Properties of boride-added powder metallurgy magnesium alloys

Science.gov (United States)

Tanaka, Atsushi; Yoshimura, Syota; Fujima, Takuya; Takagi, Ken-ichi

2009-06-01

Magnesium alloys with metallic borides, magnesium diboride (MgB2) or aluminum diboride (AlB2), were investigated regarding their mechanical properties, transverse rupture strength (TRS) and micro Vickers hardness (HV). The alloys were made from pure Mg, Al and B powders by mechanical alloying and hot pressing to have boride content of between 2.0 and 20 vol%. The alloy with AlB2 exhibited an obvious improvement of HV around a boride content of 6 vol% though the other alloy, with MgB2, did not. TRS showed moderate maxima around the same boride content region for the both alloys. X-ray diffraction measurements indicated an intermetallic compound, Mg17Al12, formed in the alloy with AlB2, which was consistent with its higher hardness.

Properties of boride-added powder metallurgy magnesium alloys

International Nuclear Information System (INIS)

Tanaka, Atsushi; Yoshimura, Syota; Fujima, Takuya; Takagi, Ken-ichi

2009-01-01

Magnesium alloys with metallic borides, magnesium diboride (MgB 2 ) or aluminum diboride (AlB 2 ), were investigated regarding their mechanical properties, transverse rupture strength (TRS) and micro Vickers hardness (HV). The alloys were made from pure Mg, Al and B powders by mechanical alloying and hot pressing to have boride content of between 2.0 and 20 vol%. The alloy with AlB 2 exhibited an obvious improvement of HV around a boride content of 6 vol% though the other alloy, with MgB 2 , did not. TRS showed moderate maxima around the same boride content region for the both alloys. X-ray diffraction measurements indicated an intermetallic compound, Mg 17 Al 12 , formed in the alloy with AlB 2 , which was consistent with its higher hardness.

Boron-dependency of molybdenum boride electrocatalysts for the hydrogen evolution reaction

International Nuclear Information System (INIS)

Park, Hyounmyung; Encinas, Andrew; Fokwa, Boniface P.T.; Scheifers, Jan P.; Zhang, Yuemei

2017-01-01

Molybdenum-based materials have been considered as alternative catalysts to noble metals, such as platinum, for the hydrogen evolution reaction (HER). We have synthesized four binary bulk molybdenum borides Mo_2B, α-MoB, β-MoB, and MoB_2 by arc-melting. All four phases were tested for their electrocatalytic activity (linear sweep voltammetry) and stability (cyclic voltammetry) with respect to the HER in acidic conditions. Three of these phases were studied for their HER activity and by X-ray photoelectron spectroscopy (XPS) for the first time; MoB_2 and β-MoB show excellent activity in the same range as the recently reported α-MoB and β-Mo_2C phases, while the molybdenum richest phase Mo_2B show significantly lower HER activity, indicating a strong boron-dependency of these borides for the HER. In addition, MoB_2 and β-MoB show long-term cycle stability in acidic solution. (copyright 2017 Wiley-VCH Verlag GmbH and Co. KGaA, Weinheim)

Boron-dependency of molybdenum boride electrocatalysts for the hydrogen evolution reaction

Energy Technology Data Exchange (ETDEWEB)

Park, Hyounmyung; Encinas, Andrew; Fokwa, Boniface P.T. [Department of Chemistry, University of California, Riverside, CA (United States); Department of Chemical and Environmental Engineering, University of California, Riverside, CA (United States); Scheifers, Jan P.; Zhang, Yuemei [Department of Chemistry, University of California, Riverside, CA (United States)

