuclear Pressurized Water Reactor (PWR), the fuel elements in the core may reach very high temperatures (more than 2000 K). UO 2 (Uranium dioxide) pellets are enclosed by a cladding mainly composed of Zircaloy (Zr). If the temperature became higher than 2100 K (melting temperature of Zr), the UO 2 pellets would be in contact with molten Zr, resulting in the dissolution and liquefaction of UO 2 at a lower temperature than its melting points (3100 K). Several experimental and numerical investigations have led to a better understanding of this phenomenon but a comprehensive and consistent modeling is still missing. The goal of this paper is to propose a two-phase macroscopic model describing the dissolution of a solid alloy by a liquid. The model is limited to binary alloys and it is applied to the particular case of the dissolution of ZrO 2 by liquid Zr, for which experimental data are available (Hofmann et al., 1999). The model was established by using a volume averaging method. Numerical simulations are compared to experimental results and show a good agreement. (authors)

Fabrication of mock-up with Be armour tiles diffusion bonded to the CuCrZr heat sink

International Nuclear Information System (INIS)

Moreschi, L.F.; Pizzuto, A.; Alessandrini, I.; Agostini, M.; Visca, E.; Merola, M.

2001-01-01

The aim of this work is the manufacture of high heat flux mock-ups with Be armour tiles on a CuCrZr heat sink for fabricating the beryllium section of the divertor vertical target (DVT) in the ITER reactor. Diffusion bonding between the CuCrZr bar and the beryllium tiles was obtained by inserting an aluminium interlayer to accommodate surface irregularities as well as to provide a compliant layer for accommodating thermal mismatches during both manufacturing and operation and cycles

Effect of thermal annealing on resistance switching characteristics of Pt/ZrO2/TiN stacks

International Nuclear Information System (INIS)

Kim, Jonggi; Lee, Kyumin; Kim, Yonjae; Na, Heedo; Ko, Dae-Hong; Sohn, Hyunchul; Lee, Sunghoon

2013-01-01

In this study, the effect of thermal annealing on both the physical properties and the resistive switching properties of ZrO 2 films deposited by atomic layer deposition (ALD) method were investigated for its potential application to non-volatile memory devices. The ZrO 2 films in the Pt/ZrO 2 /TiN structure exhibited unipolar and bipolar resistance switching behaviors depending on the nature of the bias applied to Pt top electrodes for the electro-forming process. For unipolar switching, the resistance of the high resistance state (HRS) was reduced with increasing annealing temperature, accompanied with the increase of metallic Zr in the annealed ZrO 2 films. In contrast, the HRS resistance in the bipolar switching was increased while the low resistance state (LRS) resistance was decreased with increasing annealing temperature, producing a greater change in resistance. SIMS and EDX showed that the thickness of interfacial TiO x N y layer between the ZrO 2 and the TiN bottom electrode was enlarged with annealing. The enlarged TiO x N y layer was expected to produce the reduction of LRS resistance with the increase of HRS resistance in the bipolar resistance switching. - Highlights: • Effect of thermal annealing on resistive switching of ZrO 2 was investigated. • Both unipolar and bipolar switching were shown in the Pt/ZrO 2 /TiN stack. • TiO x N y interface layer was enlarged with increasing annealing temperature. • TiO x N y interface plays an important role in resistive switching properties

The effect of sintering conditions and ZrN volume fraction on the mechanical properties of spark plasma sintered W/ZrN composites

International Nuclear Information System (INIS)

Lee, Dongju; Umer, Malik Adeel; Shin, Yoochul; Jeon, Seokwoo; Hong, Soonhyung

2012-01-01

Highlights: ► Effect of sintering conditions on properties of W composites was investigated. ► Effect of ZrN volume fraction on properties of W composites was investigated. ► The grain size and relative density increased with increasing sintering temperature. ► ZrN particles led to an increase in strength of W and a decrease in grain size. ► Highest flexural strength was obtained for 10 vol.% W/ZrN with lowest agglomeration. - Abstract: In an effort to improve the room temperature mechanical properties of tungsten, W/ZrN composites were fabricated by high energy ball milling followed by spark plasma sintering at temperatures in a range of 1200–1700 °C under a pressure of 50 MPa. The effects of sintering conditions and ZrN volume fraction on the mechanical properties of the W/ZrN composites were studied and the results were compared to the properties of monolithic tungsten. The grain size of monolith tungsten and W/ZrN composites was found to increase with an increase in sintering temperature and time. In the case of the W/ZrN composites, ZrN particles led to an increase in the compressive strength of tungsten and a decrease in grain size. The increase in compressive strength of the composites was attributed to a reinforcement effect of ZrN particles as well as grain size refinement according to the Hall–Petch relation. Compressive strength of the composites increased with increasing ZrN content while the flexural strength decreased for samples with ZrN content exceeding 10 vol.%. This was attributed to the effects of ZrN agglomeration within the tungsten matrix.

Nanoindentation of ZrO{sub 2} and ZrO{sub 2}/Zr systems by molecular dynamics simulation

Energy Technology Data Exchange (ETDEWEB)

Lu, Zizhe; Chernatynskiy, Aleksandr; Noordhoek, Mark J.; Sinnott, Susan B.; Phillpot, Simon R., E-mail: sphil@mse.ufl.edu

2017-04-01

The deformation behaviors of cubic zirconia and a cubic zirconia thin film on top of an hcp zirconium substrate are investigated using molecular dynamics nanoindentation simulation. Interatomic interactions are described by the previously developed Charge Optimized Many Body (COMB) potential for the Zr-ZrO{sub 2}-O{sub 2} system. The load-displacement curves, deformation processes and hardnesses of zirconia and the zirconia/zirconium systems are characterized. In addition, by comparing with a previous nanoindentation simulation on zirconium, the effects of the zirconia layer on top on the mechanical properties of the zirconium substrate are determined.

Specificity in the interaction of natural products with their target proteins--a biochemical and structural insight.

Science.gov (United States)

Venkatraman, Prasanna

2010-06-01

Natural products are an abundant source of anti cancer agents. They act as cytotoxic drugs, and inhibitors of apoptosis, transcription, cell proliferation and angiogenesis. While pathways targeted by natural products have been well studied, there is paucity of information about the in vivo molecular target/s of these compounds. This review summarizes some of the natural compounds for which the molecular targets, mechanism of action and structural basis of specificity have been well documented. These examples illustrate that 'off target' binding can be explained on the basis of diversity inherent to biomolecular interactions. There is enough evidence to suggest that natural compounds are potent and versatile warheads that can be optimized for a multi targeted therapeutic intervention in cancer.

Mechanism and deuterium pickup in Zr-2.5Nb alloy

International Nuclear Information System (INIS)

Ploc, R.A.

1999-12-01

There are approximately 400 Zr-2.5Nb pressure tubes in a CANDU reactor. During operation, the pressure tubes contain heavy water at about 300 deg C, 10.3 NPa with a room-temperature pD of 10.5. Operation of the pressure tube in the environment leads to oxide formation and absorption of deuterium. Excess deuterium absorption leads to precipitation of zirconium deuterides in the metal. A knowledge of how the deuterium passes through the oxide film to enter into the metal is an important step in gaining control over ingress rates. Fresnel fringe imaging of cross-sectioned oxides grown on pressure tubes, combined with tilting in the electron microscope, has revealed the three-dimensional nature of porosity in the oxide films. Two primary types exist, flake and ribbon. The main route for deuterium ingress is via ribbon porosity, as shown by electrochemical impedance spectroscopy. The location of the ribbon porosity is along the boundary between the oxidized α-Zr and β-Zr phases. Modifications to reduce ribbon porosity are possible and this, in turn, leads to significantly lower rates of deuterium absorption and extension of pressure-tube lifetime. (author)

Study of the neutron decays of giant resonances excited by the inelastic scattering of 36 Ar on 90 Zr and 94 Zr targets at 44 MeV/u: a signature of multiphonon states

International Nuclear Information System (INIS)

Pascalon-Rozier, V.

1997-01-01

In inelastic heavy ion scattering, to angles near to the grazing angle, giant resonances (GR) are excited with very large differential cross sections. It has been shown that multiphonon states, states built with several GR quanta, can also been excited. These states can be revealed through the measurement of their decay by light particle emission. In this thesis, we report on the study of inelastic scattering of 36 Ar at 44 MeV/u on target of 90 Zr and 94 Zr, measured in coincidence with neutrons detected with the EDEN multidetector. The analysis of the inelastic spectra show evidence for a structure at high excitation energy, exhibiting characteristics compatible with a two-photon excitation. The construction of missing energy spectra allows us to the study of the GR and the high energy structure. In both nuclei, the GR presents a direct decay branch of 8%, which yields informations on the microscopic structure of the resonance. A two phonon state, interpreted as two weakly coupled GR's, built on one top of the other, and each phonon is expected to exhibit the same direct decay pattern as the GR. Such a simple decay is observed in the data, proving that the structure observed is due to the excitation of the two phonon state in both nuclei studied. Finally, we present a theoretical development based on Random Phase Approximation calculation, predicting that the two phonon state should be very harmonic. This result is in agreement with experimental studies of double phonon states over a large range of nuclei (from A = 12 to 208) carried out with several different probes. (author)

Dehydration of Sugar Mixture to HMF and Furfural over SO42-/ZrO2-TiO2 Catalyst

Directory of Open Access Journals (Sweden)

Junhua Zhang

2014-05-01

Full Text Available A series of sulfated zirconia-titanium dioxide (SO42-/ZrO2-TiO2 catalysts with different Zr-Ti molar ratios were prepared by a precipitation and impregnation method and characterized by ammonia adsorption/ temperature programmed desorption (NH3-TPD, X-ray diffraction (XRD, and X-ray photoelectron spectroscopy (XPS techniques. The catalysts were used in the catalytic conversion of a sugar mixture (glucose and xylose to 5-hydroxymethylfurfural and furfural in a water/n-butanol reaction system. An optimized yield of 26.0 mol% for 5-hydroxymethylfurfural and 47.5 mol% for furfural was obtained within 2 h at 170 °C over the SO42-/ZrO2-TiO2 catalyst with a Zr-Al molar ratio of 7:3. Catalysts with higher acidity and moderate basicity were more favorable for the formation of the target product.

Radiation-induced effects on the mechanical properties of natural ZrSiO4: double cascade-overlap damage accumulation

Science.gov (United States)

Beirau, Tobias; Nix, William D.; Pöllmann, Herbert; Ewing, Rodney C.

2017-11-01

Several different models are known to describe the structure-dependent radiation-induced damage accumulation process in materials (e.g. Gibbons Proc IEEE 60:1062-1096, 1972; Weber Nuc Instr Met Phys Res B 166-167:98-106, 2000). In the literature, two different models of damage accumulation due to α-decay events in natural ZrSiO4 (zircon) have been described. The direct impact damage accumulation model is based on amorphization occurring directly within the collision cascade. However, the double cascade-overlap damage accumulation model predicts that amorphization will only occur due to the overlap of disordered domains within the cascade. By analyzing the dose-dependent evolution of mechanical properties (i.e., Poisson's ratios, compliance constants, elastic modulus, and hardness) as a measure of the increasing amorphization, we provide support for the double cascade-overlap damage accumulation model. We found no evidence to support the direct impact damage accumulation model. Additionally, the amount of radiation damage could be related to an anisotropic-to-isotropic transition of the Poisson's ratio for stress along and perpendicular to the four-fold c-axis and of the related compliance constants of natural U- and Th-bearing zircon. The isotropification occurs in the dose range between 3.1 × and 6.3 × 1018 α-decays/g.

Radiation-induced effects on the mechanical properties of natural ZrSiO4: double cascade-overlap damage accumulation

Science.gov (United States)

Beirau, Tobias; Nix, William D.; Pöllmann, Herbert; Ewing, Rodney C.

2018-05-01

Several different models are known to describe the structure-dependent radiation-induced damage accumulation process in materials (e.g. Gibbons Proc IEEE 60:1062-1096, 1972; Weber Nuc Instr Met Phys Res B 166-167:98-106, 2000). In the literature, two different models of damage accumulation due to α-decay events in natural ZrSiO4 (zircon) have been described. The direct impact damage accumulation model is based on amorphization occurring directly within the collision cascade. However, the double cascade-overlap damage accumulation model predicts that amorphization will only occur due to the overlap of disordered domains within the cascade. By analyzing the dose-dependent evolution of mechanical properties (i.e., Poisson's ratios, compliance constants, elastic modulus, and hardness) as a measure of the increasing amorphization, we provide support for the double cascade-overlap damage accumulation model. We found no evidence to support the direct impact damage accumulation model. Additionally, the amount of radiation damage could be related to an anisotropic-to-isotropic transition of the Poisson's ratio for stress along and perpendicular to the four-fold c-axis and of the related compliance constants of natural U- and Th-bearing zircon. The isotropification occurs in the dose range between 3.1 × and 6.3 × 1018 α-decays/g.

Measurement of astrophysical S-factors and electron screening potentials for d(d,n){sup 3}He reaction in ZrD{sub 2}, TiD{sub 2} and TaD{sub 0.5} targets in the ultralow energy region using plasma accelerator

Energy Technology Data Exchange (ETDEWEB)

Bystritsky, V.M., E-mail: bystvm@jinr.ru [Joint Institute for Nuclear Research, Dubna, Moscow Region (Russian Federation); Bystritskii, Vit.M. [Department of Physics and Astronomy, University of California, Irvine (United States); Dudkin, G.N. [National Scientific Research Tomsk Polytechnical University, Tomsk (Russian Federation); Filipowicz, M. [Faculty of Energy and Fuels, AGH, University of Science and Technology, Cracow (Poland); Gazi, S.; Huran, J. [Institute of Electrical Engineering, SAS, Bratislava (Slovakia); Kobzev, A.P. [Joint Institute for Nuclear Research, Dubna, Moscow Region (Russian Federation); Mesyats, G.A. [Lebedev Physical Institute of the Russian Academy of Sciences, Moscow (Russian Federation); Nechaev, B.A.; Padalko, V.N. [National Scientific Research Tomsk Polytechnical University, Tomsk (Russian Federation); Parzhitskii, S.S. [Joint Institute for Nuclear Research, Dubna, Moscow Region (Russian Federation); Pen' kov, F.M. [Institute of Nuclear Physics, NNC, Almaty (Kazakhstan); Philippov, A.V. [Joint Institute for Nuclear Research, Dubna, Moscow Region (Russian Federation); Kaminskii, V.L. [National Scientific Research Tomsk Polytechnical University, Tomsk (Russian Federation); Tuleushev, Yu.Zh. [Institute of Nuclear Physics, NNC, Almaty (Kazakhstan); Wozniak, J. [Faculty of Physics and Applied Computer Sciences, AGH, University of Science and Technology, Cracow (Poland)

2012-09-01

The present paper is devoted to the study of the electron screening effect influence on the rate of d(d,n){sup 3}He reaction in the ultralow deuteron collision energy range in the deuterated metals (ZrD{sub 2}, TiD{sub 2} and TaD{sub 0.5}). The ZrD{sub 2}, TiD{sub 2} and TaD0.5 targets were fabricated via magnetron sputtering of titanium, zirconium and tantalum in gas (deuterium) environment. The experiments have been carried out using the high-current pulsed Hall plasma accelerator (NSR TPU, Russia). The detection of neutrons with energy of 2.5 MeV from the dd reaction was done with plastic scintillation spectrometers. As a result of the experiments, the energy dependences of the astrophysical S-factor for the dd reaction in the deuteron collision energy range of 2-7 keV and the values of the electron screening potential U{sub e} of the interacting deuterons have been measured for the above targets: U{sub e}(ZrD{sub 2})=(205{+-}35) eV; U{sub e}(TiD{sub 2})=(125{+-}34) eV; U{sub e}(TaD{sub 0.5})=(313{+-}58) eV. Our results are compared with the other published experimental and calculated data.

Crystallization of AlON layers and its effects on the microstructure and hardness of reactively synthesized ZrN/AlON nanomultilayers

Energy Technology Data Exchange (ETDEWEB)

Dong Yunshan; Yue Jianling; Liu Yan; Li Geyang [State Key Lab of Metal Matrix Composites, Shanghai Jiao Tong University, Shanghai, 200030 (China)

2006-11-21

By reactively sputtering Zr and Al{sub 2}O{sub 3} targets in a gaseous mixture of Ar and N{sub 2}, ZrN/AlON nanomultilayers were synthesized to study the crystallization conditions for AlON layers and how they influence the characteristics of multilayers. The composition analysis indicated that some of the oxygen atoms were replaced by nitrogen atoms in Al{sub 2}O{sub 3}, leading to the formation of aluminium oxynitride, AlON, during the procedure of the Al{sub 2}O{sub 3} target being sputtered in the gaseous mixture. Further investigations showed that when their thickness was limited to less than 1 nm, amorphous AlON layers were crystallized under the template effects of crystalline ZrN layers, and then coherent interfaces formed as a result. Correspondingly, the multilayers were remarkably strengthened with hardness approaching a maximum of 33 GPa. After the layer thickness of AlON exceeded the critical value of 1 nm, the subsequently deposited AlON grew amorphously and blocked the epitaxial growth of multilayers, accompanied by the decline of hardness. Yet, on the other hand, the integrated hardness of multilayers was not sensitive to the thickness of the ZrN template layers and its value was maintained a bit higher than 30 GPa in a wide range of ZrN layer thickness variations.

The secondary electron yield of TiZr and TiZrV non evaporable getter thin film coatings

CERN Document Server

Scheuerlein, C; Hilleret, Noël; Taborelli, M

2001-01-01

The secondary electron yield (SEY) of two different non evaporable getter (NEG) samples has been measured 'as received' and after thermal treatment. The investigated NEGs are TiZr and TiZrV thin film coatings of 1 mm thickness, which are sputter deposited onto copper substrates. The maximum SEY dmax of the air exposed TiZr and TiZrV coating decreases from above 2.0 to below 1.1 during a 2 hour heat treatment at 250 °C and 200 °C, respectively. Saturating an activated TiZrV surface under vacuum with the gases typically present in ultra high vacuum systems increases dmax by about 0.1. Changes in elemental surface composition during the applied heat treatments were monitored by Auger electron spectroscopy (AES). After activation carbon, oxygen and chlorine were detected on the NEG surfaces. The potential of AES for detecting the surface modifications which cause the reduction of SE emission during the applied heat treatments is critically discussed.

Amorphous Ti-Zr

International Nuclear Information System (INIS)

Rabinkin, A.; Liebermann, H.; Pounds, S.; Taylor, T.

1991-01-01

This paper is the first report on processing, properties and potential application of amorphous titanium/zirconium-base alloys produced in the form of a good quality continuous and ductile ribbon having up to 12.5 mm width. To date, the majority of titanium brazing is accomplished using cooper and aluminum-base brazing filler metals. The brazements produced with these filler metals have rather low (∼300 degrees C) service temperature, thus impeding progress in aircraft and other technologies and industries. The attempt to develop a generation of high temperature brazing filler metals was made in the late sixties-early seventies studies in detail were a large number of Ti-, Zr-Ti-Zr, Ti-V and Zr-V-Ti based alloys. The majority of these alloys has copper and nickel as melting temperature depressants. The presence of nickel and copper converts them into eutectic alloys having [Ti(Zr)] [Cu(Ni)], intermetallic phases as major structural constituents. This, in turn, results in high alloy brittleness and poor, if any, processability by means of conventional, i.e. melting-ingot casting-deformation technology. In spite of good wettability and high joint strength achieved in dozens of promising alloys, only Ti-15Cu-15Ni is now widely used as a brazing filler metal for high service temperature. Up until now this material could not be produced as a homogeneous foil and is instead applied as a clad strip consisting of three separate metallic layers

Development of Zr alloys - Fabrication of Zr-Nb alloy used in PHWRs

Energy Technology Data Exchange (ETDEWEB)

Lee, Kang In; Kim, Won Baek; Choi, Guk Sun; Lee, Chul Kyung; Jang, Dae Kyu; Seo, Chang Yeol; Sim, Kun Joo; Lee, Jae Cheon [Korea Institute of Geology Mining and Materials, Taejon (Korea, Republic of)

1996-07-01

The manufacture of Zr-Nb alloy ingot by EB melting process is carried out to meet the chemical composition and mechanical and property specifications and to ensure that the ingots are free of unacceptable defects through this study. It was established that Zr-Nb alloy was made by EB melting technique including the control of adding elements, melting power and melting and cast device. 28 refs., 13 tabs., 26 figs., 23 ills. (author)

X-ray study of rapidly cooled ribbons of Al-Cr-Zr and Al-Ni-Y-Cr-Zr alloys

International Nuclear Information System (INIS)

Betsofen, S.Ya.; Osintsev, O.E.; Lutsenko, A.N.; Konkevich, V.Yu.

2002-01-01

One investigated into phase composition, lattice spacing and structure of rapidly cooled 25-200 μm gauge strips made of Al-4,1Cr-3,2Zr and Al-1,5Cr-1,5Zr-4Ni-3Y alloys, wt. %, produced by melt spinning to a water-cooled copper disk. In Al-4,1Cr-3,2Zr alloy one detected intermetallic phases: Al 3 Zr and two Al 86 Cr 14 composition icosahedral phases apart from aluminium solid solution with 4.040-4.043 A lattice spacing. In Al-1,5Cr-1,5Zr-4Ni-3Y alloy one identified two Al 86 Cr 14 icosahedral phases and two AlNiY and Al 3 Y yttrium-containing ones, lattice spacing of aluminium solid solution was equal to 4.052-4.053 A [ru

Behavior of LASL-made graphite, ZrC, and ZrC-containing coated particles in irradiation tests HT-28 and HT-29

International Nuclear Information System (INIS)

Reiswig, R.D.; Wagner, P.; Hollabaugh, C.M.; White, R.W.; O'Rourke, J.A.; Davidson, K.V.; Schell, D.H.

1976-01-01

Three types of materials, extruded graphite, hot-pressed ZrC, and particles with ZrC coatings, were irradiated in ORNL High Fluence Isotope Reactor Irradiation tests HT-28 and HT-29. The ZrC seemed unaffected. The graphite changed in dimensions, x-ray diffraction parameters, and thermal conductivity. The four types of coated particles tested all resisted the irradiation well, except one set of particles with double-graded C-ZrC-C coats. Overall, the results were considered encouraging for use of ZrC and extruded graphite fuel matrices. 16 fig

Target selection for the HRIBF Project

International Nuclear Information System (INIS)

Dellwo, J.; Alton, G.D.; Batchelder, J.C.

1994-01-01

Experiments are in progress at the Oak Ridge National Laboratory (ORNL) which are designed to select the most appropriate target materials for generating particular radioactive ion beams for the Holifield Radioactive Ion Beam Facility (HRIBF). The 25-MV tandem accelerator is used to implant stable complements of interesting radioactive elements into refractory targets mounted in a high-temperature FEBIAD ion source which is on-line at the UNISOR facility. These experiments permit selection of the target material most appropriate for the rapid release of the element of interest, as well as realistic estimates of the efficiency of the FEBIAD source. From diffusion release data information on the release times and diffusion coefficients can be derived. Diffusion coefficients for CI implanted into and diffused from CeS and Zr 5 Si 3 and As, Br, and Se implanted into and diffused from Zr 5 Ge 3 have been derived from the resulting intensity versus time profiles

Interdiffusion and reaction between U and Zr

Science.gov (United States)

Park, Y.; Newell, R.; Mehta, A.; Keiser, D. D.; Sohn, Y. H.

2018-04-01

The microstructural development and diffusion kinetics were examined for the binary U vs. Zr system using solid-to-solid diffusion couples, U vs. Zr, annealed at 580 °C for 960 h, 650 °C for 480 h, 680 °C for 240 h, and 710 °C for 96 h. Scanning and transmission electron microscopies with X-ray energy dispersive spectroscopy were employed for detailed microstructural and compositional analyses. Interdiffusion and reaction in U vs. Zr diffusion couples primarily produced: δ-UZr2 solid solution (hP3) and α‧-U at 580 °C; and (γU,βZr) solid solution (cI2) and α‧-U at 650°, 680° and 710 °C. The α‧-phase was confirmed as a reduced variant of the α-U orthorhombic structure with lattice parameters, a × b × c = 2.65 × 5.40 × 4.75 (Å) with a negligible solubility for Zr at room temperature. Concentration profiles were examined to determine interdiffusion coefficients, integrated interdiffusion coefficients, and intrinsic diffusion coefficients using Boltzmann-Matano, Wagner, and Heumann analyses, respectively. Composition-dependence of interdiffusion coefficients were documented for α-U, δ-UZr2 (at 580 °C) and (γU,βZr) solid solution (at 650°, 680° and 710 °C). U was determined to intrinsically diffuse faster than Zr, approximately by an order of magnitude, in the δ-UZr2 at 580 °C, and (γU,βZr) phases at 650°, 680° and 710 °C. Based on Darken's approach, thermodynamic data available in literature were coupled to estimate the tracer diffusion coefficients and atomic mobilities of U and Zr.

Thermal expansion of phosphates with the NaZr2(PO4)3 structure containing lanthanides and zirconium: R0.33Zr2(PO4)3 (R = Nd, Eu, Er) and Er0.33(1–x) Zr0.25xZr2(PO4)3

International Nuclear Information System (INIS)

Volgutov, V. Yu.; Orlova, A. I.

2015-01-01

Phosphates R 0.33 Zr 2 (PO 4 ) 3 (R = Nd, Eu, or Er) and Er 0.33(1–x) Zr 0.25 Zr 2 (PO 4 ) 3 (x = 0, 0.25, 0.5, 0.75, 1.0) of the NaZr 2 (PO 4 ) 3 family have been synthesized and investigated by high-temperature X-ray diffraction. The crystallochemical approach is used to obtain compounds with expected small and controllable thermal-expansion parameters. Phosphates with close-to-zero thermal-expansion parameters, including those with low thermal-expansion anisotropy, have been obtained: Nd 0.33 Zr 2 (PO 4 ) 3 with α a =–2.21 × 10 −6 °C −1 , α c = 0.81 × 10 −6 °C −1 , and Δα = 3.02 × 10 −6 °C –1 and Er 0.08 Zr 0.19 Zr 2 (PO 4 ) 3 with α a =–1.86 × 10 −6 °C −1 , α c = 1.73 × 10 −6 °C −1 , and Δα = 3.58 × 10 −6 °C −1

Zr-(Cu,Ag)-Al bulk metallic glasses

International Nuclear Information System (INIS)

Jiang, Q.K.; Wang, X.D.; Nie, X.P.; Zhang, G.Q.; Ma, H.; Fecht, H.-J.; Bendnarcik, J.; Franz, H.; Liu, Y.G.; Cao, Q.P.; Jiang, J.Z.

2008-01-01

In this paper, we report the formation of a series Zr-(Cu,Ag)-Al bulk metallic glasses (BMGs) with diameters at least 20 mm and demonstrate the formation of about 25 g amorphous metallic ingots in a wide Zr-(Cu,Ag)-Al composition range using a conventional arc-melting machine. The origin of high glass-forming ability (GFA) of the Zr-(Cu,Ag)-Al alloy system has been investigated from the structural, thermodynamic and kinetic points of view. The high GFA of the Zr-(Cu,Ag)-Al system is attributed to denser local atomic packing and the smaller difference in Gibbs free energy between amorphous and crystalline phases. The thermal, mechanical and corrosion properties, as well as elastic constants for the newly developed Zr-(Cu,Ag)-Al BMGs, are also presented. These newly developed Ni-free Zr-(Cu,Ag)-Al BMGs exhibit excellent combined properties: strong GFA, high strength, high compressive plasticity, cheap and non-toxic raw materials and biocompatible property, as compared with other BMGs, leading to their potential industrial applications

Microstructure and mechanical properties of Zr-Si-N films prepared by rf-reactive sputtering

CERN Document Server

Nose, M; Zhou, M; Mae, T; Meshii, M

2002-01-01

ZrN and ZrSiN films were prepared in an rf sputtering apparatus that has a pair of targets facing each other (referred to as the facing target--type rf sputtering). Films were deposited on silicon wafers without bias application or substrate heating in order to examine only the effect of silicon addition to the transition metal nitride films. The contents of zirconium, nitrogen, and silicon of the films were determined with an electron probe microanalyzer. The transmission electron microscopy studies were carried out in addition to x-ray diffraction. For the high resolution transmission electron microscopy observation, the field emission type transmission electron microscope was used, which provides a point-to-point resolution of 0.1 nm. The samples were observed both parallel and perpendicular to the film surface, which were plane and cross sectional views, respectively. In order to investigate the relationship between the mechanical properties and microstructure of films, the hardness was measured by a nano...

A quantum mechanical study of La-doped Pb(Zr,Ti)O{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Stashans, Arvids [Grupo de Fisica de Cristales, Escuela de Electronica y Telecomunicaciones, Universidad Tecnica Particular de Loja, Apartado 11-01-608, Loja (Ecuador)]. E-mail: arvids@utpl.edu.ec; Maldonado, Frank [Grupo de Fisica de Cristales, Escuela de Electronica y Telecomunicaciones, Universidad Tecnica Particular de Loja, Apartado 11-01-608, Loja (Ecuador)

2007-04-15

Lanthanum-modified Pb(Zr,Ti)O{sub 3} (PZT) crystals have been investigated applying a quantum-mechanical approach based on the Hartree-Fock theory. A morphotropic phase boundary (MPB), PbZr{sub 0.53}Ti{sub 0.47}O{sub 3}, of the crystal was considered throughout the study. The obtained results show the outward atomic displacements with respect to the La impurity within the defective region and also the increase of covalent nature in the chemical bonding of the material. These outcomes are discussed and analyzed in light of the available experimental data. The occurrence of Jahn-Teller self-trapped electron polarons is predicted in the present report.

Corrosion behavior of Zr-x(Nb, Sn and Cu) binary alloys

International Nuclear Information System (INIS)

Kim, M. H.; Lee, M. H.; Park, S. Y.; Jung, Y. H.; We, M. Y.

1999-01-01

For the development of advanced zirconium alloys for nuclear fuel cladding, the corrosion behaviors of zirconium binary alloys were studied on the Zr-xNb, Zr-xSn, and Zr-xCu alloys. The corrosion test were performed in water at 360 deg C, steam at 400 deg C and LiOH at 360 deg C for 45 days. The corrosion behaviors of Zr-xNb was similar to that of Zr-xCu alloys. However, the corrosion behavior of Zr-xSn was different from Zr-xNb and Zr-xCu. The weight gain of Zr-xNb and Zr-xCu was increased with addition of alloying elements. When Sn is added to Zr matrix in range below the solubility limit, the corrosion resistance decrease with increasing Sn-content, while in the range over solubility limit, Sn has an adverse effect on the corrosion resistance. Especially, Zr-xSn alloys showed higher corrosion resistance than Zr-xNb and Zr-xCu alloys in LiOH solution

Magnetic and electronic properties of the Cu-substituted Weyl semimetal candidate ZrCo2Sn.

Science.gov (United States)

Kushwaha, S K; Wang, Zhijun; Kong, Tai; Cava, Robert

2018-01-04

We report that the partial substitution of Cu for Co has a significant impact on the magnetic properties of the Heusler-phase Weyl fermion candidate ZrCo₂Sn. Polycrystalline samples of ZrCo_2-xCu_xSn (x = 0.0 to 1.0) exhibited a linearly decreasing ferromagnetic transition temperature and similarly decreasing saturated magnetic moment on increasing Cu substitution x. Materials with Cu contents near x = 1 and several other quaternary materials synthesized at the same x (ZrCoT'Sn (T' = Rh, Pd, Ni)) display what appears to be non-ferromagnetic magnetization behavior with spin glass characteristics. Electronic structure calculations suggest that the half-metallic nature of unsubstituted ZrCo₂Sn is disrupted significantly by the Cu substitutions, leading to the breakdown of the magnetization vs. electron count guidelines usually followed by Heusler phases, and a more typical metallic non-spin-polarized electronic structure at high x. © 2018 IOP Publishing Ltd.

Synthesis of Defect Perovskites (He_2–x⟂_x)(CaZr)F₆ by Inserting Helium into the Negative Thermal Expansion Material CaZrF₆

Energy Technology Data Exchange (ETDEWEB)

Hester, Brett R. [Georgia Inst. of Technology, Atlanta, GA (United States); dos Santos, António M. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Molaison, Jamie J. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Hancock, Justin C. [Georgia Inst. of Technology, Atlanta, GA (United States); Wilkinson, Angus P. [Georgia Inst. of Technology, Atlanta, GA (United States)

2017-09-11

Defect perovskites (He_2–x⟂_x)(CaZr)F₆ can be prepared by inserting helium into CaZrF₆ at high pressure. They can be recovered to ambient pressure at low temperature. There are no prior examples of perovskites with noble gases on the A-sites. The insertion of helium gas into CaZrF₆ both elastically stiffens the material and reduces the magnitude of its negative thermal expansion. It also suppresses the onset of structural disorder, which is seen on compression in other media. Measurements of the gas released on warming to room temperature and Rietveld analyses of neutron diffraction data at low temperature indicate that exposure to helium gas at 500 MPa leads to a stoichiometry close to (He₁⟂₁)(CaZr)F₆. Helium has a much higher solubility in CaZrF₆ than silica glass or crystobalite. An analogue with composition (H₂)₂(CaZr)F₆ would have a volumetric hydrogen storage capacity greater than current US DOE targets. We anticipate that other hybrid perovskites with small neutral molecules on the A-site can also be prepared and that they will display a rich structural chemistry.

Zirconium hydrides and Fe redistribution in Zr-2.5%Nb alloy under ion irradiation

Energy Technology Data Exchange (ETDEWEB)

Idrees, Y.; Yao, Z. [Department of Mechanical and Materials Engineering, Queen' s University, Kingston, ON, Canada, K7L 3N6 (Canada); Cui, J.; Shek, G.K. [Kinetrics, Mississauga, ON (Canada); Daymond, M.R., E-mail: daymond@queensu.ca [Department of Mechanical and Materials Engineering, Queen' s University, Kingston, ON, Canada, K7L 3N6 (Canada)

2016-11-15

Zr-2.5%Nb alloy is used to fabricate the pressure tubes of the CANDU reactor. The pressure tube is the primary pressure boundary for coolant in the CANDU design and is susceptible to delayed hydride cracking, reduction in fracture toughness upon hydride precipitation and potentially hydride blister formation. The morphology and nature of hydrides in Zr-2.5%Nb with 100 wppm hydrogen has been investigated using transmission electron microscopy. The effect of hydrides on heavy ion irradiation induced decomposition of the β phase has been reported. STEM-EDX mapping was employed to investigate the distribution of alloying elements. The results show that hydrides are present in the form of stacks of different sizes, with length scales from nano- to micro-meters. Heavy ion irradiation experiments at 250 °C on as-received and hydrided Zr-2.5%Nb alloy, show interesting effects of hydrogen on the irradiation induced redistribution of Fe. It was found that Fe is widely redistributed from the β phase into the α phase in the as-received material, however, the loss of Fe from the β phase and subsequent precipitation is retarded in the hydrided material. This preliminary work will further the current understanding of microstructural evolution of Zr based alloys in the presence of hydrogen. - Graphical abstract: STEM HAADF micrographs at low magnification showing the hydride structure in Zr-2.5Nb alloy.

Reduced cobalt phases of ZrO2 and Ru/ZrO2 promoted cobalt catalysts and product distributions from Fischer–Tropsch synthesis

International Nuclear Information System (INIS)

Kangvansura, Praewpilin; Schulz, Hans; Suramitr, Anwaraporn; Poo-arporn, Yingyot; Viravathana, Pinsuda; Worayingyong, Attera

2014-01-01

Highlights: • Ru/ZrO 2 , ZrO 2 promoted Co/SiO 2 for FTS were reduced by time resolved XANES. • Reduced catalysts resulted from XANES reduction showed the mixed phases of Co, CoO. • The highest percentages of CoO resulted from the high ZrO 2 promoted Co/SiO 2 . • Product distributions of 1-alkenes, iso-alkanes indicated sites for FTS and the 2° reaction. • Alkene readsorption were high corresponding to the high CoO forming branched alkanes. - Abstract: Co/SiO 2 catalysts were promoted with 4% and 8% ZrO 2 . Small amounts (0.07%) of Ru were impregnated onto 4%ZrO 2 /Co/SiO 2 . Catalysts resulting from time-resolved XANES reduction showed mixed phases of Co and CoO, with the highest percentages of Co resulting from Ru/4%ZrO 2 /Co/SiO 2 and the highest percentages of CoO resulting from 8%ZrO 2 /Co/SiO 2 . Product distributions of n-alkanes, iso-alkanes and alkenes during Fischer–Tropsch Synthesis (FTS) were used to investigate the catalyst performance of 4%ZrO 2 /Co/SiO 2 8%ZrO 2 /Co/SiO 2 and Ru/4%ZrO 2 /Co/SiO 2 . FTS steady state was studied by growth probabilities of n-alkane products. No 1-alkene was produced from Ru/4%ZrO 2 /Co/SiO 2 , indicating high availability of Fischer–Tropsch sites for long chain hydrocarbon growth, despite high methanation. Branched alkanes produced from the secondary reaction were related to the high CoO percentages on 8%ZrO 2 /Co/SiO 2 . Alkene readsorption sites were high, corresponding to the high CoO percentages, causing a high probability of forming branched alkane products

Study on surface defect structures of ZrO2 and some doped ZrO2 by means of work function measurement

International Nuclear Information System (INIS)

Yamawaki, M.; Suzuki, A.; Ono, F.; Yamaguchi, K.

1997-01-01

The work function change of the ZrO 2 +2%Y 2 O 3 sintered pellet, caused by a change of the composition of the sweep gas, was measured using a high temperature Kelvin probe. The Pt reference electrode was calibrated by using ZrO 2 +2%Y 2 O 3 as a standard material. Work function changes of undoped ZrO 2 and Nb-doped ZrO 2 (2%Nb 2 O 5 ) were measured as a function of equilibrium oxygen partial pressure, P O 2 . The thus obtained exponents of P O 2 , 1/n, were 1/6.2 and 1/33.6 for ZrO 2 and ZrO 2 +2%Nb 2 O 5 , respectively. These exponent values were discussed in terms of defect chemistry of the surface layer. (orig.)

The influence of Zr substitution for Nb on the corrosion behaviors of the Ni-Nb-Zr bulk metallic glasses

Science.gov (United States)

Li, DengKe; Zhu, ZhengWang; Zhang, HaiFeng; Wang, AiMin; Hu, ZhuangQi

2012-12-01

The influence of Zr content on corrosion behaviors of the Ni61.5Nb38.5- x Zr x ( x=1, 3, 5, 7, 9 at.%) bulk metallic glasses (BMGs) in 1 M HCl aqueous solution was investigated by potentiodynamic polarization measurements and X-ray photo-electron spectroscopy (XPS). It was found that these BMG alloys possess superior corrosion resistance, that is, with large passive region of about 1.5 V and low passive current density (as low as 0.05 Am-2 for Ni61.5Nb31.5Zr7). XPS analysis indicates that the high corrosion resistance is attributed to the formation of Nb- and Zr-enriched surface films formed in the aggressive acid solution. The Zr substitution for Nb effectively reduces the Ni content, particularly the metallic state Ni content in the surface films, which depresses the electrical conduction of the surface films and reduces the passive current density, thus leading to the enhancement of the corrosion resistance of these Ni-Nb-Zr BMGs. These alloys may potentially be useful for engineering applications.

Identification of new phases in the Zr-Nb-Fe system

International Nuclear Information System (INIS)

Granovsky, Marta S.; Arias, Delia E.; Lena, Esteban M.

1999-01-01

Intermediate phases in the Zr - rich region of the Zr - Nb - Fe system have been investigated by X-ray diffraction, optical and electron microscopy and electron microanalysis. The chemical composition ranges of the alloys here studied were (52 - 97) at. % Zr, (14 - 0.9) at. % Nb and (38 - 0.6) at. % Fe. The phases found in this region were the solid solutions α(Zr) and β(Zr), the intermetallic Zr 3 Fe with less than 0.2 at. % Nb in solution, and two new ternary phases: (Zr + Nb) 2 Fe, identified as a cubic Ti 2 Ni - type structure and another compound with composition close to Zr - 12 at. % Nb - 50 at. % Fe. (author)

Effect of Nb aggregates on Zr2Fe

International Nuclear Information System (INIS)

Ramos, Cinthia P.

2001-01-01

The binary Zr-Fe phase diagram revision, performed by Arias et al., accepted the intermetallic Zr 2 Fe crystalline structure as tetragonal and determined that the presence of a third element like oxygen, nitrogen or carbon, stabilizes a cubic phase. Nevitt et al. studying Ti, Zr and Hf alloys with transition metals as second or third element and ternary systems with oxygen as third element, systematized the occurrence of phases with a cubic Ti 2 Ni type crystalline structure. From previous studies in the Zr-Nb-Fe system, it is an agreed fact that Nb presence in the Zr 2 Fe intermetallic stabilizes a cubic Ti 2 Ni type phase. The purpose of the present work is to determine the stability range of the Zr 2 Fe intermetallic with Nb contents, the existence range of the ternary cubic Ti 2 Ni type phase (designated Λ) and the corresponding two-phase region. We analyze as cast and heat treated (800 C degrees) Zr-Nb-Fe alloys with 35 atomic % Fe and Nb contents between 0.5 and 15 atomic %. The determination and characterization of the phases is made by optical and scanning electron microscopy, X-ray diffraction microprobe analysis and Moessbauer Spectroscopy. Joining these techniques together it is found, among many other things, that the Zr 2 Fe phase would accept up to around 0.5 atomic % Nb in solution and that the two-phase region Zr 2 Fe+Λ would be stable in the (0.5 - 3.5) Nb atomic % range. It is proposed as well a 800 C degrees section of the ternary (Zr-Nb-Fe) in the studied region. (author) [es

The Thermodynamic Characterization of ZrCo–H, HfCo−H, HfNi−H and Zr{sub 1–x}HfxNi(Co) Alloy–H Systems

Energy Technology Data Exchange (ETDEWEB)

Flanagan, Ted B., E-mail: ted.flanagan@uvm.edu; Noh, Hak; Luo, Suifang

2016-08-25

ZrCo and HfCo intermetallic compounds have the same cubic (CsCl-type) structure and their ternary (Zr{sub 1−x}Hf{sub x})Co alloys are also cubic. ZrNi and HfNi intermetallic compounds have the orthorhombic structure (CrB-type) and the ternary (Zr{sub 1−x}Hf{sub x})Ni alloys also have this structure. Thermodynamic data for hydride formation and decomposition in ZrCo, HfCo and HfNi intermetallic compounds have been determined from reaction calorimetry and from pressure-composition isotherms. Thermodynamic data have been determined for the three ternary alloys: (Zr{sub 0.75}Hf{sub 0.25})Co, (Zr{sub 0.50}Hf{sub 0.50})Co, and (Zr{sub 0.25}Hf{sub 0.75})Co and the four ternary alloys: (Zr{sub 0.875}Hf{sub 0.125})Ni, (Zr{sub 0.75}Hf{sub 0.25})Ni, (Zr{sub 0.50}Hf{sub 0.50})Ni, and (Zr{sub 0.25}Hf{sub 0.75})Ni. This offers the opportunity to learn how the thermodynamic properties of the ternary alloy-H systems change with the stoichiometry of alloys with the same structure. - Highlights: • Calorimetric enthalpies determined for H absorption by ZrCo, HfCo, HfNi are determined. • Ternary alloys, e.g., Zr{sub 1−x}Hf{sub x}Ni, prepared and characterized by x-ray diffraction. • Isotherms for the ternary alloys give thermodynamic parameters for H solution.

The structure of ZrO2 phases and deviltrification processes in a Ca-Zr-Si-O-based glass ceramic: a combined a-XRD and XAS study

International Nuclear Information System (INIS)

Meneghini, C.; Mobilio, S.

2004-01-01

The structure of Zr atomic environment in a CaO-ZrO 2 -Si 2 glass ceramic as a function of thermal treatments has been studied, combining X-ray absorption spectroscopy (XAS), X-ray diffraction (XRD) and anomalous XRD (a-XRD) techniques. The analysis of XRD patterns demonstrates that the devitrification process proceeds through the partial segregation of Zr-depleted phases (wollastonite-like) and Zr-rich phases (Zr oxides). The XAS and a-XRD measurements at the Zr K-edge have been exploited in order to obtain a closer insight into the atomic structure around the Zr atoms. In the as-quenched glass the Zr atom is sixfold coordinated to O atoms in an amorphous environment rich in Ca and Si. Thermal treatment firstly (T=1273-1323 K) causes partial segragation of Zr in the form of an oxide with a tetragonal zirconia (t-ZrO 2 ) crystalline structure. Raising the temperature (T=1373 K) causes the formation of ZrO 2 crystallites in the monoclinic crystallographic phase (baddeleyite, m-ZrO 2 ). Analysis of the XAS data shows that a considerable amount of Zr remains in an amorphous calcium silicate phase. (orig.)

Synthesis of (U,Zr)C solid solutions under exothermic conditions

International Nuclear Information System (INIS)

Wang, L.L.; Moore, H.G.; Gladson, J.W.

1993-01-01

The reactions of forming (U,Zr)C solid solutions from their elemental components or similarly less stable reactants such as UC 2 are strongly exothermic due to the high stability of these solid solutions. A simple approach of utilizing this heat of formation energy to assist the solid solution reaction process is to intimately mix the less stable reactant powders and then pressed them into a compact. The compact is then heated to the ignition temperature of the reaction. The feasibility of this reaction method to synthesize (U,Zr)C solid solutions has been demonstrated in this study. The preliminary results also show that both the initial composition and the heating rate have a significant effect on the nature of the reaction process. As expected the degree of powder mixing was also found to affect the completeness of the reaction

Storage of Hydrogen in the Ti-Zr System; Almacenamiento de hidrogeno en el sistema Ti-Zr

Energy Technology Data Exchange (ETDEWEB)

Salmones, J.; Zeifert, B. [Instituto Politecnico Nacional, ESIQIE, Mexico D.F. (Mexico)]. E-mail: jose_salmones@yahoo.com.mx; Ortega-Aviles, M. [Instituto Politecnico Nacional, Mexico D.F. (Mexico); Contreras-Larios, J. L. [Universidad Autonoma Metropolitana, Mexico D.F. (Mexico); Garibay-Febles, V. [Instituto Mexicano del Petroleo, Mexico D.F. (Mexico)

2009-09-15

This research was conducted to contribute to the study of hydrogen storage systems, synthesizing and characterizing two Ti-Zr based systems: I) titanium dioxide (TiO{sub 2}) + zirconium acetylacetonate (C{sub 20}H{sub 28}O{sub 8}Zr) and II) titanium dioxide (TiO{sub 2}) + zirconium tetrachloride (ZrCl{sub 4}). Both systems were prepared using mechanical grinding under the same conditions, with a composition of 50% Ti and Zr weights and grinding times of 2, 5, 7, 15, 30 and 70 hours. The samples were evaluated with hydrogen absorption tests and characterized with BET, DRX and MET. The results of hydrogen storage for one absorption-desorption cycle, at ambient temperature and pressure, showed that the samples from system I absorbed the greatest amount of hydrogen, but did not desorb them, while samples from system II liberated the hydrogen absorbed in them. The increase in temperature from mechanical grinding is directly associated with changes in the adsorption capacity of hydrogen, the size of the particle and formation of new components, as shows by BET measurements, XRD diffractograms and MET micrographs. The formation of Ti and Zr oxide nanoparticles in the samples in series II were associated with the desorption capacity of hydrogen. [Spanish] Esta investigacion se realizo para contribuir al estudio de sistemas para almacenamiento de hidrogeno, sintetizando y caracterizando dos sistemas base Ti-Zr: I) dioxido de titanio (TiO{sub 2}) + acetilacetonato de zirconio (C{sub 20}H{sub 28}O{sub 8}Zr) y II) dioxido de titanio (TiO{sub 2}) + tetracloruro de zirconio (ZrCl{sub 4}). Ambos sistemas se prepararon por molienda mecanica a las mismas condiciones, con composicion de 50% en peso de Ti y Zr y tiempos de molienda de 2, 5, 7, 15, 30 y 70 hrs. Las muestras fueron evaluadas mediante pruebas de absorcion de hidrogeno y caracterizadas por BET, DRX y MET. Los resultados de almacenamiento de hidrogeno para un ciclo de absorcion-desorcion, a presion y temperatura ambientes

Experimental investigation and thermodynamic modeling of the Ga–Zr system

Energy Technology Data Exchange (ETDEWEB)

Luo, Wei [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China); Liu, Shuhong, E-mail: shhliu@csu.edu.cn [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Tang, Ying [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Yin, Ming [Thermal Processing Technology Center, Illinois Institute of Technology (IIT), 10 West 32nd Street, Chicago, IL 60616 (United States); Sundman, Bosse [INSTN, CEA Saclay, 91191 Gif-sur-Yvette Cedex (France); Du, Yong [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Nash, Philip [Thermal Processing Technology Center, Illinois Institute of Technology (IIT), 10 West 32nd Street, Chicago, IL 60616 (United States); Tao, Huijin [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China)

2014-02-25

Highlights: • Phase equilibria of the Ga–Zr system were investigated by experiment. • Δ{sub f}Hs for intermetallic compounds were computed via first–principles calculations. • The enthalpy of formation at 298 K for αGaZr was measured by calorimetry. • A set of self-consistent thermodynamic parameters was obtained. -- Abstract: Phase equilibria of the Ga–Zr system were investigated by experiment and thermodynamic modeling. In the experimental part, eleven alloys were prepared by melting the pure elements and annealed. Both the as-cast and annealed samples were analyzed by X-ray diffraction, optical microscopy, and scanning electron microscope. The annealed alloys were investigated by differential thermal analysis and electron probe microanalysis. In order to assist the thermodynamic modeling, the enthalpies of formation at 0 K for the GaZr{sub 2}, Ga{sub 3}Zr{sub 5}, Ga{sub 2}Zr{sub 3}, Ga{sub 4}Zr{sub 5}, αGaZr, Ga{sub 3}Zr{sub 2}, Ga{sub 5}Zr{sub 3}, Ga{sub 2}Zr and Ga{sub 3}Zr phases were computed via first-principles calculations. The enthalpy of formation at 298 K for the αGaZr was measured by high temperature reaction calorimetry. Based on the experimental phase diagram data from the present work and the literature as well as the present first-principles calculations, the Ga–Zr system was critically assessed by means of CALPHAD approach. The calculated phase diagram and thermodynamic properties agree well with the available experimental data.

Expanding the range of 'druggable' targets with natural product-based libraries: an academic perspective.

Science.gov (United States)

Bauer, Renato A; Wurst, Jacqueline M; Tan, Derek S

2010-06-01

Existing drugs address a relatively narrow range of biological targets. As a result, libraries of drug-like molecules have proven ineffective against a variety of challenging targets, such as protein-protein interactions, nucleic acid complexes, and antibacterial modalities. In contrast, natural products are known to be effective at modulating such targets, and new libraries are being developed based on underrepresented scaffolds and regions of chemical space associated with natural products. This has led to several recent successes in identifying new chemical probes that address these challenging targets. Copyright 2010 Elsevier Ltd. All rights reserved.

Hybrid HF-DFT comparative study of SrZrO{sub 3} and SrTiO{sub 3}(001) surface properties

Energy Technology Data Exchange (ETDEWEB)

Evarestov, R.A.; Bandura, A.V.; Alexandrov, V.E. [Department of Quantum Chemistry, St. Petersburg State University, 26 Universitetskii Prospekt, Stary Petergof, 198504 St. Petersburg (Russian Federation)

2006-10-15

Hybrid HF-DFT LCAO simulations of SrZrO{sub 3} and SrTiO{sub 3}(001) surface properties are performed in a single-slab model framework. The SrZrO{sub 3}(001) surface was studied by an ab initio method for the first time. Three slab models with different surface terminations including up to 8 atomic planes were used for calculation of the various surface characteristics (surface energies, atomic charges, density of electronic states). The dependence of the results on the chosen model and on the kind of d-element is analyzed. The dissimilarity in the surface oxygen atom contributions to the total density of states of two crystals is attributed to the more ionic nature of Zr-O bonds compared to Ti-O bonds. It is found that in the case of SrZrO{sub 3} the electronic density is biased towards the SrO-terminated surface and this surface should be more basic in nature than the SrO surface of SrTiO{sub 3} crystal. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

PEMISAHAN Zr – Hf SECARA SINAMBUNG MENGGUNAKAN MIXER SETTLER

Directory of Open Access Journals (Sweden)

Dwi Biyantoro

2017-01-01

Full Text Available ABSTRAK PEMISAHAN Zr – Hf SECARA SINAMBUNG MENGGUNAKANMIXER SETTLER. Telah dilakukan pemisahanZr – Hf secara sinambung menggunakan pengaduk pengenap (mixer settler 16 stage. Larutan umpan adalah zirkon nitrat dengan kadar Zr = 30786 ppm dan Hf = 499 ppm. Ekstraktan dipakai adalah solven 60 % TBP dalam kerosen dan larutan scrubbingyang dipakai adalah asam nitrat 1 M. Umpan masuk pada stageke 5 dikontakkan secara berlawanan arah dengan solven masuk pada stage ke 16 dan larutan scrubbing masuk pada stage ke 1. Tujuan penelitian ini adalah memisahkan unsur Zr dan Hf dari hasil olah pasir zirkon menggunakan solven TBP dengan alat mixer settler16 stage. Analisis umpan dan hasil proses pemisahan untuk zirkonium (Zr dilakukan dengan menggunakan alat pendar sinar-X, sedangkananalisis unsur hafnium (Hf menggunakan Analisis Pengaktifan Neutron (APN. Parameter penelitian dilakukan dengan variasi keasaman asam nitrat dalam umpan dan variasi waktu pada berbagai laju pengadukan. Hasil penelitian pemisahan unsur Zr dengan Hf diperolehkondisi optimum pada keasaman umpan 4 N HNO3, keseimbangan dicapai setelah 3jam dan laju pengadukan 3300 rpm. Hasil ekstrak  unsur zirkon (Zr diperoleh kadar sebesar 28577 ppm dengan efisiensi 92,76 % serta kadar pengotor hafnium (Hf sebesar 95 ppm. Kata Kunci: pemisahan Zr, Hf, ekstraksi, mixer settler, alat pendar sinar-X, APN. ABSTRACT SEPARATION of Zr - Hf CONTINUOUSLY USE THE MIXER SETTLER. Separation of Zr - Hf continuously using mixer settler 16 stage has been done. The feed solution is zircon nitrate concentration of Zr = 30786 ppm  and Hf = 499 ppm. As the solvent used extractant 60 % TBP in 40 % kerosene. Nitric acid solution used srubbing 1 M. The feed entered into stage to 5 is contacted with solvents direction on the stage to 16 and the scrubbing solution enter the stage to 1. The purpose of this study is to separate Zr and Hf of the results from the process of zircon sand using solvent TBP using 16 stage

Modeling and preliminary analysis on the temperature profile of the (TRU-Zr)-Zr dispersion fuel rod for HYPER

International Nuclear Information System (INIS)

Lee, B. W.; Hwang, W.; Lee, B. S.; Park, W. S.

2000-01-01

Either TRU-Zr metal alloy or (TRU-Zr)-Zr dispersion fuel is considered as a blanket fuel for HYPER(Hybrid Power Extraction Reactor). In order to develop the code for dispersion fuel rod performance analysis under steady state condition, the fuel temperature distribution model which is the one of the most important factors in a fuel performance code has been developed in this paper,. This developed model computes the one dimensional radial temperature distribution of a cylindrical fuel rod. The temperature profile results by this model are compared with the temperature distributions of U 3 Si-A1 dispersion fuel and TRU-Zr metal alloy fuel. This model will be installed in performance analysis code for dispersion fuel

Spontaneous nano-clustering of ZrO2 in atomic layer deposited LayZr1-yOx thin films: Part 1 - Material characterization

NARCIS (Netherlands)

Klootwijk, J.H.; Jinesh, K.B.; Wolters, R.A.M.; Roozeboom, F.; Besling, W.

2008-01-01

During atomic layer deposition (ALD) of uniform LayZr1-yOx thin films, spontaneous segregation of ZrO2 nanocrystals takes place that are embedded in an amorphous La2O3 matrix. This occurs if the Zr content in the LayZr1-yOx film is above 30% i.e. if the pulse ratio between the lanthanum precursor

Interaction of Au with thin ZrO2 films: influence of ZrO2 morphology on the adsorption and thermal stability of Au nanoparticles.

Science.gov (United States)

Pan, Yonghe; Gao, Yan; Kong, Dandan; Wang, Guodong; Hou, Jianbo; Hu, Shanwei; Pan, Haibin; Zhu, Junfa

2012-04-10

The model catalysts of ZrO(2)-supported Au nanoparticles have been prepared by deposition of Au atoms onto the surfaces of thin ZrO(2) films with different morphologies. The adsorption and thermal stability of Au nanoparticles on thin ZrO(2) films have been investigated using synchrotron radiation photoemission spectroscopy (SRPES) and X-ray photoelectron spectroscopy (XPS). The thin ZrO(2) films were prepared by two different methods, giving rise to different morphologies. The first method utilized wet chemical impregnation to synthesize the thin ZrO(2) film through the procedure of first spin-coating a zirconium ethoxide (Zr(OC(2)H(5))(4)) precursor onto a SiO(2)/Si(100) substrate at room temperature followed by calcination at 773 K for 12 h. Scanning electron microscopy (SEM) investigations indicate that highly porous "sponge-like nanostructures" were obtained in this case. The second method was epitaxial growth of a ZrO(2)(111) film through vacuum evaporation of Zr metal onto Pt(111) in 1 × 10(-6) Torr of oxygen at 550 K followed by annealing at 1000 K. The structural analysis with low energy electron diffraction (LEED) of this film exhibits good long-range ordering. It has been found that Au forms smaller particles on the porous ZrO(2) film as compared to those on the ordered ZrO(2)(111) film at a given coverage. Thermal annealing experiments demonstrate that Au particles are more thermally stable on the porous ZrO(2) surface than on the ZrO(2)(111) surface, although on both surfaces, Au particles experience significant sintering at elevated temperatures. In addition, by annealing the surfaces to 1100 K, Au particles desorb completely from ZrO(2)(111) but not from porous ZrO(2). The enhanced thermal stability for Au on porous ZrO(2) can be attributed to the stronger interaction of the adsorbed Au with the defects and the hindered migration or coalescence resulting from the porous structures. © 2012 American Chemical Society

Determination of 93Zr in nuclear power plant wastes

DEFF Research Database (Denmark)

Osváth, Szabolcs; Vajda, Nora; Molnar, Zsuzsa

2017-01-01

A radioanalytical method (based on separation using UTEVA columns and ICP-MS measurement) has been used for determination of 93Zr in 37 nuclear power plant samples. As 93Nb might affect the detection of 93Zr, Monte Carlo activation model was used to calculate the expected 93Zr/natZr mass ratio...

NPACT: Naturally Occurring Plant-based Anti-cancer Compound-Activity-Target database.

Science.gov (United States)

Mangal, Manu; Sagar, Parul; Singh, Harinder; Raghava, Gajendra P S; Agarwal, Subhash M

2013-01-01

Plant-derived molecules have been highly valued by biomedical researchers and pharmaceutical companies for developing drugs, as they are thought to be optimized during evolution. Therefore, we have collected and compiled a central resource Naturally Occurring Plant-based Anti-cancer Compound-Activity-Target database (NPACT, http://crdd.osdd.net/raghava/npact/) that gathers the information related to experimentally validated plant-derived natural compounds exhibiting anti-cancerous activity (in vitro and in vivo), to complement the other databases. It currently contains 1574 compound entries, and each record provides information on their structure, manually curated published data on in vitro and in vivo experiments along with reference for users referral, inhibitory values (IC(50)/ED(50)/EC(50)/GI(50)), properties (physical, elemental and topological), cancer types, cell lines, protein targets, commercial suppliers and drug likeness of compounds. NPACT can easily be browsed or queried using various options, and an online similarity tool has also been made available. Further, to facilitate retrieval of existing data, each record is hyperlinked to similar databases like SuperNatural, Herbal Ingredients' Targets, Comparative Toxicogenomics Database, PubChem and NCI-60 GI(50) data.

NPACT: Naturally Occurring Plant-based Anti-cancer Compound-Activity-Target database

Science.gov (United States)

Mangal, Manu; Sagar, Parul; Singh, Harinder; Raghava, Gajendra P. S.; Agarwal, Subhash M.