2017-05-08

Molybdenum-based materials have been considered as alternative catalysts to noble metals, such as platinum, for the hydrogen evolution reaction (HER). We have synthesized four binary bulk molybdenum borides Mo{sub 2}B, α-MoB, β-MoB, and MoB{sub 2} by arc-melting. All four phases were tested for their electrocatalytic activity (linear sweep voltammetry) and stability (cyclic voltammetry) with respect to the HER in acidic conditions. Three of these phases were studied for their HER activity and by X-ray photoelectron spectroscopy (XPS) for the first time; MoB{sub 2} and β-MoB show excellent activity in the same range as the recently reported α-MoB and β-Mo{sub 2}C phases, while the molybdenum richest phase Mo{sub 2}B show significantly lower HER activity, indicating a strong boron-dependency of these borides for the HER. In addition, MoB{sub 2} and β-MoB show long-term cycle stability in acidic solution. (copyright 2017 Wiley-VCH Verlag GmbH and Co. KGaA, Weinheim)

Some physical properties of the higher borides of molybdenum and tungsten

International Nuclear Information System (INIS)

Koval'chenko, M.S.; Bodrova, L.G.; Nemchenko, V.F.; Kolotun, V.F.

1979-01-01

The temperature dependences of the thermal conductivity, the specific electrical resistance, the thermo-e.m.f. and the magnetic susceptibility, together with the variation of magnetic resistance and of Hall constant with the magnetic field strength at liquid nitrogen temperature and at room temperature, for the higher borides Mo 2 B 5 , MoB 4 , W 2 B 5 and WB 4 were studied. Some features of the physical properties of these metallic borides were established. In contrast with the corresponding metals the higher borides are diamagnetic and the Hall constants are negative. The values of the magnetic susceptibility and the Hall constant are larger for the higher borides than for the low borides. As the temperature increased an inversion of the thermo-e.m.f. sign took place and the signs of the thermo-e.m.f. and the Hall constant are different. The values of the magnetic susceptibility of Mo 2 B 5 , MoB 4 and WB 4 were temperature independent. The electronic structure of the compounds studied is discussed briefly. (Auth.)

Development and application of high strength ternary boride base cermets

International Nuclear Information System (INIS)

Takagi, Ken-ichi

2006-01-01

Reaction boronizing sintering is a novel strategy to form a ternary boride coexisting with a metal matrix in a cermet during liquid phase sintering. This new sintering technique has successfully developed world first ternary boride base cermets with excellent mechanical properties such as Mo 2 FeB 2 , Mo 2 NiB 2 and WCoB base ones. In these cermets Mo 2 FeB 2 and Mo 2 NiB 2 base ones consist of a tetragonal M 3 B 2 (M: metal)-type complex boride as a hard phase and a transition metal base matrix. The cermets have already been applied to wear resistant applications such as injection molding machine parts, can making tools, and hot copper extruding dies, etc. This paper focuses on the characteristics, effects of the additional elements on the mechanical properties and structure, and practical applications of the ternary boride base cermets. - Graphical abstract: TRS and hardness of Ni-5B-51Mo-17.5Cr and Ni-5B-51Mo-12.5Cr-5V-xMn mass% cermets as functions of Mn content (Fig. 17)

Properties of boride-added powder metallurgy magnesium alloys

Energy Technology Data Exchange (ETDEWEB)

Tanaka, Atsushi; Yoshimura, Syota; Fujima, Takuya; Takagi, Ken-ichi [Department of Mechanical Engineering, Tokyo City University 1-28-1 Tamazutsumi, Setagaya, Tokyo 158-8557 (Japan)], E-mail: ktakagi@tcu.ac.jp

2009-06-01

Magnesium alloys with metallic borides, magnesium diboride (MgB{sub 2}) or aluminum diboride (AlB{sub 2}), were investigated regarding their mechanical properties, transverse rupture strength (TRS) and micro Vickers hardness (HV). The alloys were made from pure Mg, Al and B powders by mechanical alloying and hot pressing to have boride content of between 2.0 and 20 vol%. The alloy with AlB{sub 2} exhibited an obvious improvement of HV around a boride content of 6 vol% though the other alloy, with MgB{sub 2}, did not. TRS showed moderate maxima around the same boride content region for the both alloys. X-ray diffraction measurements indicated an intermetallic compound, Mg{sub 17}Al{sub 12}, formed in the alloy with AlB{sub 2}, which was consistent with its higher hardness.