2013-01-01

Plant-derived molecules have been highly valued by biomedical researchers and pharmaceutical companies for developing drugs, as they are thought to be optimized during evolution. Therefore, we have collected and compiled a central resource Naturally Occurring Plant-based Anti-cancer Compound-Activity-Target database (NPACT, http://crdd.osdd.net/raghava/npact/) that gathers the information related to experimentally validated plant-derived natural compounds exhibiting anti-cancerous activity (in vitro and in vivo), to complement the other databases. It currently contains 1574 compound entries, and each record provides information on their structure, manually curated published data on in vitro and in vivo experiments along with reference for users referral, inhibitory values (IC50/ED50/EC50/GI50), properties (physical, elemental and topological), cancer types, cell lines, protein targets, commercial suppliers and drug likeness of compounds. NPACT can easily be browsed or queried using various options, and an online similarity tool has also been made available. Further, to facilitate retrieval of existing data, each record is hyperlinked to similar databases like SuperNatural, Herbal Ingredients’ Targets, Comparative Toxicogenomics Database, PubChem and NCI-60 GI50 data. PMID:23203877

Gamma decay of pygmy states in 90,94Zr from inelastic scattering of light ions

Science.gov (United States)

Crespi, F. C. L.; Bracco, A.; Tamii, A.; Blasi, N.; Camera, F.; Wieland, O.; Aoi, N.; Balabanski, D.; Bassauer, S.; Brown, A. S.; Carpenter, M. P.; Carroll, J. J.; Ciemala, M.; Czeszumska, A.; Davies, P. J.; Donaldson, L.; Fang, Y.; Fujita, H.; Gey, G.; Hoang, T. H.; Ichige, N.; Ideguchi, E.; Inoue, A.; Isaak, J.; Iwamoto, C.; Jenkins, D. G.; Jin, O. H.; Klaus, T.; Kobayashi, N.; Koike, T.; Krzysiek, M.; Raju, M. Kumar; Liu, M.; Maj, A.; Montanari, D.; Morris, L.; Noji, S.; Pickstone, S. G.; Savran, D.; Spieker, M.; Steinhilber, G.; Sullivan, C.; Wasilewska, B.; Werner, V.; Yamamoto, T.; Yamamoto, Y.; Zhou, X.; Zhu, S.

2018-05-01

We performed experiments to study the low-energy part of the E1 response (Pygmy Dipole Resonance) in 90,94Zr nuclei, by measuring the (p,p’γ) and (α,α’γ) inelastic scattering reactions at energies Ebeam,p = 80 MeV and Ebeam,α = 130 MeV respectively. The inelastically scattered particles were measured by employing the high-resolution spectrometer Grand Raiden. The gamma-rays emitted following the de-excitation of the Zr target nuclei were detected using both the clover type HPGe detectors of the CAGRA array and the large volume LaBr3:Ce scintillation detectors from the HECTOR+ array. Some preliminary results are presented here.

Influence of ZrO{sub 2} nanoparticles and thermal treatment on the properties of PMMA/ZrO{sub 2} hybrid coatings

Energy Technology Data Exchange (ETDEWEB)

Reyes-Acosta, M.A. [Instituto Politécnico Nacional, CICATA-Altamira, CIAMS (Mexico); Instituto Politécnico Nacional, CICATA-Altamira, Km 14.5 Carretera Tampico-Puerto Industrial Altamira, C.P. 89600 Altamira, Tamps. (Mexico); Torres-Huerta, A.M., E-mail: atorresh@ipn.mx [Instituto Politécnico Nacional, CICATA-Altamira, Km 14.5 Carretera Tampico-Puerto Industrial Altamira, C.P. 89600 Altamira, Tamps. (Mexico); Domínguez-Crespo, M.A. [Instituto Politécnico Nacional, CICATA-Altamira, Km 14.5 Carretera Tampico-Puerto Industrial Altamira, C.P. 89600 Altamira, Tamps. (Mexico); Flores-Vela, A.I. [Instituto Politécnico Nacional, CMP+L, Av. Acueducto s/n, Barrio La Laguna, Col. Ticomán, C.P. 07340 México D.F. (Mexico); Dorantes-Rosales, H.J. [Instituto Politécnico Nacional, SEPI-ESIQIE, Departamento de Metalurgia, C.P. 07738 México D.F. (Mexico); Ramírez-Meneses, E. [Departamento de Ingeniería y Ciencias Químicas, Universidad Iberoamericana, Prolongación Paseo de la Reforma 880, Lomas de Santa Fe, Distrito Federal C.P. 01219 (Mexico)

2015-09-15

Highlights: • PMMA/ZrO{sub 2} nanocomposites were prepared by melt blending in a single screw extruder. • The nanoparticles of m-, t-ZrO{sub 2} were successfully synthesized using sol–gel technique. • The prepared PMMA/ZrO{sub 2} nanocomposites have better UV protection than pure PMMA. • The thermal stability of the PMMA increases with low amount of ZrO{sub 2} nanoparticles. • PMMA/ZrO{sub 2} nanocomposites show superior values of elastic modulus and hardness. - Abstract: In this work, ZrO{sub 2} nanoparticles were synthesized by the sol–gel method, treated thermally at different temperatures (400, 600 and 800 °C), and added to a polymer matrix in two different weight percentages (0.5 and 1) by single screw extrusion in order to determine the influence of these parameters on the thermal stability and UV radiation resistance of PMMA/ZrO{sub 2} composites. Fourier transform infrared spectroscopy (FT-IR), nuclear magnetic resonance (NMR), X-ray diffraction (XRD), transmission electron microscopy (TEM), confocal laser scanning microscopy (CLSM), ultraviolet–visible spectroscopy (UV–Vis), thermogravimetric analysis (TGA) and nanoindentation techniques were used to evaluate the structural, morphological, optical, thermal and mechanical properties of as-prepared composites. The average crystallite sizes for ZrO{sub 2} sintered at 600 and 800 °C were about 17 and 26 nm, respectively. It was found that the incorporation of a low percentage of ZrO{sub 2} nanoparticles increased the thermal properties of PMMA as well as its hardness and elastic modulus. The degradation temperature at 10 wt.% loss of the PMMA/ZrO{sub 2} (0.5 wt.%, 400 °C) nanocomposite was approximately 48 °C higher than that of pure PMMA. The absorption in the UV region was increased according to the ZrO{sub 2} heat treatment temperature and amount added to the polymer matrix.

Performance of U-Pu-Zr fuel cast into zirconium molds

International Nuclear Information System (INIS)

Crawford, D.C.; Lahm, C.E.; Tsai, H.

1992-10-01

U-3Zr and U-20.5Pu-3Zr were injection cast into Zr tubes, or sheaths, rather than into quartz molds and clad in 316SS. These elements and standard-cast U-l0Zr and U-IgPu-l0Zr elements were irradiated in EBR-II to 2 at.% and removed for interim examination. Measurements of axial growth at indicate that the Zr-sheathed elements exhibited significantly less axial elongation than the standard-cast elements (1.3 to 1.8% versus 4.9 to 8.1%). Fuel material extruded through the ends of the Zr sheaths. allowing the low-Zr fuel to contact the cladding in some cases. Transverse metallographic sections reveal cracks in the Zr sheath through which fuel extruded and contacted cladding. The sheath is not a sufficient barrier between fuel and cladding to reduce FCCI. and any adverse effects due to increased FCCI will be evident as the elements attain higher burnup

Effects of TiN coating on the corrosion of nanostructured Ti-30Ta-xZr alloys for dental implants

Science.gov (United States)

Kim, Won-Gi; Choe, Han-Cheol

2012-01-01

Electrochemical characteristics of a titanium nitride (TiN)-coated/nanotube-formed Ti-Ta-Zr alloy for biomaterials have been researched by using the magnetic sputter and electrochemical methods. Ti-30Ta-xZr (x = 3, 7 and 15 wt%) alloys were prepared by arc melting and heat treated for 24 h at 1000 °C in an argon atmosphere and then water quenching. The formation of oxide nanotubes was achieved by anodizing a Ti-30Ta-xZr alloy in H3PO4 electrolytes containing small amounts of fluoride ions at room temperature. Anodization was carried out using a scanning potentiostat, and all experiments were conducted at room temperature. The microstructure and morphology of nanotube arrays were characterized by optical microscopy (OM), field emission scanning electron microscopy (FE-SEM) and X-ray diffraction (XRD). The TiN coatings were obtained by the radio-frequency (RF) magnetron sputtering technique. The depositions were performed from pure Ti targets on Ti-30Ta-xZr alloys substrates. The corrosion properties of the specimens were examined using potentiodynamic test in a 0.9% NaCl solution by using potentiostat. The microstructures of Ti-30Ta-xZr alloys were changed from an equiaxed to a needle-like structure with increasing Zr content. The interspace between the nanotubes was approximately 20, 80 and 200 nm for Zr contents of 3, 7 and 15 wt%, respectively. The corrosion resistance of the TiN-coated on the anodized Ti-30Ta-xZr alloys was higher than that of the untreated Ti alloys, indicating a better protective effect.

Temperature effect on uranium retention onto Zr2O(PO4)2 surface

International Nuclear Information System (INIS)

Almazan Torres, M.G.

2007-03-01

Uranium sorption onto Zr 2 O(PO 4 ) 2 has been studied between 298 K and 363 K, in 0.1 M NaClO 4 medium. Potentiometric titrations were realized to determine temperature dependency of the acid-base properties (pH(pcn), acidity constants). Classical batch experiments were performed at different temperatures. The sorption experiments revealed that the uranium sorption onto Zr 2 O(PO 4 ) 2 is favoured with the temperature. Structural characterization of the surface complexes was performed by both Time-Resolved Laser-Induced Fluorescence (TRLIF) and EXAFS spectroscopy. The TRLIF measurements vs. temperature revealed two uranyl surface complexes. No influence of the temperature onto the nature surface complex was observed. The EXAFS analysis showed a splitting of the equatorial oxygen atoms in two shells, corresponding to uranyl bidentate, inner-sphere complexes. The obtained structural uranyl surface complex information was used to simulate (using a constant capacitance model) the sorption edges. The proposed complexes equilibrium model consists of the following surface complexes: (ZrOH) 2 UO 2 2+ and (PO) 2 UO 2 . Besides the stability constants for the surface complexes, the thermodynamic parameters ΔH 0 and ΔS 0 were determined using the van't Hoff equation. The enthalpy values associated to the U(VI) retention onto Zr 2 O(PO 4 ) 2 , determined by the temperature dependence of the stability constants, testify that the formation of the complex (PO) 2 UO 2 (55 kJ/mol) is endothermic, while no influence of the temperature was observed for the formation of the complex (ZrOH) 2 UO 2 2+ . The adsorption reaction of the last complex is then driven by entropy. In addition, calorimetric measurements of uranium sorption onto Zr 2 O(PO 4 ) 2 were carried out to directly quantify the enthalpy associated to the retention processes. (author)

Study of dielectric property on ZrO2 and Al doped ZrO2 nanoparticles

International Nuclear Information System (INIS)

Catherine Siriya Pushpa, K.; Mangayarkarasi, K.; Ravichandran, A.T.; Xavier, A. Robert; Nagabushana, B.M.

2014-01-01

A solution combustion process was used to synthesize ZrO 2 and Al doped ZrO 2 nanoparticles by using Zirconium nitrate and aluminium nitrate as the oxidizer and glycine as fuel. The prepared samples were characterized by several techniques such as X-ray Diffraction (XRD), Scanning Electron Microscopy (SEM), UV-visible spectroscopy (UV-vis). The dielectric values of the pelletized samples were examined at room temperature as the function of frequency. XRD shows the structure of the prepared and doped samples. The SEM shows the surface morphology of the pure and doped ZrO 2 nanoparticles. The dielectric property enhances with increase of Al concentration, which is useful in dielectric gates. (author)

Plan of development of ZrC-TRISO coated fuel particle and construction of ZrC coater

Energy Technology Data Exchange (ETDEWEB)

Ueta, Shohei; Ino, Hiroichi; Sawa, Kazuhiro [Japan Atomic Energy Research Inst., Oarai, Ibaraki (Japan). Oarai Research Establishment; Tobita, Tsutomu [Nuclear Engineering Company, Ltd., Tokai, Ibaraki (Japan); Takahashi, Masashi [Nuclear Fuel Industries, Ltd., Tokyo (Japan)

2002-11-01

In order to use coated fuel particle under higher temperature condition, more refractory coating material, which is more refractory than conventional silicon carbide (SiC), should be applied. Zirconium carbide (ZrC) is considered to be one of the promising materials, which is proposed as candidate for VHTR fuel material in GENERATION-IV, because of its intactness under high temperature of around 2000degC and its higher stability against kernel migration (amoeba effect) and fission product corrosion under normal operating condition. In order to develop ZrC coated particle for commercial use, research and development items were extracted based on review of the previous works. Research and development plan was determined. Based on the plan, a new ZrC coater of 100g batch size, which applies bromine process, was constructed. This report describes the review of precious works, extracted research and develop items and plan, and specifications of the ZrC coater. (author)

The structure and mechanical properties of as-cast Zr-Ti alloys

International Nuclear Information System (INIS)

Hsu, H.-C.; Wu, S.-C.; Sung, Y.-C.; Ho, W.-F.

2009-01-01

This study has investigated the structure and mechanical properties of pure Zr and a series of binary Zr-Ti alloys in order to determine their potential application as dental implant materials. The titanium contents of these alloys range from 10 to 40 wt.% and were prepared by arc melting in inert gas. This study evaluated the phase and structure of these Zr-Ti alloys using an X-ray diffraction (XRD) for phase analysis, and an optical microscope for microstructure analysis of the etched alloys. Three-point bending tests were performed to evaluate the mechanical properties of all specimens. The experimental results indicated that the pure Zr and Zr-10Ti comprised entirely of an acicular hexagonal structure of α' phase. When the Ti content increased to 20 wt.%, a significant amount of β phase was retained. However, when the Ti content increased to 40 wt.%, only the equi-axed, retained β phase was observed in the cast alloy. Moreover, the hardness values and bending strengths of the Zr-Ti alloys decreased with an increasing Ti content. Among pure Zr and Zr-Ti alloys, the α'-phase Zr-10Ti alloy has the greatest hardness and bending strength. The pure Zr and Zr-Ti alloys exhibit a similar elastic modulus ranging from 68 GPa (Zr-30Ti) to 78 GPa (Zr-40Ti). Based on the results of elastic moduli, pure Zr and Zr-Ti alloys are found to be suitable for implant materials due to lower modulus. Like bending strength, the elastically recoverable angle of Zr-Ti alloys decreased as the concentration of Ti increased. In the current search for a better implant material, the Zr-10Ti alloy exhibited the highest bending strength/modulus ratios as large as 25.3, which are higher than that of pure Zr (14.9) by 70%, and commercially pure Ti (8.7) by 191%. Thus, Zr-Ti alloy's low modulus, ductile property, excellent elastic recovery capability and impressive strength confirm that it is a promising candidate for dental implant materials.

Aqueous corrosion study on U-Zr alloy

International Nuclear Information System (INIS)

Pal, Titas; Venkatesan, V.; Kumar, Pradeep; Khan, K.B.; Kumar, Arun

2009-01-01

In low power or research reactor, U-Zr alloy is a potential candidate for dispersion fuel. Moreover, Zirconium has a low thermal-neutron cross section and uranium alloyed with Zr has excellent corrosion resistance and dimensional stability during thermal cycling. In the present study aqueous corrosion behavior of U-Zr alloy samples was studied in autoclave at 200 deg C temperature. Corrosion rate was determined from weight loss with time. (author)

Pb(Zr,TiO3 (PZT Thin Film Sensors for Fully-Integrated, Passive Telemetric Transponders

Directory of Open Access Journals (Sweden)

Richard X. FU

2011-04-01

Full Text Available The great potential of taking advantages of PZT in a single chip to achieve inexpensive, fully-integrated, passive telemetric transponders has been shown in this paper. The processes for the sputter deposition of Pb(Zr,TiO3 (PZT thin films from two different composite targets on both Si and c-plane sapphire substrates have been demonstrated. PZT thin films have been deposited by sputter technique. PZT films were deposited onto substrates (Si [(100 Cz wafer] and c-plane sapphire (0001//Ti//Pt followed by sputter-deposited Pt top electrodes. X-ray diffraction results showed that both sputtered PZT films were textured along the [110] direction. The degree of preference for the [110] direction was greater on sapphire substrate where the intensity of that peak is seen to be larger compared to the intensity one Si substrate. TEM data revealed that both sputtered PZT films were polycrystalline in nature. Selected area diffraction (SAD pattern showed that the degree of disorientation between the crystallites was smaller on sapphire substrate compared to on Si substrate, which confirmed the results from the XRD. The remnant polarization Pr on sapphire substrate was larger than on Si’s. The leakage current for the 11 % Pb target sputtered film was much less than 22 % Pb target sputtered film. The breakdown voltage on sapphire substrate was the best. However, for the 11 % Pb target sputtered film’s breakdown voltage was much higher than 22 % Pb target sputtered film.

Thermoluminescence on ZrO{sub 2} films with different dopants; Termoluminiscencia en peliculas de ZrO{sub 2} con distintos impurificantes

Energy Technology Data Exchange (ETDEWEB)

Ceron R, P. V.; Rivera M, T.; Ramos G, A. I.; Guzman M, J.; Montes R, E., E-mail: victceronr@hotmail.com [IPN, Centro de Investigacion en Ciencia Aplicada y Tecnologia Avanzada, Av. Legaria No. 694, Col. Irrigacion, 11500 Mexico D. F. (Mexico)

2015-10-15

Full text: The metal oxides doped with rare earths have presented good thermoluminescent properties for certain wavelengths in the UV. With respect to zirconium oxide exist several studies in which were incorporated impurities and their properties as dosimeter in several regions of the electromagnetic spectrum were analyzed. Because of this background, in this material thermoluminescent glow curves induced by UV in films of ZrO{sub 2}:Eu and ZrO{sub 2}:Tb were studied for comparison with the response of the material doped with two rare earths (ZrO{sub 2}:Eu + Tb). Samples were deposited on glass by ultrasonic spray pyrolysis technique with different synthesis parameters. It was found that the strongest Tl response was to ZrO{sub 2} film doped with terbium (14 times more intense than the film of ZrO{sub 2}:Eu and 6 times the response of ZrO{sub 2}:Eu + Tb). (Author)

Self-diffusion and heterodiffusion in Zr-2.5%Nb α/β interfaces comparison with grain boundary diffusion in α-Zr

International Nuclear Information System (INIS)

Iribarren, M.J.; Dyment, F.

1991-01-01

Conventional radioactive tracer section techniques were used to make an experimental determination of diffusion parameters for Zr, Nb and Ni along the α/β boundary interfaces of Zr-2.5%Nb and comparing them with those for Zr, Nb and Co in α-Zr grain boundaries. Both determinations were made for a wide range of temperatures, including reactor working temperatures. Different materials were used for this purpose, both specially prepared alloys for diffusion experiments and part of the material from the actual pressure tubes. Different stabilizing thermal treatments were performed and results were analyzed based on the different morphologies obtained. (Author) [es

Microwave sintering and in vitro study of defect-free stable porous multilayered HAp–ZrO2 artificial bone scaffold

Directory of Open Access Journals (Sweden)

Dong-Woo Jang, Thi-Hiep Nguyen, Swapan Kumar Sarkar and Byong-Taek Lee

2012-01-01

Full Text Available Continuously porous hydroxyapatite (HAp/t-ZrO2 composites containing concentric laminated frames and microchanneled bodies were fabricated by an extrusion process. To investigate the mechanical properties of HAp/t-ZrO2 composites, the porous composites were sintered at different temperatures using a microwave furnace. The microstructure was designed to imitate that of natural bone, particularly small bone, with both cortical and spongy bone sections. Each microchannel was separated by alternating lamina of HAp, HAp–(t-ZrO2 and t-ZrO2. HAp and ZrO2 phases existed on the surface of the microchannel and the core zone to increase the biocompatibility and mechanical properties of the HAp-ZrO2 artificial bone. The sintering behavior was evaluated and the optimum sintering temperature was found to be 1400 °C, which produced a stable scaffold. The material characteristics, such as the microstructure, crystal structure and compressive strength, were evaluated in detail for different sintering temperatures. A detailed in vitro study was carried out using MTT assay, western blot analysis, gene expression by polymerase chain reaction and laser confocal image analysis of cell proliferation. The results confirmed that HAp-ZrO2 performs as an artificial bone, showing excellent cell growth, attachment and proliferation behavior using osteoblast-like MG63 cells.

Systematic continuum-discretized coupled-channels calculations of total fusion for 6Li with targets 28Si, 59Co, 96Zr, 198Pt, and 209Bi: Effect of resonance states

Science.gov (United States)

Gómez Camacho, A.; Wang, Bing; Zhang, H. Q.

2018-05-01

Continuum discretized coupled-channel (CDCC) calculations of total fusion cross sections for reactions induced by the weakly bound nucleus 6Li with targets 28Si, 59Co, 96Zr, 198Pt, and 209Bi at energies around the Coulomb barrier are presented. In the cluster structure frame of 6Li→α +d , short-range absorption potentials are considered for the interactions between the α and d fragments with the targets. The effect of resonance (l =2 , Jπ=3+,2+,1+ ) and nonresonance states of 6Li on fusion is studied by using two approaches: (1) by omitting the resonance states from the full discretized CDCC breakup space and (2) by considering only the resonance subspace. A systematic analysis of the effect on fusion from resonance breakup couplings is carried out from light to heavy mass targets. Among other things, it is found that resonance breakup states produce strong repulsive polarization potentials that lead to fusion suppression. Couplings from nonresonance states give place to weak repulsive potentials at high energies; however, these become attractive for the heavier targets at low energies.

Field ion microscopy and 3-D atom probe analysis of Al3Zr particles in 7050 Al alloy

International Nuclear Information System (INIS)

Sha, G.; Cerezo, A.

2004-01-01

Full text: For high strength 7xxx series Al alloys, Zr is an important trace alloy element which is often added to optimise properties, having effects such as refining grain size, inhibiting recrystallization, and improving stress corrosion cracking resistance and quench sensitivity. In addition, it has been reported recently that Zr addition also has a significant influence on early stage ageing behaviour of a 7xxx series Al alloy. Zr equilibrium solubility in solid Al is extremely low. After solution or ageing treatment, most Zr is present as small spherical Ai 3 Zr dispersoids approximately 20 nm in diameter, distributed at grain boundaries as well as within the Al matrix. The crystallographic nature of intermetallic phase Al 3 Zr has been well studied in the literatures. So far, no direct measurement of the chemistry of the Al 3 Zr particles in 7xxx series Al alloys has been published. It is unclear if there is significant Zn, Mg or Cu included in the particles. In this research, 3DAP has been employed for the first time to investigate ionisation behaviour of Al 3 Zr particles and determine the chemistry of the particles in 7050 Al alloy. Using field ion microscopy, the local evaporation radius of the Al 3 Zr particle has been measured to be equivalent to 36 nm for a 10 kV tip, less than the equivalent tip radius for the Al matrix of ∼68 nm. Using the matrix Al evaporation field (19 V/nm) as a reference, this allows the evaporation field of Al 3 Zr to be calculated as 35 V/nm, the same as the field calculated for evaporation of Al as Al 2+ (35 V/nm), and that of Zr as Zr 3+ (35 V/nm). This result is consistent with Al 2+ and Zr 3+ being the main species observed in the mass spectrum during analysis of Al 3 Zr particles. Using 3DAP, the chemical compositions of Al 3 Zr particles are determined to be 64.8∼67.7 at% Al, 23.6∼24.8 at% Zr, 6.9∼9.1 at% Zn, 0.4∼0.7 at% Cu, 0.5∼1.2 at% Mg, with a (Al+Zn)/Zr ratio close to 3. Choice of specimen temperature of

Hydrogen storage behavior of ZrCo1-xNix alloys

International Nuclear Information System (INIS)

Jat, Ram Avtar; Parida, S.C.; Agarwal, Renu; Kulkarni, S.G.

2012-01-01

Intermetallic compound ZrCo is proposed as a candidate material for storage, supply and recovery of hydrogen isotopes in International Thermonuclear Experimental Reactor (ITER) Storage and Delivery System (SDS). However, it has been reported that upon repeated hydriding-dehydriding cycles, ZrCo undergoes disproportionation as per the reaction; 2ZrCo + H 2 ↔ ZrH 2 + ZrCO 2 . This results in reduction in hydrogen storage capacity of ZrCo, which is not a desirable property for SDS. Konishi et al. reported that the disproportionation reaction can be suppressed by decreasing the desorption temperature. It is anticipated that suitable ternary alloying of ZrCo can elevated the hydrogen equilibrium pressure and hence decrease the desorption temperature for supply of 100 kPa of hydrogen. In this study, we have investigated the effect of Ni content on the hydrogenation behavior of ZrCo 1-x Ni x alloys

Target identification of natural and traditional medicines with quantitative chemical proteomics approaches.

Science.gov (United States)

Wang, Jigang; Gao, Liqian; Lee, Yew Mun; Kalesh, Karunakaran A; Ong, Yong Siang; Lim, Jaehong; Jee, Joo-Eun; Sun, Hongyan; Lee, Su Seong; Hua, Zi-Chun; Lin, Qingsong

2016-06-01

Natural and traditional medicines, being a great source of drugs and drug leads, have regained wide interests due to the limited success of high-throughput screening of compound libraries in the past few decades and the recent technology advancement. Many drugs/bioactive compounds exert their functions through interaction with their protein targets, with more and more drugs showing their ability to target multiple proteins, thus target identification has an important role in drug discovery and biomedical research fields. Identifying drug targets not only furthers the understanding of the mechanism of action (MOA) of a drug but also reveals its potential therapeutic applications and adverse side effects. Chemical proteomics makes use of affinity chromatography approaches coupled with mass spectrometry to systematically identify small molecule-protein interactions. Although traditional affinity-based chemical proteomics approaches have made great progress in the identification of cellular targets and elucidation of MOAs of many bioactive molecules, nonspecific binding remains a major issue which may reduce the accuracy of target identification and may hamper the drug development process. Recently, quantitative proteomics approaches, namely, metabolic labeling, chemical labeling, or label-free approaches, have been implemented in target identification to overcome such limitations. In this review, we will summarize and discuss the recent advances in the application of various quantitative chemical proteomics approaches for the identification of targets of natural and traditional medicines. Copyright © 2016. Published by Elsevier Inc.

Auto and hetero-diffusion along grain and interphase boundaries in α-Zr and Zr-2.5wt%Nb

International Nuclear Information System (INIS)

Dyment, F.; Iribarren, M.J.; Vieregge, K.; Herzig, C.

1993-01-01

Grain-boundary diffusion measurements made in α-Zr and interphase-boundary diffusion measurements made in the (α+β) region of Zr-2.5wt%Nb were considered together with the aim of gaining a better understanding of the behaviour of these boundaries in Zr-based materials which are relevant for the nuclear industry. When comparing the total set of data it turns out that, from the diffusion point of view, both types of boundaries provide similar short-circuit diffusion paths. (orig.)

Preparation and sintering of Zr(C,N,O) phases

International Nuclear Information System (INIS)

Tamborenea, S.; Mazzoni, A.D.; Aglietti, E.F.

2003-01-01

The Zr(C,O,N) compounds form a great mono-phase zone belonging to the pseudoternary ZrO-ZrN-ZrC system.Theses phases have cubic crystalline structure with a o parameter depending on the C, O 2 and N 2 content.These phases have many potential applications in the manufacture of ceramic pieces utilizable as electronic conductors.The Zr (C,O,N) phases can be obtained from ZrO 2 by carbonitriding reactions: that is carbothermal reduction and simultaneous nitriding.In this work a series of experiences of carbonitriding of zirconia under different conditions (temperatures between 1400 and 1600degC, times of 120 min, carbon content between 20 and 40%) in order to obtain suitable powders to be sintered.The XRD analysis shows the Zr(C,O,N) as the main products and β -ZrON as the only secondary product in proportions depending on the obtaining conditions.The variables employed were the C content and the reaction temperature.The Zr(C,O,N) content varies between 40 and 90% and tends to increase with the temperature and the carbon content whereas the β -ZrON phase varies between the 40 and 10 % decreasing its proportion with temperature and the carbon content.The oxidation resistance of these phases was studied by DTA-TG tests in air.Results show complete oxidation reaction at ∼500degC in air.The sintering of these materials was made on disks obtained by pressing of powders of Zr(C,N,O) contents higher than 90%.Sintering was performed in nitrogen atmosphere and temperatures between 1450 and 1620degC.Disks were characterized by pycnometry and Hg volumeter.The densities obtained were between 5 and 6,6g/cm 3 with a tendency to increase with the Zr(C,N,O) phase content, the temperature and the sintering time.Sintered disks were characterized by dilatometry in N 2

Effects of processing parameters on Be/CuCrZr joining

International Nuclear Information System (INIS)

Park, Jeong-Yong; Lee, Jung-Suk; Choi, Byung-Kwon; Park, Sang-Yun; Hong, Bong Guen; Jeong, Yong Hwan; Jung, Ki-Jung

2007-01-01

A joining of Be/CuCrZr has been considered as the key technology for the fabrication of the ITER first wall. Among the joining methods, Hot isostatic pressing (HIP), which is one of the diffusion bonding methods, is the most feasible method to join the Be and CuCrZr alloy. In the HIP joining of Be and CuCrZr, the interlayer was used to prevent the formation of brittle intermetallic compounds in the interface. Therefore, it is crucial to select a suitable interlayer for a joining of Be and CuCrZr. On the other hand, the diffusion between Be and CuCrZr would be enhanced with an increase of the HIP joining temperature, thereby increasing the joint strength. However, the HIP joining temperature is limited by the mechanical properties of CuCrZr. During the fabrication process of the ITER first wall, CuCrZr is subjected to several thermal cycles including a solution annealing, a cooling and an aging. The HIP joining of Be and CuCrZr corresponds to the aging of CuCrZr. The HIP joining at a higher temperature would cause a degradation of the mechanical properties of CuCrZr by an overaging effect although it is preferable for an improvement of the joint strength. In this study, the effect of the cooling rate on the mechanical properties of aged CuCrZr was investigated to find the maximum HIP temperature without a degradation of the mechanical properties of CuCrZr

Valence electron structure and properties of the ZrO2

Institute of Scientific and Technical Information of China (English)

2008-01-01

To reveal the properties of ZrO2 at the atom and electron levels, the valence elec- tron structures of three ZrO2 phases were analyzed on the basis of the empirical electron theory of solids and molecules. The results showed that the hybridization levels of Zr and O atoms in the m-ZrO2 were the same as those in the t-ZrO2, while those in the c-ZrO2 rose markedly. The electron numbers and bond energies on the strongest covalent bonds in the m-ZrO2 phase were the greatest, the values were 0.901106 and 157.5933 kJ/mol, respectively. Those in the t-ZrO2 phase took second place, which were 0.722182 and 123.9304 kJ/mol, and those in the c-ZrO2 phase were the smallest, which were 0.469323 and 79.0289 kJ/mol. According to the product of the bond energy on the strongest covalent bond and equivalent bond number (this value reflected the crystal cohesive energy), the order from the greatness to smallness was the c-ZrO2> t-ZrO2 > m-ZrO2. This showed that the m-phase bonds were the tightest, their energy was the smallest, the crystal cohe- sive energy of the m-phase was the largest, and the m-phase existed most stably at room temperature. So it must need energy or higher temperature to take apart the stronger covalent bonds to form a new phase.

Valence electron structure and properties of the ZrO2

Institute of Scientific and Technical Information of China (English)

LI JinPing; MENG SongHe; HAN JieCai; ZHANG XingHong

2008-01-01

To reveal the properties of ZrO2 at the atom and electron levels, the valence elec-tron structures of three ZrO2 phases were analyzed on the basis of the empirical electron theory of solids and molecules. The results showed that the hybridization levels of Zr and O atoms in the m-ZrO2 were the same as those in the t-ZrO2, while those in the c-ZrO2 rose markedly. The electron numbers and bond energies on the strongest covalent bonds in the m-ZrO2 phase were the greatest, the values were 0.901106 and 157.5933 kJ/mol, respectively. Those in the t-ZrO2 phase took second place, which were 0.722182 and 123.9304 kJ/mol, and those in the c-ZrO2 phase were the smallest, which were 0.469323 and 79.0289 kJ/mol. According to the product of the bond energy on the strongest covalent bond and equivalent bond number (this value reflected the crystal cohesive energy), the order from the greatness to smallness was the c-ZrO2 t-ZrO2 m-ZrO2. This showed that the m-phase bonds were the tightest, their energy was the smallest, the crystal cohe-sive energy of the m-phase was the largest, and the m-phase existed most stably at room temperature. So it must need energy or higher temperature to take apart the stronger covalent bonds to form a new phase.

Phase diagram of the ternary Zr-Ti-Sn system

International Nuclear Information System (INIS)

Arias, D.; Gonzalez Camus, M.

1987-01-01

It is well known that Ti stabilizes the high temperature cubic phase of Zr and that Sn stabilizes the low temperature hexagonal phase of Zr. The effect of Sn on the Zr-Ti diagram has been studied in the present paper. Using high purity metals, nine different alloys have been prepared, with 4-32 at % Ti, 0.7-2.2 at % Sn and Zr till 100%. Resistivity and optical and SEM metallography techniques have been employed. Effect of some impurities have been analyzed. The results are discussed and different isothermic sections of the ternary Zr-Ti-Sn diagram are presented. (Author) [es

A peristaltic pump driven 89Zr separation module

DEFF Research Database (Denmark)

Siikanen, J.; Peterson, M.; Tran, T.

2012-01-01

To facilitate the separation of 89Zr produced in yttrium foils, an automated separation module was designed and assembled. The module separates more than 85% of produced 89Zr - activity in 3 g foils in less than 90 min. About 10 % remains in the dissolving vial. The quality of the separated 89Zr...

Effects of interfacial layer on characteristics of TiN/ZrO2 structures.

Science.gov (United States)

Kim, Younsoo; Kang, Sang Yeol; Choi, Jae Hyoung; Lim, Jae Soon; Park, Min Young; Chung, Suk-Jin; Chung, Jaegwan; Lee, Hyung Ik; Kim, Ki Hong; Kyoung, Yong Koo; Heo, Sung; Yoo, Cha Young; Kang, Ho-Kyu

2011-09-01

To minimize the formation of unwanted interfacial layers, thin interfacial layer (ZrCN layer) was deposited between TiN bottom electrode and ZrO2 dielectric in TiN/ZrO2/TiN capacitor. Carbon and nitrogen were also involved in the layer because ZrCN layer was thermally deposited using TEMAZ without any reactant. Electrical characteristics of TiN/ZrO2/TiN capacitor were improved by insertion of ZrCN layer. The oxidation of TiN bottom electrode was largely inhibited at TiN/ZrCN/ZrO2 structure compared to TiN/ZrO2 structure. While the sheet resistance of TiN/ZrCN/ZrO2 structure was constantly sustained with increasing ZrO2 thickness, the large increase of sheet resistance was observed in TiN/ZrO2 structure after 6 nm ZrO2 deposition. When ZrO2 films were deposited on ZrCN layer, the deposition rate of ZrO2 also increased. It is believed that ZrCN layer acted both as a protection layer of TiN oxidation and a seed layer of ZrO2 growth.

Thermodynamic study of CVD-ZrO2 phase diagrams

International Nuclear Information System (INIS)

Torres-Huerta, A.M.; Vargas-Garcia, J.R.; Dominguez-Crespo, M.A.; Romero-Serrano, J.A.

2009-01-01

Chemical vapor deposition (CVD) of zirconium oxide (ZrO 2 ) from zirconium acetylacetonate Zr(acac) 4 has been thermodynamically investigated using the Gibbs' free energy minimization method and the FACTSAGE program. Thermodynamic data Cp o , ΔH o and S o for Zr(acac) 4 have been estimated using the Meghreblian-Crawford-Parr and Benson methods because they are not available in the literature. The effect of deposition parameters, such as temperature and pressure, on the extension of the region where pure ZrO 2 can be deposited was analyzed. The results are presented as calculated CVD stability diagrams. The phase diagrams showed two zones, one of them corresponds to pure monoclinic phase of ZrO 2 and the other one corresponds to a mix of monoclinic phase of ZrO 2 and graphite carbon.

Targeting arachidonic acid pathway by natural products for cancer prevention and therapy.

Science.gov (United States)

Yarla, Nagendra Sastry; Bishayee, Anupam; Sethi, Gautam; Reddanna, Pallu; Kalle, Arunasree M; Dhananjaya, Bhadrapura Lakkappa; Dowluru, Kaladhar S V G K; Chintala, Ramakrishna; Duddukuri, Govinda Rao

2016-10-01

Arachidonic acid (AA) pathway, a metabolic process, plays a key role in carcinogenesis. Hence, AA pathway metabolic enzymes phospholipase A 2 s (PLA 2 s), cyclooxygenases (COXs) and lipoxygenases (LOXs) and their metabolic products, such as prostaglandins and leukotrienes, have been considered novel preventive and therapeutic targets in cancer. Bioactive natural products are a good source for development of novel cancer preventive and therapeutic drugs, which have been widely used in clinical practice due to their safety profiles. AA pathway inhibitory natural products have been developed as chemopreventive and therapeutic agents against several cancers. Curcumin, resveratrol, apigenin, anthocyans, berberine, ellagic acid, eugenol, fisetin, ursolic acid, [6]-gingerol, guggulsteone, lycopene and genistein are well known cancer chemopreventive agents which act by targeting multiple pathways, including COX-2. Nordihydroguaiaretic acid and baicalein can be chemopreventive molecules against various cancers by inhibiting LOXs. Several PLA 2 s inhibitory natural products have been identified with chemopreventive and therapeutic potentials against various cancers. In this review, we critically discuss the possible utility of natural products as preventive and therapeutic agents against various oncologic diseases, including prostate, pancreatic, lung, skin, gastric, oral, blood, head and neck, colorectal, liver, cervical and breast cancers, by targeting AA pathway. Further, the current status of clinical studies evaluating AA pathway inhibitory natural products in cancer is reviewed. In addition, various emerging issues, including bioavailability, toxicity and explorability of combination therapy, for the development of AA pathway inhibitory natural products as chemopreventive and therapeutic agents against human malignancy are also discussed. Copyright © 2016 Elsevier Ltd. All rights reserved.

The {sup 95}Zr( n , γ ){sup 96}Zr Cross Section from the Surrogate Ratio Method and Its Effect on s -process Nucleosynthesis

Energy Technology Data Exchange (ETDEWEB)

Yan, S.Q.; Li, Z.H.; Wang, Y.B.; Su, J.; Li, Y. J.; Han, Y.L.; Shen, Y.P.; Guo, B.; Zeng, S.; Lian, G.; Chen, Y.S.; Liu, W.P. [China Institute of Atomic Energy, P.O. Box 275(10), Beijing 102413 (China); Nishio, K.; Makii, H.; Nishinaka, I.; Hirose, K.; Orlandi, R. [Japan Atomic Energy Agency, Tokai, Naka, Ibaraki 319-1195 (Japan); Lugaro, M. [Konkoly Observatory, Research Centre for Astronomy and Earth Sciences, Hungarian Academy of Sciences, 1121 Budapest (Hungary); Karakas, A. I. [Monash Centre for Astrophysics, School of Physics and Astronomy, Monash University, Clayton, VIC 3800 (Australia); Mohr, P., E-mail: panyu@ciae.ac.cn, E-mail: maria.lugaro@csfk.mta.hu [Institute for Nuclear Research (ATOMKI), H-4001 Debrecen (Hungary)

2017-10-20

The {sup 95}Zr( n , γ ){sup 96}Zr reaction cross section is crucial in the modeling of s -process nucleosynthesis in asymptotic giant branch stars because it controls the operation of the branching point at the unstable {sup 95}Zr and the subsequent production of {sup 96}Zr. We have carried out the measurement of the {sup 94}Zr({sup 18}O, {sup 16}O) and {sup 90}Zr({sup 18}O, {sup 16}O) reactions and obtained the γ -decay probability ratio of {sup 96}Zr* and {sup 92}Zr* to determine the {sup 95}Zr( n , γ ){sup 96}Zr reaction cross sections with the surrogate ratio method. Our deduced Maxwellian-averaged cross section of 66 ± 16 mb at 30 keV is close to the value recommended by Bao et al., but 30% and more than a factor of two larger than the values proposed by Toukan and Käppeler and Lugaro et al., respectively, and routinely used in s -process models. We tested the new rate in stellar models with masses between 2 and 6 M {sub ⊙} and metallicities of 0.014 and 0.03. The largest changes—up to 80% variations in {sup 96}Zr—are seen in models of mass 3–4 M {sub ⊙}, where the {sup 22}Ne neutron source is mildly activated. The new rate can still provide a match to data from meteoritic stardust silicon carbide grains, provided that the maximum mass of the parent stars is below 4 M {sub ⊙}, for a metallicity of 0.03.

First-principles study of structural stability, electronic, optical and elastic properties of binary intermetallic: PtZr

Energy Technology Data Exchange (ETDEWEB)

Pagare, Gitanjali, E-mail: gita-pagare@yahoo.co.in [Department of Physics, Sarojini Naidu Government Girls P. G. Autonomous College, Bhopal-462016 (India); Jain, Ekta, E-mail: jainekta05@gmail.com [Department of Physics, Government M. L. B. Girls P. G. Autonomous College, Bhopal-462002 (India); Sanyal, S. P., E-mail: sps.physicsbu@gmail.com [Department of Physics, Barkatullah University, Bhopal-462026 (India)

2016-05-06

Structural, electronic, optical and elastic properties of PtZr have been studied using the full-potential linearized augmented plane wave (FP-LAPW) method within density functional theory (DFT). The energy against volume and enthalpy vs. pressure variation in three different structures i.e. B{sub 1}, B{sub 2} and B{sub 3} for PtZr has been presented. The equilibrium lattice parameter, bulk modulus and its pressure derivative have been obtained using optimization method for all the three phases. Furthermore, electronic structure was discussed to reveal the metallic character of the present compound. The linear optical properties are also studied under zero pressure for the first time. Results on elastic properties are obtained using generalized gradient approximation (GGA) for exchange correlation potentials. Ductile nature of PtZr compound is predicted in accordance with Pugh’s criteria.

Cross-sections for formation of {sup 89}Zr{sup m} through {sup 90}Zr(n,2n){sup 89}Zr{sup m} reaction over neutron energy range 13.73 MeV to 14.77 MeV

Energy Technology Data Exchange (ETDEWEB)

Attar, F.M.D. [Department of Physics, University of Pune, Pune-411007 (India); Mandal, R. [Department of Physics, University of Pune, Pune-411007 (India); Indian Institute of Technology, Kharagpur (India); Dhole, S.D. [Department of Physics, University of Pune, Pune-411007 (India); Saxena, A. [Nuclear Physics Division, BARC, Mumbai (India); Ashokkumar,; Ganesan, S. [Reactor Physics Design Division, BARC, Mumbai (India); Kailas, S. [Nuclear Physics Division, BARC, Mumbai (India); Bhoraskar, V.N. [Department of Physics, University of Pune, Pune-411007 (India)], E-mail: vnb@physics.unipune.ernet.in

2008-04-01

The cross-sections for formation of metastable state of {sup 89}Zr ({sup 89}Zr{sup m}, 0.588 MeV, 4.16 m) through {sup 90}Zr(n,2n){sup 89}Zr{sup m} reaction induced by 13.73 MeV to 14.77 MeV neutrons were measured for the first time and also theoretically estimated using Empire-II and Talys programs. At 13.73 MeV neutron energy, the {sup 89}Zr nuclei can be excited to metastable state, {sup 89}Zr{sup m}, when the first and the second emitted neutrons have energies lower than the most probable energy {approx}0.64 MeV. The probability of exciting {sup 89}Zr nuclei to energy levels higher than 0.588 MeV and therefore of populating the metastable state through decay process increases with increasing neutron energy. The measured cross-sections vary from 41{+-}3mb to 221{+-}15mb over neutron energies 13.73 MeV to 14.77 MeV, and are in agreement with the cross-sections estimated using Empire-II code. The formation of {sup 89}Zr{sup m} is favoured when the first and the second reaction neutrons are emitted with the most probable energies rather than lower energy, except for 13.73 MeV neutrons.

Whole genome resequencing reveals natural target site preferences of transposable elements in Drosophila melanogaster.

Directory of Open Access Journals (Sweden)

Raquel S Linheiro

Full Text Available Transposable elements are mobile DNA sequences that integrate into host genomes using diverse mechanisms with varying degrees of target site specificity. While the target site preferences of some engineered transposable elements are well studied, the natural target preferences of most transposable elements are poorly characterized. Using population genomic resequencing data from 166 strains of Drosophila melanogaster, we identified over 8,000 new insertion sites not present in the reference genome sequence that we used to decode the natural target preferences of 22 families of transposable element in this species. We found that terminal inverted repeat transposon and long terminal repeat retrotransposon families present clade-specific target site duplications and target site sequence motifs. Additionally, we found that the sequence motifs at transposable element target sites are always palindromes that extend beyond the target site duplication. Our results demonstrate the utility of population genomics data for high-throughput inference of transposable element targeting preferences in the wild and establish general rules for terminal inverted repeat transposon and long terminal repeat retrotransposon target site selection in eukaryotic genomes.

Corrosion resistance of amorphous NiCrZr and NiCrMoZr alloys

International Nuclear Information System (INIS)

Naka, M.; Miyake, M.; Okamoto, I.

1987-01-01

One of the authors has reported that the corrosion resistance of chromium containing amorphous alloys is extremely improved by alloying phosphorus among metalloids. Two factors operate for the improvement of corrosion resistance of the amorphous alloys. First, phosphorus serves for the rapid formation of protective passive film. Second, the compositional and structural homogeneity in amorphous state also account for the formation of protective film. The latter factor has been clearly seen in the high corrosion resistance of CoCrMoZr and CoCrWZr alloys without metalloids. In order to clarify the separately two factors in the corrosion resistance of amorphous alloys, the corrosion resistance of amorphous alloys without metalloids has to be further investigated. This paper also deals with the corrosion resistance and electrochemical behavior of NiCrZr and NiCrMoZr alloys in 1N HCl, and compare them with the corrosion behavior of the crystalline alloys containing the same composition as that of the amorphous alloys

Influence of Zr doping on structure and morphology of TiO2 nanorods prepared using hydrothermal method

Science.gov (United States)

Muslimin, Masliana; Jumali, Mohammad Hafizuddin; Tee, Tan Sin; Beng, Lee Hock; Hui, Tan Chun; Chin, Yap Chi

2018-04-01

The aim of this work is to investigate the effect of Zr doping on TiO2 nanostructure. TiO2 nanorods thin films with different Zr-doping concentrations (6 × 10-3 M, 13 × 10-3 M and 25 × 10-3 M) were successfully prepared using a simple hydrothermal method. The structural and morphological properties of the samples were evaluated using XRD and FESEM respectively. The XRD results revealed that the TiO2 in all samples stabilized as rutile phase. The FESEM micrographs confirmed that TiO2 exist as square like nanorods with blunt tips. Although the crystallographic nature remains unchanged, the introduction of Zr has altered the surface density, structure and morphology of TiO2 which subsequently will have significant effect on its properties.

Structure, mechanical properties, and grindability of dental Ti-Zr alloys.

Science.gov (United States)

Ho, Wen-Fu; Chen, Wei-Kai; Wu, Shih-Ching; Hsu, Hsueh-Chuan

2008-10-01

Structure, mechanical properties and grindability of a series of binary Ti-Zr alloys with zirconium contents ranging from 10 to 40 wt% have been investigated. Commercially pure titanium (c.p. Ti) was used as a control. Experimental results indicated that the diffraction peaks of all the Ti-Zr alloys matched those for alpha Ti. No beta-phase peaks were found. The hardness of the Ti-Zr alloys increased as the Zr contents increased, and ranged from 266 HV (Ti-10Zr) to 350 HV (Ti-40Zr). As the concentration of zirconium in the alloys increased, the strength, elastic recovery angles and hardness increased. Moreover, the elastically recoverable angle of Ti-40Zr was higher than of c.p. Ti by as much as 550%. The grindability of each metal was found to be largely dependent on the grinding conditions. The Ti-40Zr alloy had a higher grinding rate and grinding ratio than c.p. Ti at low speed. The grinding rate of the Ti-40Zr alloy at 500 m/min was about 1.8 times larger than that of c.p. Ti, and the grinding ratio was about 1.6 times larger than that of c.p. Ti. Our research suggested that the Ti-40Zr alloy has better mechanical properties, excellent elastic recovery capability and improved grindability at low grinding speed. The Ti-40Zr alloy has a great potential for use as a dental machining alloy.

Microstructural characterization of LaB6-ZrB2 eutectic composites

International Nuclear Information System (INIS)

Wang Shengchang; Wei, W.J.; Zhang Litong

2003-01-01

Detail microstructure of LaB 6 -ZrB 2 composites has been characterized by TEM and HRTEM. The directionally solidified ZrB 2 fibers in LaB 6 matrix near LaB 6 -ZrB 2 eutectics present at least three growing relationship systems. In addition to previous report of [001]LaB 6 / [0001]ZrB 2 relationship, [0 anti 11]LaB 6 / [0001]ZrB 2 and [1 anti 20]LaB 6 / [0001]ZrB 2 . were identified. Different with [001]LaB 6 / [0001]ZrB 2 system, the interfaces of [0 anti 11]LaB 6 / [0001]ZrB 2 and [1 anti 20]LaB 6 / [0001]ZrB 2 . show non-coherent and clean interfaces. There is neither glassy phase nor reaction products found at the interfaces (orig.)

Development of AMS procedure for measurement of 93Zr

Science.gov (United States)

Lu, Wenting; Collon, Philippe; Kashiv, Yoav; Bowers, Matthew; Robertson, Daniel; Schmitt, Christopher

2011-10-01

The procedure for measuring 93Zr (t1/2 = 1.5 Ma) by AMS is currently being developed at the Nuclear Science Lab at the University of Notre Dame and we report on first experiments performed in this direction. AMS detection of 93Zr can potentially be applied to address astrophysical and environmental issues: (1) the measurement of the 92Zr(n,γ)93Zr reaction cross-section at nucleosynthesis s-process relevant temperatures, (2) the search for potential live 93Zr from a supernova in deep sea sediments, (3) hydrological and radioactive waste tracing. The measurement of 93Zr requires adequate separation from its stable isobar 93Nb. We are currently working on optimizing this separation by using the GasFilled Magnet technique with additional multiple dE measurements in a focal plane ionization chamber.

Multiple superdeformed bands in Sr, Y, and Zr nuclei

International Nuclear Information System (INIS)

Reviol, W.; Sarantites, D.G.; Lerma, F.; Devlin, M.; LaFosse, D.R.; Chiara, C.J.; Wyss, R.; Baktash, C.; Jin, H.-Q.; Tabor, S.L.; Soltysik, D.; Clark, R.M.; Lee, I.Y.; Macchiavelli, A.O.; MacLeod, R.W.

2003-01-01

Multiple superdeformed bands in the nuclei 80-83Sr, 82-84Y, and 83,84Zr have been studied in a backed-target experiment using the Gammasphere and Microball detector arrays. For 15 bands in these nuclei, average transition quadrupole moments (Qt) have been measured accurately. Among those are two pairs of 'isospectral' bands and the Qt values obtained in each case are nearly identical. The measured Qt values and dynamical moments of inertia place stringent conditions on configuration assignments for the bands obtained from mean field calculations

Grain size stabilization of tetragonal phase of zirconia in sputtered Zr-O cermet films

International Nuclear Information System (INIS)

Hadavi, M. S.; Keshmiri, H.; Kompany, A.; Zhang, Q. C.

2005-01-01

In this research, thin films of Zr/ZrO 2 composites were deposited by reactive magnetron sputtering technique on Si and fused Silica substrates, and their structures were investigated by x-ray diffraction method. During the deposition of the cermet layers, a Zr metallic target was sputtered in a gas mixture of Ar and O 2 . By controlling of O 2 flow rate, the different metal volume fractions in the cermet layers were achieved. The optical response of the samples was studied using spectroscopy methods. Also the effect of vacuum annealing on the structures and the optical properties were studies. x-ray diffraction results indicated that the prepared samples were amorphous and vacuum annealing induced crystallization in the cermet films. This research also show that without doping, the tetragonal phase of Zirconia can be stabilized at a temperature lower than the normal transition temperature. This is g rain size stabilization a nd relates to the small size of the crystallizes. In order to study the electron diffraction in the selected area patterns, the samples were analysed by a high-resolution transmission microscope. The selected area patterns results showed that all of the as prepared samples were amorphous showing evidence of very small Zr crystallites immersed in a dielectric medium. The Sad results are in close agreement with those obtained by x-ray diffraction analysis

Grain size stabilization of tetragonal phase of zirconia in sputtered Zr- O cermet films

Directory of Open Access Journals (Sweden)

M. S. Hadavi

2005-06-01

Full Text Available  In this research, thin films of Zr/ZrO2 composites were deposited by reactive magnetron sputtering technique on Si and fused Silica substrates, and their structures were investigated by XRD method. During the deposition of the cermet layers, a Zr metallic target was sputtered in a gas mixture of Ar and O2. By controlling of O2 flow rate, the different metal volume fractions in the cermet layers were achieved. The optical response of the samples was studied using spectroscopy methods. Also the effect of vacuum annealing on the structures and the optical properties were studied. XRD results indicated that the prepared samples were amorphous and vacuum annealing induced crystallization in the cermet films. This research also showed that without doping, the tetragonal phase of zirconia can be stabilized at a temperature lower than the normal transition temperature. This is “grain size stabilization” and relates to the small size of the crystallites. In order to study the electron diffraction in the selected area patterns (SAD, the samples were analyzed by a high-resolution transmission microscope. The SAD results showed that all of the as prepared samples were amorphous showing evidence of very small Zr crystallites immersed in a dielectric medium.The SAD results are in close agreement with those obtained by XRD analysis.

Mechanical testings on hydrurated Zr, Zry-4 and Zr-2.5 Nb under neutronic irradiation

International Nuclear Information System (INIS)

Vazquez, Carolina A.; Fortis, Ana M.

2007-01-01

In this work the measurements of irradiation hardening made on hydrurated and irradiated Zr and Zr alloys are presented. The irradiations were carried out in the RA-1 reactor at neutron fluences below those were the inhomogeneities of the deformation occur. It is observed an important difference in the mechanical behavior between the alloys according to the thermal treatments and the hydrogen contents. (author) [es

Effect of processing variables on microstructure and properties of two Al-Li-Cu-Mg-Zr alloys

International Nuclear Information System (INIS)

Palmer, I.G.; Lewis, R.E.; Crooks, D.D.

1984-01-01

Two Al-Li-Cu-Mg-Zr alloys have been prepared in the form of both powder metallurgy (PM) and ingot metallurgy (IM) alloys. The compositions were selected to meet certain program goals based on the results of an alloy development phase, the details of which have been previously published. The target compositions were Al-3Li-1.5Cu-1Mg-0.2Zr and Al-3Cu-2Li-1Mg-0.2Zr. The PM alloys were prepared from chill cast remelt stock by centrifugal atomization in helium, followed by screening, degassing, and extrusion. The IM alloys were prepared by direct chill (DC) casting, homogenization and extrusion. Full details of the production of the alloys are given. The effects of various processing conditions on microstructure and properties were evaluated, including different heat treatments and stretching conditions. These effects are described in detail with particular emphasis on a comparison of the PM and IM alloys. 10 references

Determination of Nb in ZrO2 matrix using Wavelength Dispersive X-Ray Fluorescence (WDXRF) technique

International Nuclear Information System (INIS)

Jha, S.N.; Kapoor, S.K.; Malhotra, S.K.; Kaimal, R.; Kamat, M.J.; Sehra, J.C.

1998-09-01

A Wavelength Dispersive X-Ray Fluorescence (WDXRF) method is described for the estimation of niobium in ZrO 2 matrix in the concentration range of 0.5 to 35%. Analysis of Nb is desired during the reclamation of zirconium from Zr-2.5% Nb scrap. Zr-2.5% Nb is used in water cooled nuclear power reactors on account of high creep resistance and strength. For the reclamation of these metals from the scrap, chlorination is done to produce mixed chloride. The mixed chloride is treated to obtain individual chloride for eventually converting to respective metal. Analysis is required to ascertain purity of these metals reclaimed from the scrap. Primary x-rays from gold target x-ray tube were used to excite the K lines of Nb. A linear relation has been found between the intensity of Nb-Kα 1,2 line and concentration in the above range and the detection limit was 0.03% for 10 seconds counting time. (author)

A new Ti-Zr-Hf-Cu-Ni-Si-Sn bulk amorphous alloy with high glass-forming ability

International Nuclear Information System (INIS)

Huang, Y.J.; Shen, J.; Sun, J.F.; Yu, X.B.

2007-01-01

The effect of Sn substitution for Cu on the glass-forming ability was investigated in Ti 41.5 Zr 2.5 Hf 5 Cu 42.5-x Ni 7.5 Si 1 Sn x (x = 0, 1, 3, 5, 7) alloys by using differential scanning calorimetry (DSC) and X-ray diffractometry. The alloy containing 5% Sn shows the highest glass-forming ability (GFA) among the Ti-Zr-Hf-Cu-Ni-Si-Sn system. Fully amorphous rod sample with diameters up to 6 mm could be successfully fabricated by the copper mold casting Ti 41.5 Zr 2.5 Hf 5 Cu 37.5 Ni 7.5 Si 1 Sn 5 alloy. The activation energies for glass transition and crystallization for Ti 41.5 Zr 2.5 Hf 5 Cu 37.5 Ni 7.5 Si 1 Sn 5 amorphous alloy are both larger than those values for the Sn-free alloy. The enhancement in GFA and thermal stability after the partial replacement of Cu by Sn may be contributed to the strong atomic bonding nature between Ti and Sn and the increasing of atomic packing density. The amorphous Ti 41.5 Zr 2.5 Hf 5 Cu 37.5 Ni 7.5 Si 1 Sn 5 alloy also possesses superior mechanical properties

Moessbauer spectroscopy characterization of Zr-Nb-Fe phases

Energy Technology Data Exchange (ETDEWEB)

Ramos, C.P. [CONICET, Av. Gral. Paz 1499, 1650 Buenos Aires (Argentina)]. E-mail: ciramos@cnea.gov.ar; Granovsky, M.S. [CAC-CNEA, Av. Gral. Paz 1499, 1650 Buenos Aires (Argentina); Saragovi, C. [CAC-CNEA, Av. Gral. Paz 1499, 1650 Buenos Aires (Argentina)

2007-02-01

The aim of this work was the characterization of the ternary phases and of those coming from the corresponding binary systems in the Zr-Nb-Fe diagram by means of Moessbauer spectroscopy. This is part of a complete study involving a tentative isothermal section at 900 deg. C of the center of the Zr-Nb-Fe diagram which will be published elsewhere. Zr-Nb-Fe alloys with Nb contents between 5 and 50 at% and Fe contents between 10 and 60 at% were analyzed after a heat treatment at 900 deg. C for 4 month. Moessbauer characterization of the phases was complemented by optical and scanning electron microscopies, X-ray diffraction and electron microprobe analysis. From the obtained results it can be inferred that Fe in both of the Laves phases present in this system (Zr(FeNb){sub 2} and (ZrNb)Fe{sub 2}) sees different environments, producing quadrupole splitting and hyperfine field distributions, respectively. Two types of body centered cubic {beta} phases (Zr-rich and Nb-rich) were found having noticeable differences in their Moessbauer parameters. Furthermore it was shown that the ternary Fe(NbZr){sub 2} compound would show magnetic character at low temperatures. Concentration dependence of the hyperfine parameters and their relations with the lattice parameters contributed to the structural characterization of the phases.

Moessbauer spectroscopy characterization of Zr-Nb-Fe phases

International Nuclear Information System (INIS)

Ramos, C.P.; Granovsky, M.S.; Saragovi, C.

2007-01-01

The aim of this work was the characterization of the ternary phases and of those coming from the corresponding binary systems in the Zr-Nb-Fe diagram by means of Moessbauer spectroscopy. This is part of a complete study involving a tentative isothermal section at 900 deg. C of the center of the Zr-Nb-Fe diagram which will be published elsewhere. Zr-Nb-Fe alloys with Nb contents between 5 and 50 at% and Fe contents between 10 and 60 at% were analyzed after a heat treatment at 900 deg. C for 4 month. Moessbauer characterization of the phases was complemented by optical and scanning electron microscopies, X-ray diffraction and electron microprobe analysis. From the obtained results it can be inferred that Fe in both of the Laves phases present in this system (Zr(FeNb) 2 and (ZrNb)Fe 2 ) sees different environments, producing quadrupole splitting and hyperfine field distributions, respectively. Two types of body centered cubic β phases (Zr-rich and Nb-rich) were found having noticeable differences in their Moessbauer parameters. Furthermore it was shown that the ternary Fe(NbZr) 2 compound would show magnetic character at low temperatures. Concentration dependence of the hyperfine parameters and their relations with the lattice parameters contributed to the structural characterization of the phases

Target fuels for plutonium and minor actinide transmutation in pressurized water reactors

International Nuclear Information System (INIS)

Washington, J.; King, J.; Shayer, Z.