Surface oxidation phenomena of boride coatings grown on iron

International Nuclear Information System (INIS)

Carbucicchio, M.; Palombarini, G.; Sambogna, G.

1992-01-01

Very hard boride coatings are grown on various metals using thermochemical as well as chemical vapour deposition techniques. In this way many surface properties, and in particular the wear resistance, can be considerably improved. Usually, also the corrosion behaviour of the treated components is important. In particular, oxidizing atmospheres are involved in many applications where, therefore, coating-environment interactions can play a relevant role. In a previous work, the early stages of the oxidation of iron borides were studied by treating single phase compacted powders in flowing oxygen at low temperatures (300-450deg C). In the present paper, the attention is addressed to the oxidation of both single phase and polyphase boride coatings thermochemically grown on iron. The single phase boride coatings were constituted by Fe 2 B, while the polyphase coatings were constituted by an inner Fe 2 B layer and an outer FeB-base layer. All the boride layers displayed strong (002) preferred crystallographic orientations. (orig.)

Plasma boriding of a cobalt–chromium alloy as an interlayer for nanostructured diamond growth

Energy Technology Data Exchange (ETDEWEB)

Johnston, Jamin M.; Jubinsky, Matthew; Catledge, Shane A., E-mail: catledge@uab.edu

2015-02-15

Highlights: • Metal-boride layer creates a compatible surface for NSD deposition. • PECVD boriding on CoCrMo produces robust metal-boride layer. • Deposition temperature comparison shows 750 °C boriding masks surface cobalt. • EDS shows boron diffusion as well as deposition. • Nanoindentation hardness of CoCrMo substantially increases after boriding. - Abstract: Chemical vapor deposited (CVD) diamond coatings can potentially improve the wear resistance of cobalt–chromium medical implant surfaces, but the high cobalt content in these alloys acts as a catalyst to form graphitic carbon. Boriding by high temperature liquid baths and powder packing has been shown to improve CVD diamond compatibility with cobalt alloys. We use the microwave plasma-enhanced (PE) CVD process to deposit interlayers composed primarily of the borides of cobalt and chromium. The use of diborane (B{sub 2}H{sub 6}) in the plasma feedgas allows for the formation of a robust boride interlayer for suppressing graphitic carbon during subsequent CVD of nano-structured diamond (NSD). This metal–boride interlayer is shown to be an effective diffusion barrier against elemental cobalt for improving nucleation and adhesion of NSD coatings on a CoCrMo alloy. Migration of elemental cobalt to the surface of the interlayer is significantly reduced and undetectable on the surface of the subsequently-grown NSD coating. The effects of PECVD boriding are compared for a range of substrate temperatures and deposition times and are evaluated using glancing-angle X-ray diffraction (XRD), cross-sectional scanning electron microscopy (SEM), energy dispersive X-ray spectroscopy (EDS), and micro-Raman spectroscopy. Boriding of CoCrMo results in adhered nanostructured diamond coatings with low surface roughness.

Anisotropic elastic and thermal properties of titanium borides by first-principles calculations

Energy Technology Data Exchange (ETDEWEB)

Sun, Liang; Gao, Yimin [State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiaotong University, Xi’an 710049 (China); Xiao, Bing [Department of Physics and Quantum Theory Group, School of Science and Engineering, Tulane University, New Orleans, LA 70118 (United States); Li, Yefei, E-mail: yefeili@126.com [State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiaotong University, Xi’an 710049 (China); Wang, Guoliang [State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiaotong University, Xi’an 710049 (China)

2013-12-05

Highlights: •Elastic properties of titanium borides are calculated by first principles calculation. •Thermodynamical stability of titanium borides is analyzed. •Heat capacity and thermal expansion coefficient for titanium borides are calculated and compared. •Grüneisen parameters of titanium borides are calculated. -- Abstract: The anisotropic elastic and thermal expansions of the titanium borides (TiB{sub 2}, Ti{sub 3}B{sub 4}, TiB{sub P}nma and TiB{sub F}m3{sup ¯}m) are calculated from first-principles using density functional theory. All borides show different anisotropic elastic properties; the bulk, shear and Young’s moduli are consistent with those determined experimentally. The temperature dependence of thermal expansions is mainly caused by the restoration of thermal energy due to phonon excitations at low temperature. When the temperature is higher than 500 K, the volumetric coefficient is increased linearly by increasing temperature. Meanwhile, the heat capacities of titanium borides are obtained based on the knowledge of thermal expansion coefficient and the elasticity, the calculations are in good agreement with the experiments.