2017-01-01

Highlights: • We evaluate transmutation fuels for plutonium and minor actinide destruction in LWRs. • We model a modified AP1000 fuel assembly in SCALE6.1. • We evaluate spectral shift absorber coatings to improve transmutation performance. - Abstract: The average nuclear power plant produces twenty metric tons of used nuclear fuel per year, containing approximately 95 wt% uranium, 1 wt% plutonium, and 4 wt% fission products and transuranic elements. Fast reactors are a preferred option for the transmutation of plutonium and minor actinides; however, an optimistic deployment time of at least 20 years indicates a need for a nearer-term solution. This study considers a method for plutonium and minor actinide transmutation in existing light water reactors and evaluates a variety of transmutation fuels to provide a common basis for comparison and to determine if any single target fuel provides superior transmutation properties. A model developed using the NEWT module in the SCALE 6.1 code package provided performance data for the burnup of the target fuel rods in the present study. The target fuels (MOX, PuO_2, Pu_3Si_2, PuN, PuUZrH, PuZrH, PuZrHTh, and PuZrO_2) are evaluated over a 1400 Effective Full Power Days (EFPD) interval to ensure each assembly remained critical over the entire burnup period. The MOX (5 wt% PuO_2), Pu_0_._3_1ZrH_1_._6Th_1_._0_8, and PuZrO_2MgO (8 wt% Pu) fuels result in the highest rate of plutonium transmutation with the lowest rate of curium-244 production. This study selected eleven different burnable absorbers (B_4C, CdO, Dy_2O_3, Er_2O_3, Eu_2O_3, Gd_2O_3, HfO_2, In_2O_3, Lu_2O_3, Sm_2O_3, and TaC) for evaluation as spectral shift absorber coatings on the outside of the fuel pellets to determine if an absorber coating can improve the transmutation properties of the target fuels. The PuZrO_2MgO (8 wt% Pu) target fuel with a coating of Lu_2O_3 resulted in the highest rate of plutonium transmutation with the greatest reduction in curium

Target fuels for plutonium and minor actinide transmutation in pressurized water reactors

Energy Technology Data Exchange (ETDEWEB)

Washington, J., E-mail: jwashing@gmail.com [Nuclear Science and Engineering Program, Colorado School of Mines, 1500 Illinois St., Golden, CO 80401 (United States); King, J., E-mail: kingjc@mines.edu [Nuclear Science and Engineering Program, Colorado School of Mines, 1500 Illinois St., Golden, CO 80401 (United States); Shayer, Z., E-mail: zshayer@mines.edu [Department of Physics, Colorado School of Mines, 1500 Illinois St., Golden, CO 80401 (United States)

2017-03-15

Highlights: • We evaluate transmutation fuels for plutonium and minor actinide destruction in LWRs. • We model a modified AP1000 fuel assembly in SCALE6.1. • We evaluate spectral shift absorber coatings to improve transmutation performance. - Abstract: The average nuclear power plant produces twenty metric tons of used nuclear fuel per year, containing approximately 95 wt% uranium, 1 wt% plutonium, and 4 wt% fission products and transuranic elements. Fast reactors are a preferred option for the transmutation of plutonium and minor actinides; however, an optimistic deployment time of at least 20 years indicates a need for a nearer-term solution. This study considers a method for plutonium and minor actinide transmutation in existing light water reactors and evaluates a variety of transmutation fuels to provide a common basis for comparison and to determine if any single target fuel provides superior transmutation properties. A model developed using the NEWT module in the SCALE 6.1 code package provided performance data for the burnup of the target fuel rods in the present study. The target fuels (MOX, PuO{sub 2}, Pu{sub 3}Si{sub 2}, PuN, PuUZrH, PuZrH, PuZrHTh, and PuZrO{sub 2}) are evaluated over a 1400 Effective Full Power Days (EFPD) interval to ensure each assembly remained critical over the entire burnup period. The MOX (5 wt% PuO{sub 2}), Pu{sub 0.31}ZrH{sub 1.6}Th{sub 1.08}, and PuZrO{sub 2}MgO (8 wt% Pu) fuels result in the highest rate of plutonium transmutation with the lowest rate of curium-244 production. This study selected eleven different burnable absorbers (B{sub 4}C, CdO, Dy{sub 2}O{sub 3}, Er{sub 2}O{sub 3}, Eu{sub 2}O{sub 3}, Gd{sub 2}O{sub 3}, HfO{sub 2}, In{sub 2}O{sub 3}, Lu{sub 2}O{sub 3}, Sm{sub 2}O{sub 3}, and TaC) for evaluation as spectral shift absorber coatings on the outside of the fuel pellets to determine if an absorber coating can improve the transmutation properties of the target fuels. The PuZrO{sub 2}MgO (8 wt% Pu) target

Nafion/ZrSPP composite membrane for high temperature operation of PEMFCs

International Nuclear Information System (INIS)

Kim, Young-Taek; Song, Min-Kyu; Kim, Ki-Hyun; Park, Seung-Bae; Min, Sung-Kyu; Rhee, Hee-Woo

2004-01-01

Nafion/zirconium sulphophenyl phosphate (ZrSPP) composite membranes were prepared to maintain proton conductivity at elevated temperatures. ZrSPP was precipitated by the reaction of Zr 4+ ion and m-sulphophenyl phosphonic (SPP) acid with a stoichiometric ratio P/Zr = 2. The synthesis of ZrSPP was confirmed by phosphonate (P-O) stretching band, assigned at 900-1300 cm -1 in FTIR spectra. The sharp diffraction pattern at 2θ = 5 deg. indicated crystalline α-layered structure of ZrSPP. The proton conductivity of Nafion/ZrSPP (12.5 wt.%) composite membrane reached ca. 0.07 S/cm at 140 deg. C without extra humidification

Hydrogen isotope storage behavior of Zr1-xTixCo alloys

International Nuclear Information System (INIS)

Jat, Ram Avtar; Pati, Subhasis; Parida, S.C.; Agarwal, Renu; Mukerjee, S.K.

2016-01-01

Tritium storage properties similar to uranium make ZrCo as a suitable candidate material for storage, supply and recovery of hydrogen isotopes in various tritium facilities. Beside non-radioactive, nonpyrophoric at room temperature and higher storage capacity (H/f.u. up to 3, f.u. = ZrCo), it has been reported that upon repeated hydriding-dehydriding cycles, ZrCo undergoes dis-proportionation as per the reaction; ZrCo + H 2 ↔ ZrH 2 + ZrCo 2 . The present study is aimed to investigate the effect of Ti content on the hydrogen storage behavior of Zr 1-x Ti x Co alloys and the hydrogen isotope effect

Deuterium absorption and material phase characteristics of Zr2Fe

International Nuclear Information System (INIS)

Nobile, A.; Mosley, W.C.; Holder, J.S.; Brooks, K.N.

1992-01-01

Scanning electron microscope (SEM) images of polished surfaces, electron probe microanalysis, and X-ray powder diffractometry indicated the presence of a continuous Zr 2 Fe phase with secondary phases of ZrFe 2 , Zr 5 FeSn, α-Zr, and Zr 6 Fe 3 O. A statistically-designed experiment to determine the effects of temperature, time, and vacuum quality On activation of St 198 revealed that when activated at low temperature (350 degrees C) deuterium absorption rate was slower when the vacuum quality was pwr (2.5 Pa vs. 3x10 -4 Pa). However, at higher activation temperature (500 degrees C), deuterium absorption rate was fast and was independent of vacuum quality. Deuterium pressure-composition-temperature (P-C-T) data are reported for St 198 in the temperature range 200--500 degrees C. The P-C-T data over the full range of deuterium loading and at temperatures of 350 degrees C and below is described by: K 0e -(ΔH α /RT)=PD 2 q 2 /(q*-q) 2 where ΔHα and K 0 have values of 101.8 kJ·mole -1 and 3.24x10 -8 Pa -1 , and q* is 15.998 kPa·L -1 ·g -1 . At higher temperatures, one or more secondary reactions in the solid phase occur that slowly consume D 2 from the gas phase. XRD suggests these reactions to be: 2 Zr 2 FeD x → x ZrD 2 + x/3 ZrFe 2 + (2 - 2/3x) Zr 2 Fe and Zr 2 FeD x + (2 -1/2x) D 2 → ZrD 2 + Fe, where 0 < x < 3. Reaction between gas phase deuterium and Zr2FC formed in the first reaction accounts for the observed consumption of deuterium from the gas phase by this reaction

ZrB₂-CNTs Nanocomposites Fabricated by Spark Plasma Sintering.

Science.gov (United States)

Jin, Hua; Meng, Songhe; Xie, Weihua; Xu, Chenghai; Niu, Jiahong

2016-11-29

ZrB₂-based nanocomposites with and without carbon nanotubes (CNTs) as reinforcement were prepared at 1600 °C by spark plasma sintering. The effects of CNTs on the microstructure and mechanical properties of nano-ZrB₂ matrix composites were studied. The results indicated that adding CNTs can inhibit the abnormal grain growth of ZrB₂ grains and improve the fracture toughness of the composites. The toughness mechanisms were crack deflection, crack bridging, debonding, and pull-out of CNTs. The experimental results of the nanograined ZrB₂-CNTs composites were compared with those of the micro-grained ZrB₂-CNTs composites. Due to the small size and surface effects, the nanograined ZrB₂-CNTs composites exhibited stronger mechanical properties: the hardness, flexural strength and fracture toughness were 18.7 ± 0.2 GPa, 1016 ± 75 MPa, and 8.5 ± 0.4 MPa·m 1/2 , respectively.

Band gap tuning of amorphous Al oxides by Zr alloying

Energy Technology Data Exchange (ETDEWEB)

Canulescu, S., E-mail: stec@fotonik.dtu.dk; Schou, J. [Department of Photonics Engineering, Technical University of Denmark, 4000 Roskilde (Denmark); Jones, N. C.; Hoffmann, S. V. [ISA, Department of Physics and Astronomy, Aarhus University, 8000 Aarhus (Denmark); Borca, C. N.; Piamonteze, C. [Swiss Light Source, Paul Scherrer Institut, 5232 Villigen PSI (Switzerland); Rechendorff, K.; Nielsen, L. P.; Almtoft, K. P. [Danish Technological Institute, Kongsvang Alle 29, 8000 Aarhus (Denmark); Gudla, V. C.; Bordo, K.; Ambat, R. [Department of Mechanical Engineering, Technical University of Denmark, 2800 Kgs-Lyngby (Denmark)

2016-08-29

The optical band gap and electronic structure of amorphous Al-Zr mixed oxides with Zr content ranging from 4.8 to 21.9% were determined using vacuum ultraviolet and X-ray absorption spectroscopy. The light scattering by the nano-porous structure of alumina at low wavelengths was estimated based on the Mie scattering theory. The dependence of the optical band gap of the Al-Zr mixed oxides on the Zr content deviates from linearity and decreases from 7.3 eV for pure anodized Al{sub 2}O{sub 3} to 6.45 eV for Al-Zr mixed oxides with a Zr content of 21.9%. With increasing Zr content, the conduction band minimum changes non-linearly as well. Fitting of the energy band gap values resulted in a bowing parameter of ∼2 eV. The band gap bowing of the mixed oxides is assigned to the presence of the Zr d-electron states localized below the conduction band minimum of anodized Al{sub 2}O{sub 3}.

Computer simulation of hydrogen diffusion and hydride precipitation at Ta/Zr bond interface. Hydrogen embrittlement in SUS304ULC/Ta/Zr explosive bonded joint

International Nuclear Information System (INIS)

Saida, Kazuyoshi; Fujimoto, Tetsuya; Nishimoto, Kazutoshi

2010-01-01

The concentration of hydrogen and precipitation of zirconium hydrides in Ta/Zr explosive bonded joint were analysed by computer simulation. Numerical model of hydride precipitation under hydrogen diffusion was simplified by the alternate model coupled the macroscopic hydrogen diffusion with the microscopic hydride precipitation. Effects of the initial hydrogen content in Ta, working degree of Zr and post-bond heat treatment on the hydrogen diffusion and hydride precipitation were investigated. Hydrogen was rapidly diffused from Ta substrate into Zr after explosive bonding and temporarily concentrated at Ta/Zr bond interface. Zirconium hydrides were precipitated and grew at Ta/Zr bond interface, and the precipitation zone of hydrides was enlarged with the lapse of time. The precipitation of zirconium hydrides was promoted when the initial hydrogen content in Ta and working degree of Zr were increased. The concentration of hydrogen and precipitation of hydrides at the bond interface were reduced and diminished by post-bond heat treatment at 373 K. It was deduced that hydrogen embrittlement in Ta/Zr explosive bonded joint was caused by the precipitation of zirconium hydrides and concentration of hydrogen at Ta/Zr bond interface during the diffusion of hydrogen containing in Ta substrate. (author)

Phase equilibria of the Al-Pr-Zr ternary system at 773 K

International Nuclear Information System (INIS)

She, Jia; Zhan, Yongzhong; Li, Chunliu; Du, Yong; Xu, Honghui; He, Yuehui

2010-01-01

The phase equilibria of the Al-Pr-Zr ternary system at 773 K have been investigated mainly by means of X-ray powder diffraction (XRD), scanning electron microscopy (SEM) and differential thermal analysis (DTA). The 14 binary compounds, i.e. AlZr 3 , AlZr 2 , Al 2 Zr 3 , Al 3 Zr 4 , AlZr, Al 3 Zr 2 , Al 2 Zr, Al 3 Zr, α-Al 11 Pr 3 , Al 3 Pr, Al 2 Pr, β-AlPr, AlPr 2 and β-AlPr 3 were confirmed. No binary compound was found in the Pr-Zr binary system. The result shows that the isothermal section of the Al-Pr-Zr ternary system at 773 K consists of 17 single-phase regions, 31 two-phase regions and 15 three-phase regions. All the intermediate compounds phases in this system have not a remarkable solid solution at 773 K. No ternary compound is found in this work.

Optical and electrical properties of ZrSe3 single crystals grown by chemical vapour transport technique

International Nuclear Information System (INIS)

Patel, Kaushik; Prajapati, Jagdish; Vaidya, Rajiv; Patel, S.G.

2005-01-01

Single crystals of the lamellar compound, ZrSe 3 , were grown by chemical vapour transport technique using iodine as a transporting agent. The grown crystals were characterized with the help of energy dispersive analysis by X-ray (EDAX), which gave confirmation about the stoichiometry. The optical band gap measurement of as grown crystals was carried out with the help of optical absorption spectra in the range 700-1450 nm. The indirect as well as direct band gap of ZrSe 3 were found to be 1.1 eV and 1.47 eV, respectively. The resistivity of the as grown crystals was measured using van der Pauw method. The Hall parameters of the grown crystals were determined at room temperature from Hall effect measurements. Electrical resistivity measurements were performed on this crystal in the temperature range 303-423 K. The crystals were found to exhibit semiconducting nature in this range. The activation energy and anisotropy measurements were carried out for this crystal. Pressure dependence of electrical resistance was studied using Bridgman opposed anvils set up up to 8 GPa. The semiconducting nature of ZrSe 3 single crystal was inferred from the graph of resistance vs pressure. The results obtained are discussed in detail. (author)

Determination of the equilibrium constant of FeZrCl6 formation from FeCl3 and ZrCl4

International Nuclear Information System (INIS)

Berdonosov, S.S.; Kharisov, B.I.; Nikitin, M.I.

1992-01-01

Equilibrium pressures of chlorine formed in the course of reaction FeCl 3 +ZrCl 4 ↔ FeZrCl 6 +0.5 Cl 2 were determined at the temperatures of 250-325 deg C. The values of equilibrium constant K p of the reaction mentioned at the temperatures of 250, 275, 300 and 325 deg were calculated, taking into consideration the determined values of p Cl2 and literature data on equilibrium pressures of ZrCl 4 and FeCl 3 vapours

Adsorption of Amido Black 10B from aqueous solutions onto Zr (IV) surface-immobilized cross-linked chitosan/bentonite composite

International Nuclear Information System (INIS)

Zhang, Lujie; Hu, Pan; Wang, Jing; Huang, Ruihua

2016-01-01

Graphical abstract: - Highlights: • Zr-CCB was prepared and characterized. • The adsorption of AB10B followed the Langmuir isotherm model. • The pseudo-second-order model described the kinetic behavior. - Abstract: Zr(IV) surface-immobilized cross-linked chitosan/bentonite composite was synthesized by immersing cross-linked chitosan/bentonite composite in zirconium oxychloride solution, and characterized by X-ray diffraction, Fourier transform infrared spectroscopy, Scanning electron microscopy techniques. The adsorption of an anionic dye, Amido Black 10B, from aqueous solution by Zr(IV) loaded cross-linked chitosan/bentonite composite was investigated as a function of loading amount of Zr(IV), adsorbent dosage, pH value of initial dye solution, and ionic strength. The removal of Amido Black 10B increased with an increase in loading amount of Zr(IV) and adsorbent dosage, but decreased with an increase in pH or ionic strength. The adsorption of AB10B onto Zr(IV) loaded cross-linked chitosan/bentonite composite was favored at lower pH values and higher temperatures. The Langmuir isotherm model fitted well with the equilibrium adsorption isotherm data and the maximum monolayer adsorption capacity was 418.4 mg/g at natural pH value and 298 K. The pseudo-second-order kinetic model well described the adsorption process of Amido Black 10B onto Zr(IV) loaded cross-linked chitosan/bentonite composite. The possible mechanisms controlling Amido Black 10B adsorption included hydrogen bonding and electrostatic interactions.

Adsorption of Amido Black 10B from aqueous solutions onto Zr (IV) surface-immobilized cross-linked chitosan/bentonite composite

Energy Technology Data Exchange (ETDEWEB)

Zhang, Lujie; Hu, Pan; Wang, Jing; Huang, Ruihua, E-mail: hrh20022002@163.com

2016-04-30

Graphical abstract: - Highlights: • Zr-CCB was prepared and characterized. • The adsorption of AB10B followed the Langmuir isotherm model. • The pseudo-second-order model described the kinetic behavior. - Abstract: Zr(IV) surface-immobilized cross-linked chitosan/bentonite composite was synthesized by immersing cross-linked chitosan/bentonite composite in zirconium oxychloride solution, and characterized by X-ray diffraction, Fourier transform infrared spectroscopy, Scanning electron microscopy techniques. The adsorption of an anionic dye, Amido Black 10B, from aqueous solution by Zr(IV) loaded cross-linked chitosan/bentonite composite was investigated as a function of loading amount of Zr(IV), adsorbent dosage, pH value of initial dye solution, and ionic strength. The removal of Amido Black 10B increased with an increase in loading amount of Zr(IV) and adsorbent dosage, but decreased with an increase in pH or ionic strength. The adsorption of AB10B onto Zr(IV) loaded cross-linked chitosan/bentonite composite was favored at lower pH values and higher temperatures. The Langmuir isotherm model fitted well with the equilibrium adsorption isotherm data and the maximum monolayer adsorption capacity was 418.4 mg/g at natural pH value and 298 K. The pseudo-second-order kinetic model well described the adsorption process of Amido Black 10B onto Zr(IV) loaded cross-linked chitosan/bentonite composite. The possible mechanisms controlling Amido Black 10B adsorption included hydrogen bonding and electrostatic interactions.

Electrochemical Properties of Hydrogen-Storage Alloys ZrMn{sub 2}Ni{sub x} and ZrMnNi{sub 1+x} for Ni-MH Secondary Battery

Energy Technology Data Exchange (ETDEWEB)

Park, Hye Ryoung [Faculty of Applied Chemistry, Chonnam National University, Kwangju (Korea); Kwon, Ik Hyun [Automobile High-Technology Research Institute, Division of Advanced Materials Engineering, Chonbuk National University, Chonju (Korea)

2001-04-01

In order to improve the performance of AB{sub 2}-type hydrogen-storage alloys for Ni-MH secondary battery, AB{sub 2}-type alloys, ZrMn{sub 2}Ni{sub x}(x=0.0, 0.3, 0.6, 0.9 and 1.2) and ZrMnNi{sub 1+x}(x=0.0, 0.1, 0.2, 0.3 and 0.4) were prepared as the Zr-Mn-Ni three component alloys. The hydrogen-storage and the electrochemical properties were investigated. The C14 Laves phase formed in all alloys of ZrMn{sub 2}Ni{sub x}(x=0.0 {approx} 1.2). The equilibrium plateau pressure of the alloy, ZrMn{sub 2}Ni{sub 0.6}-H{sub 2} system, was about 0.5 atm at 30 degree C. Among these alloys, ZrMn{sub 2}Ni{sub 0.6} was the easiest to activate, and it had the largest discharge capacity as well as the best cycling performance. The C14 Laves phase also formed in all alloys of ZrMnNi{sub 1+x}(x=0.0 {approx} 0.4). The equilibrium plateau pressure of the alloy, ZrMnNi{sub 1.0}-H{sub 2} system, was about 0.45 atm at 30 degree C. Among these alloys, ZrMnNi{sub 1.0} was the easiest to activate, taking only 3 charge-discharge cycles, and it had the largest discharge capacity of 42 mAh/g. Among these alloys, ZrMn{sub 2}Ni{sub x}(x=0.0 {approx} 1.2) and ZrMnNi{sub 1+x}(x=0.0 {approx} 0.4), ZrMnNi{sub 1.0} had the largest discharge capacity (maximum value of 42 mAh/g), and it showed the fastest activation and good cycling performance. 23 refs., 4 figs., 2 tabs.

Liquid Phase Sintering of (Ti,Zr)C with WC-Co.

Science.gov (United States)

Ma, Taoran; Borrajo-Pelaez, Rafael; Hedström, Peter; Blomqvist, Andreas; Borgh, Ida; Norgren, Susanne; Odqvist, Joakim

2017-01-11

(Ti,Zr)C powder was sintered with WC-Co following an industrial process, including an isotherm at 1410 °C. A series of interrupted sintering trials was performed with the aim of studying the sintering behavior and the microstructural evolution during both solid-state and liquid-state sintering. Reference samples, using the same elemental compositions but with the starting components TiC and ZrC instead of (Ti,Zr)C, were also sintered. The microstructure was investigated using scanning electron microscopy and energy dispersive X-ray spectroscopy. It is found that the (Ti,Zr)C phase decomposes into Ti-rich and Zr-rich nano-scale lamellae before the liquid-state of the sintering initiates. The final microstructure consists of the binder and WC as well as two different γ phases, rich in either Ti (γ₁) or Zr (γ₂). The γ₂ phase grains have a core-shell structure with a (Ti,Zr)C core following the full sintering cycle. The major differences observed in (Ti,Zr)C with respect to the reference samples after the full sintering cycle were the referred core-shell structure and the carbide grain sizes; additionally, the microstructural evolution during sintering differs. The grain size of carbides (WC, γ₁, and γ₂) is about 10% smaller in WC-(Ti,Zr)C-Co than WC-TiC-ZrC-Co. The shrinkage behavior and hardness of both composites are reported and discussed.

Liquid Phase Sintering of (Ti,ZrC with WC-Co

Directory of Open Access Journals (Sweden)

Taoran Ma

2017-01-01

Full Text Available (Ti,ZrC powder was sintered with WC-Co following an industrial process, including an isotherm at 1410 °C. A series of interrupted sintering trials was performed with the aim of studying the sintering behavior and the microstructural evolution during both solid-state and liquid-state sintering. Reference samples, using the same elemental compositions but with the starting components TiC and ZrC instead of (Ti,ZrC, were also sintered. The microstructure was investigated using scanning electron microscopy and energy dispersive X-ray spectroscopy. It is found that the (Ti,ZrC phase decomposes into Ti-rich and Zr-rich nano-scale lamellae before the liquid-state of the sintering initiates. The final microstructure consists of the binder and WC as well as two different γ phases, rich in either Ti (γ1 or Zr (γ2. The γ2 phase grains have a core-shell structure with a (Ti,ZrC core following the full sintering cycle. The major differences observed in (Ti,ZrC with respect to the reference samples after the full sintering cycle were the referred core-shell structure and the carbide grain sizes; additionally, the microstructural evolution during sintering differs. The grain size of carbides (WC, γ1, and γ2 is about 10% smaller in WC-(Ti,ZrC-Co than WC-TiC-ZrC-Co. The shrinkage behavior and hardness of both composites are reported and discussed.

AMS of 93Zr: Passive absorber versus gas-filled magnet

Science.gov (United States)

Hain, Karin; Deneva, Boyana; Faestermann, Thomas; Fimiani, Leticia; Gómez-Guzmán, José Manuel; Koll, Dominik; Korschinek, Gunther; Ludwig, Peter; Sergeyeva, Victoria; Thiollay, Nicolas

2018-05-01

Two different isobar separation techniques were tested for the detection of the long-lived fission product 93Zr (T1/2 = 1.64 · 106 a) using Accelerator Mass Spectrometry (AMS), i.e. a passive absorber and a gas-filled magnet, respectively. Both techniques were used in combination with a Time-of-Flight path for the identification of the stable neighboring isotopes 92Zr and 94Zr. The passive absorber was represented by a stack of silicon nitride foils for high flexibility regarding the thickness for optimal isobar separation. Ion beams with a large variety of energies, between 80 and 180 MeV, were provided for this experiment by the tandem accelerator at the Maier-Leibnitz Laboratory in Garching, Germany. With these beams, the stopping powers of 93Zr and 93Nb as a function of energy were determined experimentally and compared to the results obtained with the simulation program SRIM. Considerable discrepancies regarding the energy dependence of the two stopping power curves relative to each other were found. The lowest detection limit for 93Zr achieved with the passive absorber setup was 93Zr/Zr = 1 · 10-10. In comparison, by optimizing the gas-filled magnet set-up, 93Nb was suppressed by around six orders of magnitude and a detection limit of 93Zr/Zr = 5 · 10-11 was obtained. To our knowledge, these results represent the lowest detection limit achieved for 93Zr until now.

Tuning of optical mode magnetic resonance in CoZr/Ru/CoZr synthetic antiferromagnetic trilayers by oblique sputtering

Science.gov (United States)

Wang, Wenqiang; Wang, Fenglong; Cao, Cuimei; Li, Pingping; Yao, Jinli; Jiang, Changjun

2018-04-01

CoZr/Ru/CoZr synthetic antiferromagnetic trilayers with strong antiferromagnetic interlayer coupling were fabricated by an oblique sputtering method that induced in-plane uniaxial magnetic anisotropy. A microstrip method using a vector network analyzer was applied to investigate the magnetic resonance modes of the trilayers, including the acoustic modes (AMs) and the optical modes (OMs). At zero magnetic field, the CoZr/Ru/CoZr trilayers showed OMs with resonance frequencies of up to 7.1 GHz. By increasing the applied external magnetic field, the magnetic resonance mode can be tuned to various OMs, mixed modes, and AMs. Additionally, the magnetic resonance mode showed an angular dependence between the magnetization and the microwave field, which showed similar switching of the magnetic modes with variation of the angle. Our results provide important information that will be helpful in the design of multifunctional microwave devices.

Fractography of STIR casted Al-ZrO2 composites

International Nuclear Information System (INIS)

Baghchesara, M. A.; Abdizadeh, H.; Baharvandi, H. R.

2009-01-01

In this study, Al-ZrO 2 composites were produced by Vortex method using ZrO 2 powder with 1 micron average diameter as reinforce particles and Al-356 as the matrix metal. The melt composites were stirred for 13 minutes, then casted into a metallic mold. Different samples of 5, 10 and 15 volume percent of ZrO 2 , in different casting temperatures of 750, 850 and 950 d eg C were produced. The latter 2 casting temperatures are not a common practice but were chosen to enhance fluidity. Effects of volume percent of ZrO 2 particles and casting temperature on tensile strength, microstructure, and fracture surfaces of Al-ZrO 2 composites have been investigated. The highest tensile strength was achieved in the specimen containing 15 vol. % ZrO 2 produced at 750 d eg C which shows an increase of 60% in comparison to the Al-356 non-reinforced alloy. Microscopic investigations of fracture surfaces revealed that fracture in a brittle manner with little or no necking happening. By increasing ZrO 2 content and casting temperature, the composites fracture goes in a more severely brittle manner.

Magnetic Compton scattering study of Laves phase ZrFe2 and Sc doped ZrFe2: Experiment and Green function based relativistic calculations

Science.gov (United States)

Bhatt, Samir; Mund, H. S.; Kumar, Kishor; Bapna, Komal; Dashora, Alpa; Itou, M.; Sakurai, Y.; Ahuja, B. L.

2018-05-01

Spin momentum densities of ferromagnetic ZrFe2 and Zr0.8Sc0.2Fe2 have been measured using magnetic Compton scattering with 182.65 keV circularly polarized synchrotron radiations. Site specific spin moments, which are responsible for the formation of total spin moment, have been deduced from Compton line shapes. At room temperature, the computed spin moment of ZrFe2 is found to be slightly higher than that of Sc doped ZrFe2 which is in consensus with the magnetization data. To compare the experimental data, we have also computed magnetic Compton profiles (MCPs), total and partial spin projected density of states (DOS) and the site specific spin moments using spin-polarized relativistic Korringa-Kohn-Rostoker method. It is observed that the spin moment at Fe site is aligned antiparallel to that of Zr site in both ZrFe2 and Zr0.8Sc0.2Fe2. The MCP results when compared with vibrating sample magnetometer based magnetization data, show a very small contribution of orbital moment in the formation of total magnetic moments in both the compounds. The DOS of ferromagnetic ground state of ZrFe2 and Zr0.8Sc0.2Fe2 are interpreted on the basis of a covalent magnetic model beyond the Stoner rigid band model. It appears that on alloying between a magnetic and a non-magnetic partner (with low valence), a polarization develops on the non-magnetic atom which is anti-parallel to that of the magnetic atom.

Effects of vacuum and ageing on Zr4/Cr3 based conversion coatings on aluminium alloys

Science.gov (United States)

Thirupathi, Kalaivanan; Bárczy, Pál; Vad, Kálmán; Csik, Attila; Somosvári, Béla Márton

2018-05-01

In this study, we investigate the impact of ageing and high vacuum on existing environmentally friendly Zr4/Cr3-based conversion coatings. The freshly formed coating undergoes several changes during ageing and exposure to high vacuum. Based on the present data, we propose that the coating formed over AA6082 and AA7075 alloys is sol-gel in nature, confirmed by secondary neutral mass spectroscopy (SNMS) using the depth profiling technique. Our findings reveal that there are elemental level changes that result in shrinkage of the coating. Most Zr ions in the coating are in the solute form, with lesser number of Cr and Al ions that disappear under high vacuum over a certain period of time. The remaining Cr, Zr and O atoms exist in a gelatinous state. During ageing, there is a continuous transition of ions from solute to gelatinous state. In addition, the deposition of coating ions is directly influenced by the substrates and their constituents. The extent of dissolution of aluminium in the conversion bath determines both Zr and Cr ion deposition. For a highly alloyed metal like AA7075, the dissolution rate is disturbed by copper and zinc.

Isobar separation of 93Zr and 93Nb at 24 MeV with a new multi-anode ionization chamber

International Nuclear Information System (INIS)

Martschini, Martin; Buchriegler, Josef; Collon, Philippe; Kutschera, Walter; Lachner, Johannes; Lu, Wenting; Priller, Alfred; Steier, Peter; Golser, Robin

2015-01-01

93 Zr with a half-life of 1.6 Ma is produced with high yield in nuclear fission, and thus should be present as a natural or anthropogenic trace isotope in all compartments of the general environment. Sensitive measurements of this isotope would immediately find numerous applications, however, its detection at sufficiently low levels has not yet been achieved. AMS measurements of 93 Zr suffer from the interference of the stable isobar 93 Nb. At the Vienna Environmental Research Accelerator VERA a new multi-anode ionization chamber was built. It is optimized for isobar separation in the medium mass range and is based on the experience from AMS experiments of 36 Cl at our 3-MV tandem accelerator facility. The design provides high flexibility in anode configuration and detector geometry. After validating the excellent energy resolution of the detector with 36 S, it was recently used to study iron–nickel and zirconium–niobium–molybdenum isobar separation. To our surprise, the separation of 94 Zr (Z = 40) from 94 Mo (Z = 42) was found to be much better than that of 58 Fe (Z = 26) from 58 Ni (Z = 28), despite the significantly larger ΔZ/Z of the latter pair. This clearly contradicts results from SRIM-simulations and suggests that differences in the stopping behavior may unexpectedly favor identification of 93 Zr. At 24 MeV particle energy, a 93 Nb (Z = 41) suppression factor of 1000 is expected based on a synthetic 93 Zr spectrum obtained by interpolation between experimental spectra from the two neighboring stable isotopes 92 Zr and 94 Zr. Assuming realistic numbers for chemical niobium reduction, a detection level of 93 Zr/Zr below 10 −9 seems feasible.

Electronic structure of ZrX2 (X = Se, Te)

Science.gov (United States)

Shkvarin, A. S.; Merentsov, A. I.; Shkvarina, E. G.; Yarmoshenko, Yu. M.; Píš, I.; Nappini, S.; Titov, A. N.

2018-03-01

The electronic structure of the ZrX2 (X = Se, Te) compounds has been studied using photoelectron, resonant photoelectron and X-ray absorption spectroscopy, theoretical calculations of the X-ray absorption spectra, and density of electronic states. It was found that the absorption spectra and valence band spectra are influenced by the chalcogen type. The results of the multiplet calculation of the Zr4+ atom show that the change in the splitting in the crystal field, which is described by the 10Dq parameter, is due to the change in the ratio of covalent and ionic contributions to the chemical bond. The resonance band near the Fermi level in the valence band spectra is observed for ZrTe2 in the Zr 3p-4d resonant excitation mode. The extent of photon energy indicates the charge localization on the Zr atom. Similar resonance band for ZrSe2 is absent; it indicates the presence of a gap at the Fermi level.

Ion conductivities of ZrF4-BaF2-CsF glasses

International Nuclear Information System (INIS)

Kawamoto, Yoji; Nohara, Ichiro

1987-01-01

The glass-forming region in the ZrF 4 -BaF 2 -CsF glass system has been determined and the ac conductivity and the transport number of fluoride ions have been measured. The conductivities of compounds β-Cs 2 ZrF 6 , α-SrZrF 6 , α-BaZrF 6 , β-BaZrF 6 and α-PbZrF 6 have also been measured. These results and a previous study of ZrF 4 -BaF 2 -MF n (M: the groups I-IV metals) glasses revealed the following: (1) the ZrF 4 -BaF 2 -CsF glasses are exclusively fluoride-ion conductors; (2) the ionic conductivities of ZrF 4 -based glasses are predominantly determined by the activation energies for conduction; (3) the activation energy for conduction decreases with an increase in the average polarizability of glass-constituting cations; (4) a decrease in average Zr-F bond length and a lowering of the average F coordination number of Zr are presumed to increase the activation energy for conduction. Principles of developing ZrF 4 -based glasses with higher conductivities have also been proposed. (Auth.)

Zr alkoxide chain effect on the sol-gel synthesis of lithium metazirconate

International Nuclear Information System (INIS)

Pfeiffer, Heriberto; Bosch, Pedro; Bulbulian, Silvia

2003-01-01

Lithium metazirconate (Li 2 ZrO 3 ) was synthesized by the sol-gel method, using four different Zr alkoxides: zirconium ethoxide, zirconium iso-propoxide, zirconium propoxide and zirconium butoxide. The syntheses were made under two different catalytic regimes, acid and basic. The resulting powders were mixtures of Li 2 ZrO 3 and ZrO 2 . The best yield of Li 2 ZrO 3 (100%) was obtained when the sol-gel reaction was developed with lithium methoxide and zirconium ethoxide under acid catalysis regime. This study establishes that, for base-catalyzed reactions the ZrO 2 formation decreases when the alkyl-chain increases in the alkoxides. By contrast, for acid-catalyzed reactions the ZrO 2 formation increases as the alkyl-chain increases. Finally, when Zr propoxide and Zr iso-propoxide were used, the Li 2 ZrO 3 amounts were different due to steric effects

Fast diffusion and nucleation of the amorphous phase in Ni--Zr films

International Nuclear Information System (INIS)

Ehrhart, P.; Averback, R.S.; Hahn, H.; Yadavalli, S.; Flynn, C.P.

1988-01-01

The nucleation of the amorphous phase by solid-state reactions has been investigated on single-crystal Zr films grown by molecular beam epitaxy and covered in situ with either polycrystalline Ni, amorphous (a-) NiZr, or single-crystalline Zr 99 N 01 films. Interfacial reactions were investigated by backscattering analysis or secondary ion mass spectroscopy. The amorphizing reaction occurred only in the specimen with the a-NiZr overlayer, although fast Ni diffusion through the single-crystalline Zr layer was observed in all three specimens. The nucleation behavior of a-NiZr is attributed to the combination of high-Ni and low-Zr mobility in crystalline Zr

Drug Target Identification and Elucidation of Natural Inhibitors for : An Study

Directory of Open Access Journals (Sweden)

Surya Narayan Rath

2016-12-01

Full Text Available Environmental microbes like Bordetella petrii has been established as a causative agent for various infectious diseases in human. Again, development of drug resistance in B. petrii challenged to combat against the infection. Identification of potential drug target and proposing a novel lead compound against the pathogen has a great aid and value. In this study, bioinformatics tools and technology have been applied to suggest a potential drug target by screening the proteome information of B. petrii DSM 12804 (accession No. PRJNA28135 from genome database of National Centre for Biotechnology information. In this regards, the inhibitory effect of nine natural compounds like ajoene (Allium sativum, allicin (A. sativum, cinnamaldehyde (Cinnamomum cassia, curcumin (Curcuma longa, gallotannin (active component of green tea and red wine, isoorientin (Anthopterus wardii, isovitexin (A. wardii, neral (Melissa officinalis, and vitexin (A. wardii have been acknowledged with anti-bacterial properties and hence tested against identified drug target of B. petrii by implicating computational approach. The in silico studies revealed the hypothesis that lpxD could be a potential drug target and with recommendation of a strong inhibitory effect of selected natural compounds against infection caused due to B. petrii, would be further validated through in vitro experiments.

Enhanced critical currents in (Gd,Y)Ba2Cu3Ox superconducting tapes with high levels of Zr addition

Energy Technology Data Exchange (ETDEWEB)

Selvamanickam, V; Chen, Y; Shi, T; Liu, Y; Khatri, ND; Liu, J; Yao, Y; Xiong, X; Lei, C; Soloveichik, S; Galstyan, E; Majkic, G

2013-01-21

The critical current and structural properties of (Gd,Y)BaCuO tapes made by metal organic chemical vapor deposition (MOCVD) with Zr addition levels up to 30 at.% have been investigated. The reduction in critical current beyond the previously optimized Zr addition level of 7.5 at.% was found to be due to structural deterioration of the (Gd,Y)Ba2Cu3Ox film. By a modified MOCVD process,enhanced critical current densities have been achieved with high levels of Zr addition,including 3.83 MA cm(-2) in 15 at.% Zr- added 1.1 mu m thick film at 77 K in zero magnetic field. Critical currents as high as 1072 A/ 12 mm have been reached in (Gd,Y) BaCuO tapes with 15 at.% Zr addition at 30 K in a field of 3 T applied perpendicular to the tape,corresponding to a pinning force value of 268 GN m(-3). The enhanced critical currents achievable with a high density of nanoscale defects by employing high levels of second- phase additions enable the performance targets needed for the use of HTS tapes in coil applications involving high magnetic fields at temperatures below 50 K to be met.

Enhanced critical currents in (Gd,Y)Ba2Cu3Ox superconducting tapes with high levels of Zr addition

International Nuclear Information System (INIS)

Selvamanickam, V; Shi, T; Liu, Y; Khatri, N D; Liu, J; Yao, Y; Galstyan, E; Majkic, G; Chen, Y; Xiong, X; Lei, C; Soloveichik, S

2013-01-01

The critical current and structural properties of (Gd,Y)BaCuO tapes made by metal organic chemical vapor deposition (MOCVD) with Zr addition levels up to 30 at.% have been investigated. The reduction in critical current beyond the previously optimized Zr addition level of 7.5 at.% was found to be due to structural deterioration of the (Gd,Y)Ba 2 Cu 3 O x film. By a modified MOCVD process, enhanced critical current densities have been achieved with high levels of Zr addition, including 3.83 MA cm −2 in 15 at.% Zr-added 1.1 μm thick film at 77 K in zero magnetic field. Critical currents as high as 1072 A/12 mm have been reached in (Gd,Y)BaCuO tapes with 15 at.% Zr addition at 30 K in a field of 3 T applied perpendicular to the tape, corresponding to a pinning force value of 268 GN m −3 . The enhanced critical currents achievable with a high density of nanoscale defects by employing high levels of second-phase additions enable the performance targets needed for the use of HTS tapes in coil applications involving high magnetic fields at temperatures below 50 K to be met. (paper)

Investigations of chemical reactions between U-Zr alloy and FBR cladding materials

International Nuclear Information System (INIS)

Ishii, Tetsuya; Ukai, Shigeharu

2005-07-01

U-Pu-Zr alloys are candidate materials for commercial FBR fuel. However, informations about chemical reactions with cladding materials developed by JNC for commercial FBR have not been well obtained. In this work, the reaction zones formed in four diffusion couples U-10wt.%Zr/PNC-FMS, U-10wt.%Zr/9Cr-ODS, U-10wt.%Zr/12Cr-ODS, and U-10wt.%Zr/Fe at about 1013K have been examined and following results were obtained. 1) At about 1013K, in the U-10wt.%Zr/Fe couple, the liquid phase zones were obtained. In the other couples U-10wt.%Zr/PNC-FMS, U-10wt.%Zr/9Cr-ODS and U-10wt.%Zr/12Cr-ODS, no liquid phase zones were obtained. The obtained chemical reaction zones in the later 3 couples were similar to the reported ones obtained in U-Zr/Fe couples without liquid phase formation. In comparison with the reaction zones obtained in the U-10wt.%Zr/Fe couple, the reaction zones inside cladding materials obtained in the PNC-FMS, 9Cr-ODS, and 12Cr-ODS couples were thin. 2) From the investigations of relationship between the obtained depths of the chemical reaction zones inside cladding materials and composition of the cladding materials, it was considered that the depth of chemical reaction zone would depend on the Cr content of the cladding materials and the depth would decrease with increasing Cr content, resulting in prevention of liquid phase formation. 3) From the investigations of the mechanisms of chemical reactions between U-Pu-Zr/cladding materials, it was considered that the same effect of Cr obtained in the U-Zr/cladding materials would be expected in U-Pu-Zr/cladding materials. Those seemed to indicate that the threshold temperatures of liquid phase formation for U-Pu-Zr/PNC-FMS, U-Pu-Zr/9Cr-ODS, and U-Pu-Zr/12Cr-ODS might be higher than that for U-Pu-Zr/Fe. (author)

Phase equilibria of the Al-Pr-Zr ternary system at 773 K

Energy Technology Data Exchange (ETDEWEB)

She, Jia [Laboratory of Nonferrous Metal Materials and New Processing Technology, Ministry of Education, Guangxi University, Nanning, Guangxi 530004 (China); Zhan, Yongzhong, E-mail: zyzmatres@yahoo.com.c [Laboratory of Nonferrous Metal Materials and New Processing Technology, Ministry of Education, Guangxi University, Nanning, Guangxi 530004 (China); Li, Chunliu [Laboratory of Nonferrous Metal Materials and New Processing Technology, Ministry of Education, Guangxi University, Nanning, Guangxi 530004 (China); Du, Yong; Xu, Honghui; He, Yuehui [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China)

2010-07-30

The phase equilibria of the Al-Pr-Zr ternary system at 773 K have been investigated mainly by means of X-ray powder diffraction (XRD), scanning electron microscopy (SEM) and differential thermal analysis (DTA). The 14 binary compounds, i.e. AlZr{sub 3}, AlZr{sub 2}, Al{sub 2}Zr{sub 3}, Al{sub 3}Zr{sub 4}, AlZr, Al{sub 3}Zr{sub 2}, Al{sub 2}Zr, Al{sub 3}Zr, {alpha}-Al{sub 11}Pr{sub 3}, Al{sub 3}Pr, Al{sub 2}Pr, {beta}-AlPr, AlPr{sub 2} and {beta}-AlPr{sub 3} were confirmed. No binary compound was found in the Pr-Zr binary system. The result shows that the isothermal section of the Al-Pr-Zr ternary system at 773 K consists of 17 single-phase regions, 31 two-phase regions and 15 three-phase regions. All the intermediate compounds phases in this system have not a remarkable solid solution at 773 K. No ternary compound is found in this work.

Experimental investigation of phase equilibria in the Co-Ni-Zr ternary system

Energy Technology Data Exchange (ETDEWEB)

Liu, Xingjun; Yang, Shuiyuan; Yu, Wenjie; Wang, Cuiping [Xiamen Univ. (China). Fujian Key Laboratory of Materials Genome; Xiong, Huaping; Cheng, Yaoyong; Wu, Xin [Beijing Institute of Aeronautical Materials (China). Div. of Welding and Forging

2016-10-15

The phase equilibria of the Co-Ni-Zr ternary system at 1 000 C, 1 100 C and 1 200 C were experimentally investigated by means of back-scattered electron imaging, electron probe microanalysis and X-ray diffraction on the equilibrated ternary alloys. In this study, no ternary compound is found. The (αCo, Ni) phase region extends from the Ni-rich corner to the Co-rich corner with small solubility of Zr at three sections. At 1 000 C and 1 100 C, Ni{sub 5}Zr, Co{sub 2}Zr and Ni{sub 10}Zr{sub 7} phases have large solid solution ranges, but Ni{sub 10}Zr{sub 7} phase disappears at 1 200 C. The Ni{sub 7}Zr{sub 2}, NiZr, Co{sub 11}Zr{sub 2}, Co{sub 23}Zr{sub 6} and CoZr phases exhibit nearly linear compounds in the studied sections, and have large composition ranges. Additionally, some differences in phase relationship exist among the above three isothermal sections.

Low silicon U(Al,Si)3 stabilization by Zr addition

International Nuclear Information System (INIS)

Pizarro, L.M.; Alonso, P.R.; Rubiolo, G.H.

2009-01-01

Previous knowledge states that (U,Zr)Al 3 and U(Al,Si) 3 phases with Zr and Si content higher than 6 at.% (7.7 wt%) and 4 at.% (1.4 wt%), respectively, does not partially transform to UAl 4 at 600 o C. In this work, four alloys within the quaternary system U-Al-Si-Zr were made with a fixed nominal 0.18 at.% (0.1 wt%) Si content in order to assess the synergetic effect of both Zr and Si alloying elements to the thermodynamic stability of the (U,Zr)(Al,Si) 3 phase. Heat treatments at 600 deg. C were undertaken and samples were analyzed by means of XRD, EPMA and EDS techniques. A remarkable conclusion is that addition of 0.3 at.% Si in the (U,Zr)(Al,Si) 3 phase reduces in 2.7 at.% the necessary Zr content to inhibit its transformation to U(Al,Si) 4 .

Band gap tuning of amorphous Al oxides by Zr alloying

DEFF Research Database (Denmark)

Canulescu, Stela; Jones, N. C.; Borca, C. N.

2016-01-01

minimum changes non-linearly as well.Fitting of the energy band gap values resulted in a bowing parameter of 2 eV. The band gap bowing of themixed oxides is assigned to the presence of the Zr d-electron states localized below the conduction bandminimum of anodized Al2O3.......The optical band gap and electronic structure of amorphous Al-Zr mixed oxides, with Zr content ranging from4.8 to 21.9% were determined using vacuum ultraviolet (VUV) and X-ray absorption spectroscopy (XAS). Thelight scattering by the nano-porous structure of alumina at low wavelengths...... was estimated based on the Miescattering theory. The dependence of the optical band gap of the Al-Zr mixed oxides on Zr content deviatesfrom linearity and decreases from 7.3 eV for pure anodized Al2O3 to 6.45 eV for Al-Zr mixed oxide with Zrcontent of 21.9%. With increasing Zr content, the conduction band...

Oxidation behavior of Zr and its alloys

International Nuclear Information System (INIS)

Costa, I.; Ramanathan, L.V.

1984-01-01

The environment effect, material composition, thermal treatment and superficial treatment on the oxidation behavior of Zr, Zircaloy-4 and Zr - 2,5% Nb, in the temperature range of 400 - 900 0 C, by thermogravimetry were studied. (E.G.) [pt

Corrosion Behavior and Oxide Properties of Zr-Nb-Cu and Zr-Nb-Sn Alloy in High Dissolved Hydrogen Primary Water Chemistry

Energy Technology Data Exchange (ETDEWEB)

Lee, Yun Ju; Kim, Tae Ho; Kim, Ji Hyun [UNIST, Ulsan (Korea, Republic of)

2016-05-15

The water-metal interface is regarded as rate-controlling site governing the rapid oxidation transition in high burn-up fuel. And the zirconium oxide is made in water-metal interface and its structure and phase do an important role in terms of oxide properties. During oxidation process, the protective tetragonal oxide layer develops at the interface due to accumulated high stress during oxide growth, and it turns into non-protective monoclinic oxide with increasing oxide thickness, thus decreasing the stress. It has been reported that Nb addition was proven to be very beneficial for increasing the corrosion resistance of the zirconium alloys. From a more recent study, Cu addition in Nb containing Zirconium alloy was reported to be effective for increasing corrosion resistance in water containing B and Li. According to the previous research conducted, Zr-Nb-Cu shows better corrosion resistance than Zircaloy-4. The dissolved hydrogen (DH) concentration is the key issue of primary water chemistry, and the effect of DH concentration on the corrosion rate of nickel based alloy has been researched. However, the effect of DH on the zirconium alloy corrosion mechanism was not fully investigated. In this study, the weight gain measurement, FIB-SEM analysis, and Raman spectroscopic measurement were conducted to investigate the effects of dissolved hydrogen concentration and the chemical composition on the corrosion resistance and oxide phase of Zr-Nb-Cu alloy and Zr-Nb-Sn alloy after oxidizing in a primary water environment for 20 d. The corrosion rate of Zr-Nb-Cu alloy is slow, when it is compared to Zr-Nb-Sn alloy. In SEM images, the oxide thickness of Zr-Nb-Cu alloy is measured to be around 1.06 μm it of Zr-Nb-Sn alloy is measured to be 1.15 μm. It is because of the Segregation made by Sn solute element when Sn solute element oxidized. And according to ex situ Raman spectra, Zr-Nb-Cu alloy oxide has more tetragonal zirconium oxide fraction than Zr-Nb-Sn alloy oxide.

The corrosion behaviour of Zr3Al-based alloys

International Nuclear Information System (INIS)

Murphy, E.V.; Wieler, R.

1977-07-01

The corrosion resistance of several zirconium-aluminum alloys with aluminum contents ranging from 7.6 to 9.6 wt% was examined in 300 deg C and 325 deg C water, 350 deg C and 400 deg C steam and in air and wet CO 2 at 325 deg C and 400 deg C. In the transformed alloys there are three phases present, αZr, Zr 2 Al and Zr 3 Al of which the αZr phase is the least corrosion resistant. The most important factor controlling the corrosion behaviour of these alloys was found to be the size, distribution and amount of the αZr phase in the transformed alloys, which in turn was dependent upon the microstructural scale of the untransformed alloys

Neutron capture cross section of $^{90}$Zr Bottleneck in the s-process reaction flow

CERN Document Server

Tagliente, G; Milazzo, P M; Moreau, C; Aerts, G; Abbondanno, U; Alvarez, H; Alvarez-Velarde, F; Andriamonje, Samuel A; Andrzejewski, J; Assimakopoulos, Panayiotis; Audouin, L; Badurek, G; Baumann, P; Bečvář, F; Berthoumieux, E; Bisterzo, S; Calviño, F; Calviani, M; Cano-Ott, D; Capote, R; Carrapiço, C; Cennini, P; Chepel, V; Chiaveri, Enrico; Colonna, N; Cortés, G; Couture, A; Cox, J; Dahlfors, M; David, S; Dillman, I; Domingo-Pardo, C; Dridi, W; Durán, I; Eleftheriadis, C; Embid-Segura, M; Ferrant, L; Ferrari, A; Ferreira-Marques, R; Furman, W; Gallino, R; Gonçalves, I; Gonzalez-Romero, E; Gramegna, F; Guerrero, C; Gunsing, F; Haas, B; Haight, R; Heil, M; Herrera-Martínez, A; Igashira, M; Jericha, E; Käppeler, F; Kadi, Y; Karadimos, D; Karamanis, D; Kerveno, M; Köhler, P; Kossionides, E; Krtička, M; Lamboudis, C; Leeb, H; Lindote, A; Lopes, I; Lozano, M; Lukic, S; Marganiec, J; Marrone, S; Martínez, T; Massimi, C; Mastinu, P; Mengoni, A; Mosconi, M; Neves, F; Oberhummer, Heinz; O'Brien, S; Pancin, J; Papachristodoulou, C; Papadopoulos, C; Paradela, C; Patronis, N; Pavlik, A; Pavlopoulos, P; Perrot, L; Pigni, M T; Plag, R; Plompen, A; Plukis, A; Poch, A; Praena, J; Pretel, C; Quesada, J; Rauscher, T; Reifarth, R; Rubbia, Carlo; Rudolf, G; Rullhusen, P; Salgado, J; Santos, J; Sarchiapone, L; Savvidis, I; Stéphan, C; Taín, J L; Tassan-Got, L; Tavora, L; Terlizzi, R; Vannini, G; Vaz, P; Ventura, A; Villamarín, D; Vincente, M, C; Vlachoudis, V; Vlastou, R; Voss, F; Walter, S; Wendler, H; Wiescher, M; Wisshak, K

2008-01-01

The neutron capture cross sections of the Zr isotopes have important implications in nuclear astrophysics and for reactor design. The small cross section of the neutron magic nucleus 90Zr, which accounts for more than 50% of natural zirconium represents one of the key isotopes for the stellar s-process, because it acts as a bottleneck in the neutron capture chain between the Fe seed and the heavier isotopes. The same element, Zr, also is an important component of the structural materials used in traditional and advanced nuclear reactors. The (n,γ) cross section has been measured at CERN, using the n_TOF spallation neutron source. In total, 45 resonances could be resolved in the neutron energy range below 70 keV, 10 being observed for the first time thanks to the high resolution and low backgrounds at n_TOF. On average, the Γγ widths obtained in resonance analyses with the R-matrix code SAMMY were 15% smaller than reported previously. By these results, the accuracy of the Maxwellian averaged cross section f...

Development of in-situ ZrC reinforced iron based composites for wear resistance applications

International Nuclear Information System (INIS)

Bandyopadhyay, T.K.; Das, K.

2002-01-01

A common objective behind the processing of iron-based composites is to improve the wear resistance of steels by incorporating some reinforcing phases, e.g., carbides and oxides. In the present investigation, iron-based zirconium carbide reinforced composite is produced by the aluminothermic reduction of zircon sand (ZrSiO 4 ) and blue dust (Fe 2 O 3 ) in the presence of carbon. Aluminothermic reduction of blue dust and zircon sand, being highly exothermic in nature, essentially leads to a self-propagating high-temperature synthesis (SHS) of the Fe-ZrC composite. The as-cast composite is characterized by scanning electron microscopy (SEM) and X-ray diffraction (XRD). The mechanical properties of the composite and the effect of heat treatment on the microstructure are evaluated. The composite possess sufficient hardness and promising abrasive wear resistance property. The abrasive wear resistance property of the Fe-ZrC composite is compared with that of a M2 grade tool material and it is found to be better than the tool material. The composite also possess good high temperature stability. (author)

Microstructure and mechanical properties of Ti-Zr-Cr biomedical alloys.

Science.gov (United States)

Wang, Pan; Feng, Yan; Liu, Fengchao; Wu, Lihong; Guan, Shaokang

2015-06-01

The Ti-15Zr-xCr (0≤x≤10, wt.%) alloys were investigated to develop new biomedical materials. It was found that the phase constitutions and mechanical properties strongly depended on the Cr content. The Ti-15Zr alloy was comprised of α' phase and a small fraction of β phase was detected with adding 1wt.% Cr. With addition of 5wt.% or more, the β phase was completely retained. In addition, the ω phase was detected in the Ti-15Zr-5Cr alloy and Ti-15Zr-7Cr alloy which exhibited the highest compressive Young's modulus and the lowest ductility. On the other hand, all the Ti-15Zr-xCr alloys without ω phase exhibited high microhardness, high yield strength and superior ductility. Furthermore, the elastic energy of Ti-15Zr-10Cr alloy (5.89MJ/m(3)) with only β phase and that of Ti-15Zr-3Cr alloy (4.04MJ/m(3)) with α' phase and small fraction of β phase was higher than the elastic energy of c.p. Ti (1.25MJ/m(3)). This study demonstrated that Ti-15Zr-3Cr alloy and Ti-15Zr-10Cr alloy with superior mechanical properties are potential materials for biomedical applications. Copyright © 2015. Published by Elsevier B.V.

Electrodeposition and characterization of Ni-Mo-ZrO2 composite coatings

Science.gov (United States)

Laszczyńska, A.; Winiarski, J.; Szczygieł, B.; Szczygieł, I.

2016-04-01

Ni-Mo-ZrO2 composite coatings were produced by electrodeposition technique from citrate electrolytes containing dispersed ZrO2 nanopowder. The influence of deposition parameters i.e. concentration of molybdate and ZrO2 nanoparticles in the electrolyte, bath pH and deposition current density on the composition and surface morphology of the coating has been investigated. The structure, microhardness and corrosion properties of Ni-Mo-ZrO2 composites with different molybdenum and ZrO2 content have been also examined. It was found that ZrO2 content in the deposit is increased by rising the nanoparticles concentration in the plating solution up to 20 g dm-3. An increase in molybdate concentration in the electrolyte affects negatively the amount of codeposited ZrO2 nanoparticles. The correlation between the deposition current efficiency and ZrO2 content in the composite coating has been also observed. A decrease in deposition current efficiency leads to deposition of Ni-Mo-ZrO2 composite with low nanoparticles content. This may be explained by formation of higher amounts of gas bubbles on the cathode surface, which prevent the adsorption of ZrO2 nanoparticles on the growing deposit. The XRD analysis revealed that all the studied Ni-Mo-ZrO2 coatings were composed of a single, nanocrystalline phase with FCC structure. It was found that the incorporation of ZrO2 nanoparticles into Ni-Mo alloy matrix affects positively the microhardness and also slightly improves the corrosion properties of Ni-Mo alloy coating.

Effect of thermo-mechanical processing on microstructure and mechanical properties of U - Nb - Zr alloys: Part 2 - U - 3 wt % Nb - 9 wt % Zr and U - 9 wt% Nb - 3 wt% Zr

Science.gov (United States)

Morais, Nathanael Wagner Sales; Lopes, Denise Adorno; Schön, Cláudio Geraldo

2018-04-01

The present work is the second and final part of an extended investigation on Usbnd Nb - Zr alloys. It investigates the effect of mechanical processing routes on microstructure of alloys U - 3 wt % Nb - 9 wt % Zr and U - 9 wt% Nb - 3 wt% Zr, through X-ray diffraction and scanning electron microscopy, completing the investigation, which started with alloy U - 6 wt% Nb - 6 wt% Zr in part 1. Mechanical properties are determined using microhardness and bending tests and correlated with the developed microstructures. The results show that processing sequence, in particular the inclusion of a 1000 °C heat treatment step, affects significantly the microstructure and mechanical properties of these alloys alloy in different ways. Microstructural characterization shows that both alloys present significant volume fraction of precipitates of a body-centered cubic (BCC) γ-Nb-Zr rich phase in addition the uranium-rich matrix. Bending tests show that sample ductility does not correlate necessarily with hardness and that the key factor appears to be the amount of the γ-Nb-Zr precipitates, which controls the matrix microstructure. Samples with a monoclinic α″ cellular microstructure and/or with the tetragonally-distorted BCC phase (γ0), although not strictly ductile, showed the largest allowed strains-before-break and complete elastic recovery of the broken pieces, pointing out to the macroscopic observation of superelasticity.

Effect of titanium and calcium oxide additions on Zr2O2 polymorphism during Al2O3+Zr2O2 mixture fusion

International Nuclear Information System (INIS)

Gladkov, V.E.; Zhekhanova, N.B.; Fotiev, A.A.; Viktorov, V.V.; Ivashinnikov, V.T.; Zubov, A.S.

1985-01-01

The effect of titanium and calcium containing additions introduced into the Al 2 O 3 +ZrO 2 melt on the phase composition and temperature ranges of ZrO 2 polymorphous transformation in the material is investigated. It is shown that introducing sponge titanium into the 70Al 2 O 3 +30ZrO 2 prepared composition melt (mass. %) with its subsequent intensive cooling one can conserve upto room temperatures 50-70% of ZrO 2 metastable tetragonal modification and therefore reduce the volume changes causing metal cracking. Calcium oxide doping stabilizes the ZrO 2 cubic modification and reduces α-Al 2 O 3 content due to formation of aluminates

Microstructure and mechanical properties of as-cast Zr-Nb alloys.

Science.gov (United States)

Kondo, Ryota; Nomura, Naoyuki; Suyalatu; Tsutsumi, Yusuke; Doi, Hisashi; Hanawa, Takao

2011-12-01

On the basis of the microstructures and mechanical properties of as-cast Zr-(0-24)Nb alloys the effects of phase constitution on the mechanical properties and magnetic susceptibility are discussed in order to develop Zr alloys for use in magnetic resonance imaging (MRI). The microstructures were evaluated using an X-ray diffractometer, an optical microscope, and a transmission electron microscope; the mechanical properties were evaluated by a tensile test. The α' phase was dominantly formed with less than 6 mass% Nb content. The ω phase was formed in Zr-(6-20)Nb alloys, but disappeared from Zr-22Nb. The β phase dominantly existed in Zr-(9-24)Nb alloys. The mechanical properties as well as the magnetic susceptibility of the Zr-Nb alloys varied depending on the phase constitution. The Zr-Nb alloys consisting of mainly α' phase showed high strength, moderate ductility, and a high Young's modulus, retaining low magnetic susceptibility. Zr-Nb alloys containing a larger volume of ω phase were found to be brittle and, thus, should be avoided, despite their low magnetic susceptibility. When the Zr-Nb alloys consisted primarily of β phase the effect of ω phase weakened the mechanical properties, thereby leading to an increase in ductility, even with an increase in magnetic susceptibility. The minimum value of Young's modulus was obtained for Zr-20Nb, because this composition was the phase boundary between the β and ω phases. However, the magnetic susceptibility of the alloy was half that of Ti-6Al-4V alloys. Zr-Nb alloys consisting of α' or β phase have excellent mechanical properties with low magnetic susceptibility and, thus, these alloys could be useful for medical devices used in MRI. Copyright © 2011 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

Oxidation kinetics of amorphous AlxZr1−x alloys

International Nuclear Information System (INIS)

Weller, K.; Wang, Z.M.; Jeurgens, L.P.H.; Mittemeijer, E.J.