Tetragonal ternary borides: superconductivity, ferromagnetism and the role of scandium

International Nuclear Information System (INIS)

Matthias, B.T.; Patel, C.K.N.; Barz, H.; Corenzwit, E.; Vandenberg, J.M.

1978-01-01

The authors report and discuss two discoveries made while studying the condensation phenomena of ternary rhodium borides, MRh 4 B 4 . M is generally a trivalent transition metal, usually a rare earth element RE. An exception is scandium which by itself does not form an isomorphous boride, but in combination with many other elements will do just that. A suprising correlation between ferromagnetic and superconducting transition temperatures has been found. (Auth.)

Hardness of carbides, nitrides, and borides

International Nuclear Information System (INIS)

Schroeter, W.

1981-01-01

Intermetallic compounds of metals with non-metals such as C, N, and B show different hardness. Wagner's interaction parameter characterizes manner and extent of the interaction between the atoms of the substance dissolved and the additional elements in metallic mixed phases. An attempt has been made to correlate the hardness of carbides, nitrides, and borides (data taken from literature) with certain interaction parameters and associated thermodynamic quantities (ΔH, ΔG). For some metals of periods 4, 5, and 6 corresponding relations were found between microhardness, interaction parameters, heat of formation, and atomic number

Structure-chemical and metallurgical investigations in boride- and boron nitride systems

International Nuclear Information System (INIS)

Smid, I.

1987-01-01

Thermodynamic phase equilibria in the systems (Ti, Zv, Hf)-B-N were determined in an isothermal cut at 1500 O C and 1 atm. The phase field separation is dominated by the high stability of the metal mononitrides and metal diborides. No ternery compounds were found. There are varying solubilities of B and N in the nitrides and borides. The system Cr-B-N was investigated at 1000 O C under 1 atm argon and vacuum, and at 1400 O C at 1 atm argon and 1 atm nitrogen. For the system Mn-B-N the phase field separation was determined at 900 O C under 1 atm Ar and under vacuum. The properties of hard metals with various binding phases and TiBr as hard constituents were investigated. 6 refs., 6 figs., 6 tabs. (qui)

Preparation of boron-rich aluminum boride nanoparticles by RF thermal plasma

Energy Technology Data Exchange (ETDEWEB)

Choi, Sooseok [Inha University, Department of Chemical Engineering and Regional Innovation Center for Environmental Technology of Thermal Plasma (Korea, Republic of); Matsuo, Jiro; Cheng, Yingying [Tokyo Institute of Technology, Department of Environmental Chemistry and Engineering (Japan); Watanabe, Takayuki, E-mail: watanabe@chemenv.titech.ac.jp [Kyushu University, Department of Chemical Engineering (Japan)

2013-08-15

Boron-rich compounds of AlB{sub 12} and AlB{sub 10} nanoparticles were synthesized by a radiofrequency thermal plasma. Aluminum and boron raw powders were evaporated in virtue of high enthalpy of the thermal plasma in upstream region, followed by the formation of aluminum boride nanoparticles in the tail region of plasma flame with rapid quenching. A high production rate of aluminum boride was confirmed by the X-ray diffraction measurement in the case of high input power, high boron content in raw material and helium inner gas. Polyhedral nanoparticles of 20.8 nm in mean size were observed by a transmission electron microscope. In the raw powder mixture of aluminum, titanium, and boron, titanium-boride nanoparticles were synthesized preferentially, because the Gibbs free energy for the boridation of titanium is lower than that of aluminum. Since the nucleation temperature of boron is higher than that of aluminum, the condensation of metal monomers onto boron nuclei results in the formation of boron-rich aluminum boride nanoparticles.