2016-01-01

The oxidation kinetics of amorphous Al x Zr 1−x alloys (solid solution) has been studied as function of the alloy composition (0.26 ≤ x ≤ 0.68) and the oxidation temperature (350 °C ≤ T ≤ 400 °C; at constant pO 2  = 1 × 10 5  Pa) by a combinatorial approach using spectroscopic ellipsometry (SE), Auger electron spectroscopy (AES) depth profiling, transmission electron microscopy (TEM) and X-ray diffraction (XRD) analysis. Thermal oxidation of the am-Al x Zr 1−x alloys results in the formation of an amorphous oxide overgrowth with a thermodynamically preferred singular composition, corresponding to a constant Al ox /Zr ox ratio of 0.5. Both the solubility and the diffusivity of oxygen in the am-Al x Zr 1−x alloy substrate increase considerably with increasing Zr content, in particular for Zr contents above 49 at.% Zr. Strikingly, the oxidation kinetics exhibit a transition from parabolic oxide growth kinetics for Al-rich am-Al x Zr 1−x alloys (x ≥ 0.51) to linear oxide growth kinetics for Zr-rich am-Al x Zr 1−x alloys (x < 0.35). The underlying oxidation mechanism is discussed. It is concluded that the oxidation kinetics of the amorphous Al x Zr 1−x alloys for 0.26 ≤ x ≤ 0.68 and 350 °C ≤ T ≤ 400 °C are governed by: (i) the atomic mobilities of O and Al in the alloy substrate at the reacting oxide/alloy interface, (ii) the solubility of O in the substrate and (iii) the compositional constraint due to the thermodynamically preferred formation of an amorphous oxide phase of singular composition.

Hydrogenation of carbon dioxide towards synthetic natural gas. A route to effective future energy storage

Energy Technology Data Exchange (ETDEWEB)

Schoder, M. [Hochschule Lausitz, Cottbus (Germany); Armbruster, U.; Martin, A. [Rostock Univ. (Germany). Leibniz Institute for Catalysis

2012-07-01

Ni- and Ru-based catalysts are best suited for the so-called Sabatier reaction, i.e., the hydrogenation of CO{sub 2} to synthetic natural gas (SNG). Besides using commercial materials, catalyst syntheses (5 wt% Ru or Ni) were carried out by incipient wetness impregnation of four carriers (TiO{sub 2}, SiO{sub 2}, ZrO{sub 2} and {gamma}-Al{sub 2}O{sub 3}). Some pre-tests revealed that catalysts supported on TiO{sub 2} and SiO{sub 2} mostly produced CO, and therefore, they were not studied in detail. The catalyst tests were carried out in a continuously operated tube reactor at 623-723 K and 1-20 bar. Ru/ZrO{sub 2} and Ni/{gamma}-Al{sub 2}O{sub 3} revealed best catalytic performance at ambient pressure. Methane selectivities of 99.9% at 81.2% CO{sub 2} conversion for Ru/ZrO{sub 2} (623 K) and of 98.9% at 73.8% CO{sub 2} conversion for Ni/{gamma}-Al{sub 2}O{sub 3} (673 K) were obtained. The conversion increased significantly with raising reaction pressure above 10 bar to reach more than 93% for the Ni-containing catalyst and more than 96% for the Zr catalysts. Methane as the target product was formed with a selectivity of 100%. In addition, the catalysts were characterized by various solid-state techniques such as BET, TPR, ICP-OES, XRD, XPS and TEM. (orig.)

Almost 'magnetic dead' of the Co layer in Co/Zr sub 3 superlattice

CERN Document Server

Kwon, Y S; Hong, S C; Lee, Y P

1999-01-01

The magnetic and electronic properties of Co/Zr sub 3 (0001) superlattice and unsupported Co and Zr monolayers (ML) with the hcp bulk Zr two dimensional lattice parameters have been calculated by employing the full potential linearized augmented plane wave (FLAPW) method with general gradient approximation (GGA) for exchange-correlation potential. The unsupported Zr and Co ML were calculated to be stable in paramagnetic and ferromagnetic states, respectively. The magnetic moment of the unsupported Co ML was 2.08 mu B. The Co-Zr interlayer spacing of the Co/Zr sub 3 superlattice was calculated to be reduced significantly by 9.80 % compared to that expected from Co and Zr bulk assuming preservation of the atomic volumes. On the other hand, the Zr-Zr interlayer spacing was calculated to be enhanced by 3.35 % compared to that of bulk Zr. Both of the reduced Zr-Co and the enhanced Zr-Zr interlayer spacings decreased the magnetic moment of Co and eventually led to almost 'magnetic dead' (0.33 mu B). Surprisingly, t...

Experimental investigation of phase equilibria in the Zr-Cu-Ni ternary system

International Nuclear Information System (INIS)

Yang, Mujin; Wang, Cuiping; Yang, Shuiyuan; Shi, Zhan; Han, Jiajia; Liu, Xingjun

2017-01-01

The phase equilibria in the Zr-Cu-Ni ternary system are investigated combined with X-ray diffraction, electron probe micro-analysis and differential scanning calorimetry. Two isothermal sections of the Zr-Cu-Ni ternary system at 1 000 C and 1 100 C are experimentally established. Most of the binary intermetallic compounds, e.g. Zr 7 Ni 10 , ZrNi, ZrNi 5 , Zr 14 Cu 51 , and Zr 2 Cu 9 , show a remarkable ternary solubility. A new ternary compound named τ 3 (Zr 31.1-30.7 . Cu 28.5-40.3 Ni 40.4-29.0 ) is detected at 1 000 C and dissolved at 1 020 C because the nearby large liquid phase field further expands. The newly determined phase equilibria will provide important information for both thermodynamic assessment and alloy design of Zr-based metallic glass.

ZrFsy1, a high-affinity fructose/H+ symporter from fructophilic yeast Zygosaccharomyces rouxii.

Directory of Open Access Journals (Sweden)

Maria José Leandro

Full Text Available Zygosaccharomyces rouxii is a fructophilic yeast than can grow at very high sugar concentrations. We have identified an ORF encoding a putative fructose/H(+ symporter in the Z. rouxii CBS 732 genome database. Heterologous expression of this ORF in a S. cerevisiae strain lacking its own hexose transporters (hxt-null and subsequent kinetic characterization of its sugar transport activity showed it is a high-affinity low-capacity fructose/H(+ symporter, with Km 0.45 ± 0.07 mM and Vmax 0.57 ± 0.02 mmol h(-1 (gdw(-1. We named it ZrFsy1. This protein also weakly transports xylitol and sorbose, but not glucose or other hexoses. The expression of ZrFSY1 in Z. rouxii is higher when the cells are cultivated at extremely low fructose concentrations (<0.2% and on non-fermentable carbon sources such as mannitol and xylitol, where the cells have a prolonged lag phase, longer duplication times and change their microscopic morphology. A clear phenotype was determined for the first time for the deletion of a fructose/H(+ symporter in the genome where it occurs naturally. The effect of the deletion of ZrFSY1 in Z. rouxii cells is only evident when the cells are cultivated at very low fructose concentrations, when the ZrFsy1 fructose symporter is the main active fructose transporter system.

Evaluation of cross sections for neutron monitor reactions {sup 90}Zr(n,x){sup 89,88}Zr, {sup 88,87,86}Y from threshold to 100 MeV

Energy Technology Data Exchange (ETDEWEB)

Baosheng, Yu; Qingbiao, Shen; Dunjiu, Cai [Chinese Nuclear Data Center, Beijing, BJ (China)

1996-06-01

The cross sections for {sup 90}Zr(n,x){sup 89,88}Zr and {sup 90}Zr(n,x){sup 88,87,86}Y reactions in intermediate energy region are useful in neutron field monitor, safety and material damage research. Below 20 MeV, the evaluated cross sections for {sup 90}Zr(n,2n){sup 89}Zr reaction are recommended based on the recent experimental data, including the new measured results in CIAE (Above 20 MeV). The measured cross sections are still insufficient to do evaluation. So the evaluation for {sup 90}Zr(n,x){sup 89,88}Zr and {sup 90}Zr(n,x){sup 88,87,86}Y reactions from threshold to 100 MeV are based on experimental and calculated data. (2 figs.).

Characterization of laves phases in the pseudobinary Zr Cr2-Zr Fe2 system by Moessbauer spectroscopy

International Nuclear Information System (INIS)

Kanter, F.L. de; Badler, C.S.; Granovski, M.; Arias, D.

1988-01-01

57 Fe Moessbauer spectroscopy together with XRD and optical metallography were used to verify the two phase boundaries of the ZrCr 2 -ZrFe 2 pseudobinary phase diagram. Samples with adequate ternary and binary composition, treated at 1450 0 C, were studied. Experimental results indicate that in some cases the two phase boundaries should be modified. (author)

Precipitation in cold-rolled Al–Sc–Zr and Al–Mn–Sc–Zr alloys prepared by powder metallurgy

International Nuclear Information System (INIS)

Vlach, M.; Stulikova, I.; Smola, B.; Kekule, T.; Kudrnova, H.; Danis, S.; Gemma, R.; Ocenasek, V.; Malek, J.; Tanprayoon, D.; Neubert, V.

2013-01-01

The effects of cold-rolling on thermal, mechanical and electrical properties, microstructure and recrystallization behaviour of the AlScZr and AlMnScZr alloys prepared by powder metallurgy were studied. The powder was produced by atomising in argon with 1% oxygen and then consolidated by hot extrusion at 350 °C. The electrical resistometry and microhardness together with differential scanning calorimetry measurements were compared with microstructure development observed by transmission and scanning electron microscopy, X-ray diffraction and electron backscatter diffraction. Fine (sub)grain structure developed and fine coherent Al 3 Sc and/or Al 3 (Sc,Zr) particles precipitated during extrusion at 350 °C in the alloys studied. Additional precipitation of the Al 3 Sc and/or Al 3 (Sc,Zr) particles and/or their coarsening was slightly facilitated by the previous cold rolling. The presence of Sc,Zr-containing particles has a significant antirecrystallization effect that prevents recrystallization at temperatures minimally up to 420 °C. The precipitation of the Al 6 Mn- and/or Al 6 (Mn,Fe) particles of a size ∼ 1.0 μm at subgrain boundaries has also an essential antirecrystallization effect and totally suppresses recrystallization during 32 h long annealing at 550 °C. The texture development of the alloys seems to be affected by high solid solution strengthening by Mn. The precipitation of the Mn-containing alloy is highly enhanced by a cold rolling. The apparent activation energy of the Al 3 Sc particles formation and/or coarsening and that of the Al 6 Mn and/or Al 6 (Mn,Fe) particle precipitation in the powder and in the compacted alloys were determined. The cold deformation has no effect on the apparent activation energy values of the Al 3 Sc-phase and the Al 6 Mn-phase precipitation. - Highlights: • The Mn, Sc and Zr additions to Al totally suppresses recrystallization at 550 °C. • The Sc,Zr-containing particle precipitation is slightly facilitated by

Structural investigation of Fe(Cu)ZrB amorphous alloy

International Nuclear Information System (INIS)

Duhaj, P.; Janickovic, D.

1996-01-01

The crystallization process in Fe 86 (Cu 1 )Zr 7 B 6 and Fe 87 Zr 7 B 6 is investigated using the methods of transmission electron microscopy, electron and X-ray diffraction and resistometry. Two crystallization reactions take place during thermal annealing of amorphous Fe 86 (Cu 1 )Zr 7 B 6 and Fe 87 Zr 7 B 6 alloys. In both alloys the first crystallization begins with the formation of nanocrystalline α-Fe at temperature to approximately 800 K. The second crystallization starts above 1000 K; the nanocrystalline phase dissolves and together with the remaining amorphous matrix form rough grains of α-Fe and dispersed Fe 23 Zr 6 phases. From Moessbauer spectroscopy it seems that there exist two neighbourhoods of Fe atoms in the amorphous structure. One of them is characterized by low Zr content and is responsible for the high-field component of the hyperfine field distribution p(H). The second one is rich in Zr and B and is responsible for the low-field component of p(H). This is in accord with the observation of two crystallization steps separated by a large interval of temperatures due to the existence of two chemically different regions or clusters. (orig.)

Surface Characterization of ZrO2/Zr Coating on Ti6Al4V and IN VITRO Evaluation of Corrosion Behavior and Biocompatibility

Science.gov (United States)

Wang, Ruoyun; Sun, Yonghua; He, Xiaojing; Gao, Yuee; Yao, Xiaohong

Biocompatibility is crucial for implants. In recent years, numerous researches were conducted aiming to modify titanium alloys, which are the most extensively used materials in orthopedic fields. The application of zirconia in the biomedical field has recently been explored. In this study, the biological ZrO2 coating was synthesized on titaniumalloy (Ti6Al4V) substrates by a duplex-treatment technique combining magnetron sputtering with micro-arc oxidation (MAO) in order to further improve the corrosion resistance and biocompatibility of Ti6Al4V alloys. The microstructures and phase constituents of the coatings were characterized by scanning electron microscope (SEM) equipped with energy dispersive spectroscopy (EDS) and X-ray diffraction (XRD), the surface wettability was evaluated by contact angle measurements. The results show that ZrO2 coatings are porous with pore sizes less than 2μm and consist predominantly of the tetragonal ZrO2 (t-ZrO2) and cubic ZrO2(c-ZrO2) phase. Electrochemical tests indicate that the corrosion rate of Ti6Al4V substrates is appreciably reduced after surface treatment in the phosphate buffer saline (PBS). In addition, significantly improved cell adhesion and growth were observed from the ZrO2/Zr surface. Therefore, the hybrid approach of magnetron sputtering and MAO provides a surface modification for Ti6Al4V to achieve acceptable corrosion resistance and biocompatibility.

Thermo-chemical properties and electrical resistivity of Zr-based arsenide chalcogenides

Directory of Open Access Journals (Sweden)

A. Schlechte, R. Niewa, M. Schmidt, G. Auffermann, Yu. Prots, W. Schnelle, D. Gnida, T. Cichorek, F. Steglich and R. Kniep

2007-01-01

Full Text Available Ternary phases in the systems Zr–As–Se and Zr–As–Te were studied using single crystals of ZrAs1.40(1Se0.50(1 and ZrAs1.60(2Te0.40(1 (PbFCl-type of structure, space group P4/nmm as well as ZrAs0.70(1Se1.30(1 and ZrAs0.75(1Te1.25(1 (NbPS-type of structure, space group Immm. The characterization covers chemical compositions, crystal structures, homogeneity ranges and electrical resistivities. At 1223 K, the Te-containing phases can be described with the general formula ZrAsxTe2−x, with 1.53(1≤x≤1.65(1 (As-rich and 0.58(1≤x≤0.75(1 (Te-rich. Both phases are located directly on the tie-line between ZrAs2 and ZrTe2, with no indication for any deviation. Similar is true for the Se-rich phase ZrAsxSe2−x with 0.70(1≤x≤0.75(1. However, the compositional range of the respective As-rich phase ZrAsx−ySe2−x (0.03(1≤y≤0.10(1; 1.42(1≤x≤1.70(1 is not located on the tie-line ZrAs2–ZrSe2, and exhibits a triangular region of existence with intrinsic deviation of the composition towards lower non-metal contents. Except for ZrAs0.75Se1.25, from the homogeneity range of the Se-rich phase, all compounds under investigation show metallic characteristics of electrical resistivity at temperatures >20 K. Related uranium and thorium arsenide selenides display a typical magnetic field-independent rise of the resistivity towards lower temperatures, which has been explained by a non-magnetic Kondo effect. However, a similar observation has been made for ZrAs1.40Se0.50, which, among the Zr-based arsenide chalcogenides, is the only system with a large concentration of intrinsic defects in the anionic substructure.

Harnessing the fruits of nature for the development of multi-targeted cancer therapeutics.

Science.gov (United States)

Sarkar, Fazlul H; Li, Yiwei

2009-11-01

Cancer cells exhibit deregulation in multiple cellular signaling pathways. Therefore, treatments using specific agents that target only one pathway usually fail in cancer therapy. The combination treatments using chemotherapeutic agents with distinct molecular mechanisms are considered more promising for higher efficacy; however, using multiple agents contributes to added toxicity. Emerging evidence has shown that some "natural products" such as isoflavones, indole-3-carbinol (I3C) and its in vivo dimeric product 3,3'-diindolylmethane (DIM), and curcumin among many others, have growth inhibitory and apoptosis inducing effects on human and animal cancer cells mediated by targeting multiple cellular signaling pathways in vitro without causing unwanted toxicity in normal cells. Therefore, these non-toxic "natural products" from natural resources could be useful in combination with conventional chemotherapeutic agents for the treatment of human malignancies with lower toxicity and higher efficacy. In fact, recently increasing evidence from pre-clinical in vivo studies and clinical trials have shown some success in support of the use of rational design of multi-targeted therapies for the treatment of cancers using conventional chemotherapeutic agents in combination with "natural products". These studies have provided promising results and further opened-up newer avenues for cancer therapy. In this review article, we have succinctly summarized the known effects of "natural products" especially by focusing on isoflavones, indole-3-carbinol (I3C) and its in vivo dimeric product 3,3'-diindolylmethane (DIM), and curcumin, and provided a comprehensive view on the molecular mechanisms underlying the principle of cancer therapy using combination of "natural products" with conventional therapeutics.

Deuterium absorption property of Al/Zr-V/Mo multifilms

International Nuclear Information System (INIS)

Wang Haifeng; Peng Shuming; Zhang Xiaohong; Long Xinggui; Yang Benfu

2005-01-01

Deuterium absorption property of Al/Zr-V/Mo multifilms was studied experimentally to explore the effect of Al film. There is only one desorption peak at 320 degree C for Al film, two desorption peaks at 220 degree C and 350 degree C for Zr-V film. When the average thickness of Al film is less than 0.6 μm, the desorption property of Al/Zr-V multifilms is just as Zr-V film, when it is more than 0.6 μm, just as Al film. Deuterium absorption by Al/Zr-V multifilms decreases as the thickness of Al film increases until 0.7 μm, then the deuterium absorption no longer changes significantly. The Al film of multifilms cracks on desorbing, so the absorption rate varies as Zr-V film when the thickness of Al film is less than 0.6 μ. When the thickness of Al film is more than 0.6 μm, the deuterium absorption rate of multifilm does not change with the thickness of Al film. (author)

Densification and Mechanical Properties of ZrN-Nb Composites

Directory of Open Access Journals (Sweden)

ZHANG Yan

2018-02-01

Full Text Available Densification of zirconium nitride (ZrN ceramics was investigated by vacuum hot pressing at temperatures range from 1500℃to 2000℃with Nb as sintering additive. Densification was enhanced with Nb addition. ZrN with 5mol% Nb addition achieved a relative density of 98.5% at 1600℃.XRD and lattice parameter measurements indicated that there were structural differences between samples sintered in different temperatures. It was likely that due to the presence of point defects by changes in stoichiometry, the kinetics of mass transport enhanced. As a result, the relative density of the zirconium nitride (ZrN ceramics have been improved, thus the fully densed ZrN ceramics can be prepared in a relative low temperature. The density, the room-temperature mechanical properties of ZrN ceramics are increased after the addition of Nb. Zirconium nitride (ZrNdoped with Nb sintered at 1600℃ are measured and obtained elasticity modulus of 238 GPa, flexural strength of 463.3 MPa, fracture toughness of 7.0 MPa·m1/2 and hardness of 10.7 GPa.

Laser and electron beam welding study on niobium based Nb-1Zr-0.1C alloy

International Nuclear Information System (INIS)

Badgujar, B.P.; Kushwaha, R.P.; Tewari, R.; Dey, G.K.

2016-01-01

The refractory metal based alloys are most suitable for the structural applications in high temperature reactors envisaged to operate at temperature higher than 1000°C. The Nb-1Zr-0.1C (wt. %) is being considered for structural applications in the proposed Compact High Temperature Reactors (CHTR). The welding of this alloy is a difficult task due to its reactive nature and higher thermal conductivity. Laser and Electron Beam (EB) welds were produced on sheet of Nb-1Zr-0.1C alloy at various processing parameters and their effects on weld quality was studied by characterizing their optical and SEM micrographs and microhardness profile. The joining efficiency of both welding processes were also studied. The laser welds done in air with argon shielding showed higher hardness values compared to EB welds indicating need for adequate shielding. This study will help to find the optimized welding parameters to produce defect free welds of Nb-1Zr-0.1C alloy. (author)

Investigation of hot- iso-static press process for tungsten target samples

International Nuclear Information System (INIS)

Xu Yongli; Zhang Jinquan; Li Huaqing

2006-01-01

Zr and stainless steel (S.S.) were selected respectively as the cladding materials of W target. The e-beam weld was used to prepare the W-Zr and W-S.S. small samples for hot iso-static press (HIP) process. The technology parameters of HIP were investigated at 1200, 1300, 1400 degree C and 180 MPa, respectively. The micro-morphology of the interface, diffusion depths and composition as well as their micro-hardness were observed and determined. The bonding of W-Zr and W-S.S. is very well under the testing conditions. There is no any pore or micro-crack in the interface, and there is no grain growth of W below 1400 degree C either. The diffusion of Zr to W at the interface of W-Zr is preferred during HIP process, and the diffusion depths under testing conditions are 6-13 μm. The diffusion of W and Fe is considerable at the interface of W-S.S. Its depth is about 13 μm, and the diffusion of Cr and Ni is mall. The hardness at the interface of W-Zr and W-S.S. shows that a diffusion layer is present for both interface. A part of stainless steel cladding was melted after HIP contained the oxygen absorber Zr at 1300 degree C and 180 MPa. Therefore, 1200 degree C and 180 MPa is suitable for W-S.S. without Zr, but 1300 or 1400 degree C and 180 MPa is better for W-Zr. (authors)

Effect of aquatic plants on 95Zr concentration in slightly polluted water

International Nuclear Information System (INIS)

Shi Jianjun; Yang Ziyin; Chen Hui

2004-01-01

Effect of three aquatic plants (Ceratophyllum demersum, Azolla caroliniana and Eichhornia crassipes) on 95 Zr concentration in slightly polluted water was studied by using isotope tracer techniques. The results showed that the aquatic plants had strong ability of 95 Zr concentration in water. The concentration factor (CF) were from 56.78 to 112.94, so three aquatic plants were suggested be bio-indicators for 95 Zr polluted water. The specific activity of 95 Zr in water decreased with time when the aquatic plants were put in slightly 95 Zr polluted water. The descent of specific activity of 95 Zr in water was very quick during the beginning period (0-3d). The time for the specific activity reduced to 50% was only 3 days, indicating that theres aquatic plants could be used to purge slightly 95 Zr polluted water. The effect of Eichhornia crassipes on purging 95 Zr in water was the best among the three aquatic plants. The specific activity of 95 Zr in bottom clay only decreased 5% after putting aquatic plants in water, indicating that desorption of 95 Zr from bottom clay was not easy. As the bottom clay had strong ability of adsorption and fixation to 95 Zr, the effect of aquatic plant on purging 95 Zr adsorbed by bottom clay was not visible

Influence of microstructure on the accelerated corrosion in Zr-Nb alloys

International Nuclear Information System (INIS)

Muller, S; Lanzani, L

2012-01-01

The influence of microstructure on the accelerated corrosion of Zr-1%Nb and Zr-2.5%Nb (CANDU's pressure tube material) has been studied. The behavior of Zircaloy-4 was also studied in order to compare the Zr-Nb alloys with an alloy that does not have niobium as an alloying element. The corrosion tests were carried out in LiOH 0.1M at 340 o C, in LiOH 1M at the same temperature and in steam at 400 o C. The results showed that the behavior of Zr-Nb alloys in steam at 400 o C is similar to that of Zircaloy-4 in this medium. However, Zr-Nb alloys are more sensitive than Zircaloy-4 to the presence of LiOH. The results suggest that the niobium concentration in the matrix is the parameter that defines the oxidation rate in Zr-Nb alloys, while the presence of second phases in these alloys (β--Zr/β-Nb/Zr-Nb-Fe) could be related with the growth of non-protective oxides in LiOH solutions. In LiOH 1M, the corrosion resistance of Zr-Nb alloys is similar to that of Zircaloy-4, except for the Zr-1Nb martensitic material which showed a sharp increase in the oxidation rate in this medium (author)

Direct current magnetron sputtered ZrB{sub 2} thin films on 4H-SiC(0001) and Si(100)

Energy Technology Data Exchange (ETDEWEB)

Tengdelius, Lina, E-mail: lina.tengdelius@liu.se [Department of Physics, Chemistry, and Biology (IFM), Linköping University, SE-581 83 Linköping (Sweden); Samuelsson, Mattias [Impact Coatings AB, Westmansgatan 29, SE-582 16 Linköping (Sweden); Jensen, Jens; Lu, Jun; Hultman, Lars; Forsberg, Urban; Janzén, Erik; Högberg, Hans [Department of Physics, Chemistry, and Biology (IFM), Linköping University, SE-581 83 Linköping (Sweden)

2014-01-01

ZrB{sub 2} thin films have been synthesized using direct current magnetron sputtering from a ZrB{sub 2} compound target onto 4H-SiC(0001) and Si(100) substrates kept at different temperatures (no heating, 400 °C, and 550 °C), and substrate bias voltage (− 20 V to − 80 V). Time-of-flight energy elastic recoil detection analysis shows that all the films are near stoichiometric and have a low degree of contaminants, with O being the most abundant (< 1 at.%). The films are crystalline, and their crystallographic orientation changes from 0001 to a more random orientation with increased deposition temperature. X-ray diffraction pole figures and selected area electron diffraction patterns of the films deposited without heating reveal a fiber-texture growth. Four point probe measurements show typical resistivity values of the films ranging from ∼ 95 to 200 μΩ cm, decreasing with increased growth temperature and substrate bias. - Highlights: • ZrB{sub 2} films have been deposited on 4H-SiC(0001) and Si(100). • Film composition correlates well to that of the target. • Level of contamination in the films is low. • Film resistivity values range from ∼ 95 to 200 μΩ cm.

Analysis of the thermoluminescent properties of the ZrO2-Eu system

International Nuclear Information System (INIS)

Palma P, H. E.

2012-01-01

The zirconia (ZrO 2 ) is one of the ceramic materials more important to industrial and scientific level due to its refractory nature, good mechanical properties, resistance to the heat and oxidation. An application of the ZrO 2 is given in the radiation physics, where has been observed that it presents an optic response when being exposed to an ionizing radiations field (beta and gamma radiation) and non ionizing (UV). Moreover, the studies have shown that this response can be quantified through the thermoluminescent signal emitted by the material after being exposed to a radiation field. And that is possible to modify the sensibility incorporating it dopants such as Eu, Co, Ag, etc. of controlled way. The objective of the present work was to synthesize the systems: ZrO 2 pure and with Eu impurities in controlled concentrations 0, 05, 1.0, 2.0 and 4.0 % in weight through the Sol-gel method. After the synthesis these were analyzed by means of scanning electron microscopy, spectroscopy by X-rays energy dispersion and X-rays diffraction, allowing this way to know the micro-structural and crystalline characteristics which will be decisive in the dosimetric properties of these systems. (Author)

Early Stages of Precipitation Process in Al-(Mn-)Sc-Zr Alloy Characterized by Positron Annihilation

KAUST Repository

Vlach, Martin; Cizek, Jakub; Melikhova, Oksana; Stulikova, Ivana; Smola, Bohumil; Kekule, Tomas; Kudrnova, Hana; Gemma, Ryota; Neubert, Volkmar

2015-01-01

Thermal effects on the precipitation stages in as-cast Al-0.70 at. pct Mn-0.15 at. pct Sc-0.05 at. pct Zr alloy were studied. The role of lattice defects was elucidated by positron annihilation spectroscopy (lifetime and coincidence Doppler broadening) enabling investigation of solutes clustering at the atomic scale. This technique has never been used in the Al-Sc- and/or Al-Zr-based alloys so far. Studies by positron annihilation were combined with resistometry, hardness measurements, and microstructure observations. Positrons trapped at defects are preferentially annihilated by Sc electrons. Lifetime of trapped positrons indicates that Sc atoms segregate at dislocations. Maximum fraction of positrons annihilated by Sc electrons occurring at 453 K (180 °C) suggests that clustering of Sc bound with vacancies takes place. It is followed by peak of this fraction at 573 K (300 °C). A rise of the contribution of trapped positrons annihilated by Zr electrons starting at 513 K (240 °C) and attaining maximum also at 573 K (300 °C) confirms that Zr participates in precipitation of the Al3Sc particles already at these temperatures. The pronounced hardening at 573 K (300 °C) has its nature in the precipitation of the Al3Sc particles with a Zr-rich shell. The contribution of trapped positrons annihilated by Mn electrons was found to be negligible. © 2015, The Minerals, Metals & Materials Society and ASM International.

Early Stages of Precipitation Process in Al-(Mn-)Sc-Zr Alloy Characterized by Positron Annihilation

KAUST Repository

Vlach, Martin

2015-01-29

Thermal effects on the precipitation stages in as-cast Al-0.70 at. pct Mn-0.15 at. pct Sc-0.05 at. pct Zr alloy were studied. The role of lattice defects was elucidated by positron annihilation spectroscopy (lifetime and coincidence Doppler broadening) enabling investigation of solutes clustering at the atomic scale. This technique has never been used in the Al-Sc- and/or Al-Zr-based alloys so far. Studies by positron annihilation were combined with resistometry, hardness measurements, and microstructure observations. Positrons trapped at defects are preferentially annihilated by Sc electrons. Lifetime of trapped positrons indicates that Sc atoms segregate at dislocations. Maximum fraction of positrons annihilated by Sc electrons occurring at 453 K (180 °C) suggests that clustering of Sc bound with vacancies takes place. It is followed by peak of this fraction at 573 K (300 °C). A rise of the contribution of trapped positrons annihilated by Zr electrons starting at 513 K (240 °C) and attaining maximum also at 573 K (300 °C) confirms that Zr participates in precipitation of the Al3Sc particles already at these temperatures. The pronounced hardening at 573 K (300 °C) has its nature in the precipitation of the Al3Sc particles with a Zr-rich shell. The contribution of trapped positrons annihilated by Mn electrons was found to be negligible. © 2015, The Minerals, Metals & Materials Society and ASM International.

Air Plasma-Sprayed La2Zr2O7-SrZrO3 Composite Thermal Barrier Coating Subjected to CaO-MgO-Al2O3-SiO2 (CMAS)

Science.gov (United States)

Cai, Lili; Ma, Wen; Ma, Bole; Guo, Feng; Chen, Weidong; Dong, Hongying; Shuang, Yingchai

2017-08-01

La2Zr2O7-SrZrO3 composite thermal barrier coatings (TBCs) were prepared by air plasma spray (APS). The La2Zr2O7-SrZrO3 composite TBCs covered with calcium-magnesium-aluminum-silicate (CMAS) powder, as well as the powder mixture of CMAS and spray-dried La2Zr2O7-SrZrO3 composite powder, were heat-treated at 1250 °C in air for 1, 4, 8, and 12 h. The phase constituents and microstructures of the reaction products were characterized by x-ray diffraction, scanning electron microscopy, and energy-dispersive spectroscopy. Experimental results showed that the La2Zr2O7-SrZrO3 composite TBCs had higher CMAS resistance than 8YSZ coating. A dense new layer developed between CMAS and La2Zr2O7-SrZrO3 composite TBCs during interaction, and this new layer consisted mostly of apatite (Ca2La8(SiO4)6O2) and c-ZrO2. The newly developed layer effectively protected the La2Zr2O7-SrZrO3 composite TBCs from further CMAS attack.

Highly resolving Rutherford-scattering spectrometry for the study of ZrO2 layer growth in the beginning stage

International Nuclear Information System (INIS)

Vieluf, Maik

2010-06-01

By means of High Resolution Rutherford Backscattering Spectrometry (HR-RBS) the diffusion behaviour and layer growth of ZrO 2 on SiO 2 and TiN in the initial regime were investigated. The analysis of concentration profiles in ultrathin layers and interfaces was the focus of this work, made possible by the excellent depth resolution of less than 0.3 nm near the surface. For the first time a two-dimensional position sensitive semiconductor detector was implemented and characterized in the setup of the HR-RBS for the improvement of the quality of the measurement results. Furthermore, a measurement procedure was put into operation that allowed the reduction of ion induced damage. Through the optimization of the experimental conditions and the development of a program package for the support of the analyst, an efficient measurement procedure could be routinely ensured. At the time of a binary collision between the incident ion and the target element with a small impact factor, the charge state changes frequently, especially due to the abruptly decreasing ion velocity of the projectile and the overlapping of the electron clouds. For HR-RBS with an energy-separating dipole magnet, the charge state distribution of the scattered ions must be known for the interpretation of the measured spectra. For the first time a significant dependence of the charge state distribution of the scattered C ions on the layer thickness as well as atomic number of the detected target elements, here from the fourth subgroup, was demonstrated. This new knowledge allowed systematic investigations of the ZrO 2 layer growth in the initial regime. The ZrO 2 layers were produced by means of the atomic layer deposition (ALD). Based on the evidence for agglomeration of ZrO 2 on SiO 2 a method was introduced, which takes local thickness variations into account during the simulation of the HR-RBS spectra. An accurate statement about the ZrO 2 /SiO 2 interface was possible due to the extraction of the

Experimental investigation of phase equilibria in the Zr-Cu-Ni ternary system

Energy Technology Data Exchange (ETDEWEB)

Yang, Mujin; Wang, Cuiping; Yang, Shuiyuan; Shi, Zhan; Han, Jiajia; Liu, Xingjun [Xiamen Univ. (China). College of Materials and Fujian Provincial Key Lab. of Materials Genome

2017-08-15

The phase equilibria in the Zr-Cu-Ni ternary system are investigated combined with X-ray diffraction, electron probe micro-analysis and differential scanning calorimetry. Two isothermal sections of the Zr-Cu-Ni ternary system at 1 000 C and 1 100 C are experimentally established. Most of the binary intermetallic compounds, e.g. Zr{sub 7}Ni{sub 10}, ZrNi, ZrNi{sub 5}, Zr{sub 14}Cu{sub 51}, and Zr{sub 2}Cu{sub 9}, show a remarkable ternary solubility. A new ternary compound named τ{sub 3} (Zr{sub 31.1-30.7} . Cu{sub 28.5-40.3}Ni{sub 40.4-29.0}) is detected at 1 000 C and dissolved at 1 020 C because the nearby large liquid phase field further expands. The newly determined phase equilibria will provide important information for both thermodynamic assessment and alloy design of Zr-based metallic glass.

Barrier capability of Zr-N films with titanium addition against copper diffusion

International Nuclear Information System (INIS)

Wang Ying; Cao Fei; Yang Xiaodong; Ding Minghui

2009-01-01

Zr-Ti-N film prepared by sputtering deposition has been employed as a potential diffusion barrier for Cu metallization. It is thought that the existing states of Ti and Zr in the films are Ti-N and Zr-N phase in Zr-Ti-N films. Material analysis by XRD, XPS and sheet resistance measurement reveal that the failure of Zr-N film is mainly due to the formation of Cu 3 Si precipitates at the Zr-N/Si interface by Cu diffusion through the grain boundaries or local defects of the Zr-N barrier layer into Si substrate. In conjunction with sheet resistance measurement, XRD and XPS analyses, the Cu/Zr-Ti-N/Si contact system has high thermal stability at least up to 700 deg. C. The incorporation of Ti atoms into Zr-N barrier layer was shown to be beneficial in improving the thermal stability of the Cu/barrier/Si contact system.

Raman Spectra of ZrS2 and ZrSe2 from Bulk to Atomically Thin Layers

Directory of Open Access Journals (Sweden)

Samuel Mañas-Valero

2016-09-01

Full Text Available In the race towards two-dimensional electronic and optoelectronic devices, semiconducting transition metal dichalcogenides (TMDCs from group VIB have been intensively studied in recent years due to the indirect to direct band-gap transition from bulk to the monolayer. However, new materials still need to be explored. For example, semiconducting TMDCs from group IVB have been predicted to have larger mobilities than their counterparts from group VIB in the monolayer limit. In this work we report the mechanical exfoliation of ZrX2 (X = S, Se from bulk down to the monolayer and we study the dimensionality dependence of the Raman spectra in ambient conditions. We observe Raman signal from bulk to few layers and no shift in the peak positions is found when decreasing the dimensionality. While a Raman signal can be observed from bulk to a bilayer for ZrS2, we could only detect signal down to five layers for flakes of ZrSe2. These results show the possibility of obtaining atomically thin layers of ZrX2 by mechanical exfoliation and represent one of the first steps towards the investigation of the properties of these materials, still unexplored in the two-dimensional limit.

Devitrification behavior and glass-forming ability of Cu-Zr-Ag alloys

International Nuclear Information System (INIS)

Louzguine-Luzgin, Dmitri V.; Xie, Guoqiang; Zhang, Wei; Inoue, Akihisa

2007-01-01

This paper presents an influence of Ag addition on the glass-forming ability and devitrification behavior of Cu-Zr glassy alloys on heating. The crystallization kinetics and structure changes in Cu 45 Zr 45 Ag 10 and Cu 35 Zr 45 Ag 20 glassy alloys on heating were studied by X-ray diffraction, transmission electron microscopy, differential scanning and isothermal calorimetry methods. Based on the results obtained one can assume that the improvement of the glass-forming ability of the Cu-Zr alloys by the addition of Ag is connected with a particular crystallization mechanism and a higher reduced glass-transition temperature of the Cu 45 Zr 45 Ag 10 ternary alloy compared to the binary Cu 55 Zr 45 counterpart. As observed in the present work crystallization of the Cu-Zr-Ag alloys is found to cause embitterment of the samples and should be avoided as these alloys are considered to be used as structural materials. The Cu 35 Zr 45 Ag 20 alloy shows possible submicron-scale phase separation upon annealing

Structural investigation of Fe(Cu)ZrB amorphous alloy

Energy Technology Data Exchange (ETDEWEB)

Duhaj, P. [Slovenska Akademia Vied, Bratislava (Slovakia). Fyzikalny Ustav; Matko, I. [Slovenska Akademia Vied, Bratislava (Slovakia). Fyzikalny Ustav; Svec, P. [Slovenska Akademia Vied, Bratislava (Slovakia). Fyzikalny Ustav; Sitek, J. [Department of Nuclear Physics and Technology, Slovak Technical University, 81219 Bratislava (Slovakia); Janickovic, D. [Slovenska Akademia Vied, Bratislava (Slovakia). Fyzikalny Ustav

1996-07-01

The crystallization process in Fe{sub 86}(Cu{sub 1})Zr{sub 7}B{sub 6} and Fe{sub 87}Zr{sub 7}B{sub 6} is investigated using the methods of transmission electron microscopy, electron and X-ray diffraction and resistometry. Two crystallization reactions take place during thermal annealing of amorphous Fe{sub 86}(Cu{sub 1})Zr{sub 7}B{sub 6} and Fe{sub 87}Zr{sub 7}B{sub 6} alloys. In both alloys the first crystallization begins with the formation of nanocrystalline {alpha}-Fe at temperature to approximately 800 K. The second crystallization starts above 1000 K; the nanocrystalline phase dissolves and together with the remaining amorphous matrix form rough grains of {alpha}-Fe and dispersed Fe{sub 23}Zr{sub 6} phases. From Moessbauer spectroscopy it seems that there exist two neighbourhoods of Fe atoms in the amorphous structure. One of them is characterized by low Zr content and is responsible for the high-field component of the hyperfine field distribution p(H). The second one is rich in Zr and B and is responsible for the low-field component of p(H). This is in accord with the observation of two crystallization steps separated by a large interval of temperatures due to the existence of two chemically different regions or clusters. (orig.)

Amorphous-to-Cu51Zr14 phase transformation in Cu60Ti20Zr20 alloy

International Nuclear Information System (INIS)

Cao, Q P; Zhou, Y H; Horsewell, A; Jiang, J Z

2003-01-01

The kinetics of an amorphous-to-Cu 51 Zr 14 phase transformation in an as-cast Cu 60 Ti 20 Zr 20 rod have been investigated by differential scanning calorimetry. The relative volume fractions of the transferred crystalline phase as a function of annealing time, obtained at 713, 716, 723, 728, and 733 K, have been analysed in detail using 14 nucleation and growth models together with the JMA model. A time-dependent nucleation process is revealed. A steady-state nucleation rate of the order of 10 22 - 10 23 nuclei m -3 s -1 in the temperature range 713-733 K and an activation energy of the order of 550 kJmol -1 for the phase transformation in the as-cast Cu 60 Ti 20 Zr 20 rod were detected, for which some possible reasons are suggested

Atomic oxygen adsorption and its effect on the oxidation behaviour of ZrB2-ZrC-SiC in air

International Nuclear Information System (INIS)

Gao Dong; Zhang Yue; Xu Chunlai; Song Yang; Shi Xiaobin

2011-01-01

Research highlights: → Atomic oxygen was adsorbed on the surface of ZrB 2 -ZrC-SiC ceramics. → Atomic oxygen was preferred reacted with borides according to XPS spectra. → The atomic oxygen adsorption is detrimental to the oxidation resistance. → The porosity should be the major reason which provides diffusion path for the atomic oxygen. → The structure evolution of the ceramics during oxidation is analyzed. - Abstract: Atomic oxygen is adsorbed on the surface of the hot-pressed ZrB 2 -ZrC-SiC ceramic composites, and then the ceramic composites are oxidized in air up to 1500 deg. C with the purpose of clarifying the effect of atomic oxygen adsorption on the oxidation behaviour of the ceramic composites. The XPS spectra are employed to identify the adsorption mechanism of atomic oxygen on the surface of the ceramic composites, and the formation of O-B, O-Zr, and O-Si bonds indicates that atomic oxygen is chemically adsorbed on the surface of the ceramic. In addition, atomic oxygen is preferred to be adsorbed on the surface of borides according to the Zr 3d core level spectrum. On the other hand, the atomic oxygen adsorption is detrimental to the oxidation resistance according to experimental results, and the porosity of the ceramic should be the major reason which provides diffusion path for the atomic oxygen. Furthermore, the structure evolution of the ceramic composites during oxidation process is analyzed.

Influenza neuraminidase: a druggable target for natural products.

Science.gov (United States)

Grienke, Ulrike; Schmidtke, Michaela; von Grafenstein, Susanne; Kirchmair, Johannes; Liedl, Klaus R; Rollinger, Judith M

2012-01-01

The imminent threat of influenza pandemics and repeatedly reported emergence of new drug-resistant influenza virus strains demonstrate the urgent need for developing innovative and effective antiviral agents for prevention and treatment. At present, influenza neuraminidase (NA), a key enzyme in viral replication, spread, and pathogenesis, is considered to be one of the most promising targets for combating influenza. Despite the substantial medical potential of NA inhibitors (NAIs), only three of these drugs are currently on the market (zanamivir, oseltamivir, and peramivir). Moreover, sudden changes in NAI susceptibility revealed the urgent need in the discovery/identification of novel inhibitors. Nature offers an abundance of biosynthesized compounds comprising chemical scaffolds of high diversity, which present an infinite pool of chemical entities for target-oriented drug discovery in the battle against this highly contagious pathogen. This review illuminates the increasing research efforts of the past decade (2000-2011), focusing on the structure, function and druggability of influenza NA, as well as its inhibition by natural products. Following a critical discussion of publications describing some 150 secondary plant metabolites tested for their inhibitory potential against influenza NA, the impact of three different strategies to identify and develop novel NAIs is presented: (i) bioactivity screening of herbal extracts, (ii) exploitation of empirical knowledge, and (iii) computational approaches. This work addresses the latest developments in theoretical and experimental research on properties of NA that are and will be driving anti-influenza drug development now and in the near future.

Novel composition above the limit of Bi:Zr solid solution; synthesis and physical properties of Bi1.33Zr0.67O3+δ

International Nuclear Information System (INIS)

Meatza, Iratxe de; Chapman, Jon P.; Mauvy, Fabrice; Larramendi, Jose I. Ruiz de; Arriortua, Maria I.; Rojo, Teofilo

2004-01-01

This paper presents an increase to x = 0.67 of the zirconium content in the conductive Bi 2-x Zr x O 3+δ solid solution. Complete incorporation of Zr in the β III -Bi 2 O 3 structure, confirmed by X-ray powder diffraction, has produced a phase with a lower volume and superior conductivity than those predicted by an earlier study. The observed β III -δ Bi 2-x Zr x O 3+δ phase transition around 730 deg. C has been characterised for the first time and shows a segregation of a mixture of predominantly γ-Bi 2 O 3 and approximately 30% of the ZrO 2 , before total reincorporation of the Zr in the high temperature δ-phase

Thermodynamic study of CVD-ZrO{sub 2} phase diagrams

Energy Technology Data Exchange (ETDEWEB)

Torres-Huerta, A.M., E-mail: atorresh@ipn.m [Research Center for Applied Science and Advanced Technology, Altamira-IPN, Altamira C.P.89600 Tamaulipas (Mexico); Vargas-Garcia, J.R. [Dept of Metallurgical Eng., ESIQIE-IPN, Mexico 07300 D.F. (Mexico); Dominguez-Crespo, M.A. [Research Center for Applied Science and Advanced Technology, Altamira-IPN, Altamira C.P.89600 Tamaulipas (Mexico); Romero-Serrano, J.A. [Dept of Metallurgical Eng., ESIQIE-IPN, Mexico 07300 D.F. (Mexico)

2009-08-26

Chemical vapor deposition (CVD) of zirconium oxide (ZrO{sub 2}) from zirconium acetylacetonate Zr(acac){sub 4} has been thermodynamically investigated using the Gibbs' free energy minimization method and the FACTSAGE program. Thermodynamic data Cp{sup o}, DELTAH{sup o} and S{sup o} for Zr(acac){sub 4} have been estimated using the Meghreblian-Crawford-Parr and Benson methods because they are not available in the literature. The effect of deposition parameters, such as temperature and pressure, on the extension of the region where pure ZrO{sub 2} can be deposited was analyzed. The results are presented as calculated CVD stability diagrams. The phase diagrams showed two zones, one of them corresponds to pure monoclinic phase of ZrO{sub 2} and the other one corresponds to a mix of monoclinic phase of ZrO{sub 2} and graphite carbon.

Effect of nitrogen addition on superelasticity of Ti-Zr-Nb alloys

International Nuclear Information System (INIS)

Tahara, Masaki; Kim, Hee Young; Miyazaki, Shuichi; Inamura, Tomonari; Hosoda, Hideki

2008-01-01

Recently, the Ti-Zr-Nb alloys have been developed as Ni-free shape memory and superelastic alloys. In this study, the effect of Nb and nitrogen (N) contents on martensitic transformation behavior, shape memory effect and superelasticity in Ti-18Zr-(12-16)Nb-(0-1.0)N (at%) alloys were investigated using tensile tests, optical microscopy and X-ray diffraction. Shape memory effect was observed in Ti-18Zr-(12-13)Nb and Ti-18Zr-12Nb-0.5N alloys at room temperature. The superelastic behavior appeared by the increase of Nb or N content. The Ti-18Zr-(14-15)Nb, Ti-18Zr-(13-14)Nb-0.5N and Ti-18Zr-(12-14)Nb-1.0N alloys exhibited the superelasticity at room temperature. The martensitic transformation start temperature (M s ) decreased by 75 K with 1 at% increase of N content for Ti-18Zr-13Nb alloy. The critical stress for slip deformation and the stress for inducing the martensitic transformation increased with increasing N content. The superelastic recovery strain was also increased by adding N. The maximum recovery strain of 5.0% was obtained in the Ti-18Zr-14Nb-0.5N alloy. (author)

Effect of laser fluence on surface, structural and mechanical properties of Zr after irradiation in the ambient environment of oxygen

International Nuclear Information System (INIS)

Jelani, M.; Bashir, S.; Khaleeq-ur Rehman, M.; Ahamad, R.; Ul-Haq, F.; Yousaf, D.; Akram, M.; Afzal, N.; Umer Chaudhry, M.; Mahmood, K.; Hayat, A.; Ahmad, Sajjad

2013-01-01

The laser irradiation effects on surface, structural and mechanical properties of zirconium (Zr) have been investigated. For this purpose, Zr samples were irradiated with Excimer (KrF) laser (λ = 248 nm, τ = 18 ns, repetition rate ∼ 30 Hz). The irradiation was performed under the ambient environment of oxygen gas at filling pressure of 20 torr by varying laser fluences ranging from 3.8 to 5.1 cm -2 . The surface and structural modification of irradiated targets was investigated by scanning electron microscope (SEM) and X-ray diffractometer (XRD). In order to explore the mechanical properties of irradiated Zr, the tensile testing and Vickers micro hardness testing techniques were employed. SEM analysis reveals the grain growth on the irradiated Zr surfaces for all fluences. However, the largest sized grains are grown for the lowest fluence of 3.8 J/cm 2 . With increasing fluence from 4.3 to 5.1 J cm -2 , the compactness and density of grains increase whereas their size decreases. XRD analysis reveals the appearance of new phases of ZrO 2 and Zr 3 O. The variation in the peak intensity is observed to be anomalous whereas decreasing trend in the crystallite size and residual stresses has been observed with increasing fluence. Micro hardness analysis reveals the increasing trend in surface hardness with increasing fluence. The tensile testing exhibits the increasing trend of yield stress (YS), decreasing trend of percentage elongation and anomalous behaviour of ultimate tensile strength with increasing fluence. (authors)

Influence of small additions of Sc and Zr on structure and mechanical properties of Al-Zn-Mg-Cu alloy

International Nuclear Information System (INIS)

Kajgorodova, L.I.; Sel'nikhina, E.I.; Tkachenko, E.A.; Senatorova, O.G.

1996-01-01

A study was made into Sc and Zr addition effects on grain structure formation, supersaturated solid solution decomposition and mechanical properties of Al-7%Zn-2%Mg-1.2%Cu alloy. It is shown that grain structure is determined by volume fraction and distribution character of disperse particles of Al 3 Sc and Al 3 (Sc 1-x Zr x ). The reason for additives influence on decomposition kinetics during natural and artificial ageing are revealed. The structural factors responsible for the enhancement of mechanical properties on alloying are discussed. 17 refs.; 5 figs.; 2 tabs

Synthesis and electrical characterization of BaZr0.9Ho0.1O3-δ electrolyte ceramic for IT - SOFCs

Science.gov (United States)

Saini, Deepash S.; Singh, Lalit K.; Bhattacharya, D.

2018-04-01

A cost-effective modified combustion method using citric acid and glycine has recently been developed to synthesize high quality, and nanosized BaZr0.9Ho0.1O3 ceramic powder. BaZr0.9Ho0.1O3-δ ceramic powder was characterized by X-ray diffraction (XRD), high-resolution transmission electron microscopy (HRTEM) and field emission scanning electron microscopy (FESEM). XRD pattern of BaZr0.9Ho0.1O3-δ ceramic sintered at 1600 °C has shown that pure phase of BaZr0.9Ho0.1O3-δ with cubic Pm3¯m space group symmetry. The transmission electron microscopic investigation has shown that the particle size of the powder calcined at 1100 °C was in the range 30-80 nm. The FESEM image of sintered pellet at 1600 °C for 4 h reveals porous nature of BaZr0.9Ho0.1O3-δ with 83.7 relative density. Impedance analysis reveal three type relaxations in the temperature range 250 °C to 500 °C as studied at different frequencies over 100 Hz to 1 MHz in air. The grain boundary conductivity of BaZr0.9Ho0.1O3-δ ceramic is found lower then grain (bulk) conductivity due to core-space charge layer behavior in grain boundary.

Trade-off between Zr Passivation and Sn Doping on Hematite Nanorod Photoanodes for Efficient Solar Water Oxidation: Effects of a ZrO2 Underlayer and FTO Deformation.

Science.gov (United States)

Subramanian, Arunprabaharan; Annamalai, Alagappan; Lee, Hyun Hwi; Choi, Sun Hee; Ryu, Jungho; Park, Jung Hee; Jang, Jum Suk

2016-08-03

Herein we report the influence of a ZrO2 underlayer on the PEC (photoelectrochemical) behavior of hematite nanorod photoanodes for efficient solar water splitting. Particular attention was given to the cathodic shift in onset potential and photocurrent enhancement. Akaganite (β-FeOOH) nanorods were grown on ZrO2-coated FTO (fluorine-doped tin oxide) substrates. Sintering at 800 °C transformed akaganite to the hematite (α-Fe2O3) phase and induced Sn diffusion into the crystal structure of hematite nanorods from the FTO substrates and surface migration, shallow doping of Zr atoms from the ZrO2 underlayer. The ZrO2 underlayer-treated photoanode showed better water oxidation performance compared to the pristine (α-Fe2O3) photoanode. A cathodic shift in the onset potential and photocurrent enhancement was achieved by surface passivation and shallow doping of Zr from the ZrO2 underlayer, along with Sn doping from the FTO substrate to the crystal lattice of hematite nanorods. The Zr based hematite nanorod photoanode achieved 1 mA/cm(2) at 1.23 VRHE with a low turn-on voltage of 0.80 VRHE. Sn doping and Zr passivation, as well as shallow doping, were confirmed by XPS, Iph, and M-S plot analyses. Electrochemical impedance spectroscopy revealed that the presence of a ZrO2 underlayer decreased the deformation of FTO substrate, improved electron transfer at the hematite/FTO interface and increased charge-transfer resistance at the electrolyte/hematite interface. This is the first systematic investigation of the effects of Zr passivation, shallow doping, and Sn doping on hematite nanorod photoanodes through application of a ZrO2 underlayer on the FTO substrate.

Optical and structural characterization of Ge clusters embedded in ZrO2

OpenAIRE

Agocs, E; Zolnai, Z.; Rossall, A. K.; Van den Berg, Jakob; Fodor, B.; Lehninger, D.; Khomenkova, L.; Ponomaryov, S.; Gudymenko, O.; Yukhymchuk, V.; Kalas, B.; Heitmann, J.; Petrik, P.

2017-01-01

The change of optical and structural properties of Ge nanoclusters in ZrO2 matrix have been investigated by spectroscopic ellipsometry versus annealing temperatures. Radio-frequency top-down magnetron sputtering approach was used to produce the samples of different types, i.e. single-layers of pure Ge, pure ZrO2 and Ge-rich-ZrO2 as well as multi-layers stacked of 40 periods of 5-nm-Ge-rich-ZrO2 layers alternated by 5-nm-ZrO2 ones. Germanium nanoclusters in ZrO2 host were formed by rapid-therm...

Molecular composition of vapor in the NaF-ZrF4 system

International Nuclear Information System (INIS)

Korenev, Yu.M.; Sidorov, L.N.; Rykov, A.N.; Novoselova, A.V.

1980-01-01

The NaF-ZrF 4 system is studied. It is established that Na 2 ZrF 6 , NaZrF 5 , (NaZrF 5 ) 2 , NaZr 2 F 9 complex molecules are present in the saturated vapor alongside with pure components. Partial pressures of all vapor components are determined. The values of partial pressure and evaporation heat have been used to calculate the vapor composition above the system; T-x and P-T projections of the phase diagram of the NaF-ZrF 4 system are plotted

Target discovery focused approaches to overcome bottlenecks in the exploitation of antimycobacterial natural products.

Science.gov (United States)

Baptista, Rafael; Bhowmick, Sumana; Nash, Robert J; Baillie, Les; Mur, Luis Aj

2018-04-01

Tuberculosis is a major global health hazard. The search for new antimycobacterials has focused on such as screening combinational chemistry libraries or designing chemicals to target predefined pockets of essential bacterial proteins. The relative ineffectiveness of these has led to a reappraisal of natural products for new antimycobacterial drug leads. However, progress has been limited, we suggest through a failure in many cases to define the drug target and optimize the hits using this information. We highlight methods of target discovery needed to develop a drug into a candidate for clinical trials. We incorporate these into suggested analysis pipelines which could inform the research strategies to accelerate the development of new drug leads from natural products.

Internal oxidation of laminated ternary Ru–Ta–Zr coatings

Energy Technology Data Exchange (ETDEWEB)

Chen, Yung-I, E-mail: yichen@mail.ntou.edu.tw; Lu, Tso-Shen

2015-10-30

Highlights: • Internal oxidation was observed in annealed and laminated Ru–Ta–Zr coatings. • The oxidized Ru–Ta–Zr coatings comprised three alternately stacked sublayers. • Correlated variations of O{sup 2-} and Zr{sup 4+} binding energies were verified in XPS spectra. - Abstract: Researchers have observed the internal oxidation phenomenon in binary alloy coatings when developing refractory alloy coatings for protective purposes by conducting annealing at high temperatures and in oxygen-containing atmospheres. The coatings were assembled using cyclical gradient concentration deposition during cosputtering by employing a substrate holder rotating at a slow speed. The internally oxidized zone demonstrated a laminated structure, comprising alternating oxygen-rich and oxygen-deficient layers stacked in a general orientation. In the current study, Ru–Ta–Zr coatings were prepared with various stacking sequences during cosputtering. The Ru–Ta–Zr coatings were annealed at 600 °C in an atmosphere continuously purged with 1% O{sub 2}–99% Ar mixed gas for 30 min. A transmission electron microscope was used to examine the periods of the laminated layers and crystallinity of the annealed coatings. Depth profiles produced using an Auger electron spectroscope and X-ray photoelectron spectroscope were used to certify the periodic variation of the related constituents and chemical states of the elements, respectively. The results indicate that the internally oxidized ternary coatings are stacked of Ru-, Ta{sub 2}O{sub 5}-, and ZrO{sub 2}-dominant sublayers and that the stacking sequences of the sublayers affect the crystalline structure of the coatings. Zr is oxidized preferentially in the Ru–Ta–Zr coatings, increasing the surface hardness of the oxidized coatings.

Ab initio hybrid DFT calculations of BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surfaces

Energy Technology Data Exchange (ETDEWEB)

Eglitis, Roberts I., E-mail: rieglitis@gmail.com

2015-12-15

Highlights: • Surface energies for AO{sub 3}-term (111) surfaces are larger than for Ti (Zr)-term surfaces. • A increase of Ti−O (Zr−O) bond covalency near the ABO{sub 3} (111) surface relative to the bulk is observed. • The ABO{sub 3} (111) surface energy is larger than the earlier calculated (001) surface energy. • Band gap for PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surfaces becomes smaller, but for BaTiO{sub 3} (111) larger with respect to the bulk . - Abstract: The results of ab initio calculations for polar BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surfaces using the CRYSTAL code are presented. By means of the hybrid B3LYP approach, the surface relaxation has been calculated for two possible B (B = Ti or Zr) or AO{sub 3} (A = Ba, Pb or Sr) BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surface terminations. According to performed B3LYP calculations, all atoms of the first surface layer, for both terminations, relax inwards. The only exception is a small outward relaxation of the PbO{sub 3}-terminated PbTiO{sub 3} (111) surface upper layer Pb atom. B3LYP calculated surface energies for BaO{sub 3}, PbO{sub 3}, SrO{sub 3} and PbO{sub 3}-terminated BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surfaces are considerably larger than the surface energies for Ti (Zr)-terminated (111) surfaces. Performed B3LYP calculations indicate a considerable increase of Ti−O (Zr−O) chemical bond covalency near the BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surface relative to the BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} bulk. Calculated band gaps at the Γ-point near the PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} (111) surfaces are reduced, but near BaTiO{sub 3} (111) surfaces increased, with respect to the BaTiO{sub 3}, PbTiO{sub 3}, SrZrO{sub 3} and PbZrO{sub 3} bulk band gap at the Γ-point values.

Intermetallic phases in the iron-rich region of the Zr-Fe phase diagram

International Nuclear Information System (INIS)

Granovsky, M.S.; Arias, D.

1996-01-01

Intermetallic phases in the Fe-rich region of the Zr-Fe system are studied by X-ray diffraction and optical and electron microscopy. The chemical composition of each phase has been quantitatively measured in a electron microprobe. The stable phases found in this region are ZrFe 2 , Zr 6 Fe 23 and (αFe). ZrFe 2 is identified as a cubic Laves type phase (C15) and the ZrFe 2 /ZrFe 2 +Zr 6 Fe 23 boundary composition is 73±1 at.% Fe. Zr 6 Fe 23 is a cubic phase of the Th 6 Mn 23 type and its composition is 80.0±1.5 at.% Fe. The eutectic L↔Zr 6 Fe 23 +τ-Fe transformation temperature and composition are 1325 C and 91±1 at.% Fe, respectively. The solubility of Zr in τ-Fe at 1012 C is 500±50 appm and 1000±100 appm close to the eutectic temperature. (orig.)

Experimental determination of liquidus of Fe-Zr by spot technique

International Nuclear Information System (INIS)

Ramakrishna, P.; Samanta, B.; Balakrishnan, S.

2016-01-01

Metallic fuel alloy for fast reactor mainly consist of U-Pu-Zr housed in T91 clad. Study of thermophysical properties of fuel element and cladding material is vital for the fuel designer to optimize the design feature and predict the fuel behavior under reactor operating conditions.To understand the fuel-clad interaction the phase diagram study of Fe-Zr system is very important since future reactors use U-Pu-Zr alloy as fuel and stainless steel as clad. The eutectic temperature in Fe-Zr alloy system has been established experimentally by various methods. Information on the liquidus temperatures of Fe-Zr is scanty in the literature excepting a very few experimental measurements. Hence measurement of liquidus temperatures is very essential to establish the phase diagram. Present work concentrates more on the generation of liquidus data of Fe-Zr binary alloy system by Spot-technique. This is one among the advanced techniques for measuring the solid-liquid phase transition temperatures. (author)

Refining U-Zr-Nb alloys by remelting