Growth kinetics of boride coatings formed at the surface AISI M2 during dehydrated paste pack boriding

Energy Technology Data Exchange (ETDEWEB)

Doñu Ruiz, M.A., E-mail: mdonur0800@alumno.ipn.mx [Universidad Politécnica del Valle de México UPVM, Grupo Ciencia e Ingeniería de Materiales, Av. Mexiquense S/N Esquina Av. Universidad Politécnica, Col Villa Esmeralda, 54910 Tultitlan (Mexico); López Perrusquia, N.; Sánchez Huerta, D. [Universidad Politécnica del Valle de México UPVM, Grupo Ciencia e Ingeniería de Materiales, Av. Mexiquense S/N Esquina Av. Universidad Politécnica, Col Villa Esmeralda, 54910 Tultitlan (Mexico); Torres San Miguel, C.R.; Urriolagoitia Calderón, G.M. [Instituto Politécnico Nacional, SEPI-ESIME, Unidad Profesional Adolfo López Mateos Zacatenco, Edificio 5, 2do. Piso, Col. Lindavista, CP 07738 México, D.F. (Mexico); Cerillo Moreno, E.A. [Universidad Politécnica del Valle de México UPVM, Grupo Ciencia e Ingeniería de Materiales, Av. Mexiquense S/N Esquina Av. Universidad Politécnica, Col Villa Esmeralda, 54910 Tultitlan (Mexico); Cortes Suarez, J.V. [Univerisdad Autónoma Metropolitana Unidad Azcapotzalco, Av. San Pablo 180 Azcapotzalco 02200, Área de Ciencia de los Materiales, México, D.F. (Mexico)

2015-12-01

The growth kinetics of the boride coatings (FeB and Fe{sub 2}B) at the surface of AISI M2 high speed steels were studied in this work. Boriding thermochemical treatment was carried out by dehydrated paste pack at three different temperatures 1173, 1223, and 1273 K and four exposure times 1, 3, 5, and 7 h, respectively. The presence of FeB and Fe{sub 2}B phases was identified by scanning electron microscopy with energy dispersive spectroscopy (SEM-EDS) and X-ray diffraction method. In order to obtain the boron diffusion coefficients at the FeB/Fe{sub 2}B boride coatings, a mathematical model based on the mass balance at the growing interfaces was proposed under certain assumptions. Likewise the parabolic growth constants and the boride incubation time were established as a function of the parameters η (T) and ε (T). The activation energy values estimated for the FeB and Fe{sub 2}B layers were 233.42 and 211.89 kJ mol{sup −1} respectively. A good agreement was obtained between the simulated values of boride layer thicknesses and the experimental results. Finally, empirical relationships of boride coating thickness as a function of boriding temperature and time are presented. - Highlights: • Formed boride coatings at the surface of AISI M2 high speed steels by new process dehydrated paste pack boriding. • The model was based on the mass balance equation at the FeB/Fe{sub 2}B and Fe{sub 2}B/Fe interfaces by considering the boride incubation time. • A good agreement was obtained between the simulated values of boride layers coatings and the experimental results.

Kinetics of electrochemical boriding of low carbon steel

International Nuclear Information System (INIS)

Kartal, G.; Eryilmaz, O.L.; Krumdick, G.; Erdemir, A.; Timur, S.

2011-01-01

In this study, the growth kinetics of the boride layers forming on low carbon steel substrates was investigated during electrochemical boriding which was performed at a constant current density of 200 mA/cm 2 in a borax based electrolyte at temperatures ranging from 1123 K to 1273 K for periods of 5-120 min. After boriding, the presence of both FeB and Fe 2 B phases were confirmed by the X-ray diffraction method. Cross-sectional microscopy revealed a very dense and thick morphology for both boride phases. Micro hardness testing of the borided steel samples showed a significant increase in the hardness of the borided surfaces (i.e., up to (1700 ± 200) HV), while the hardness of un-borided steel samples was approximately (200 ± 20) HV. Systematic studies over a wide range of boriding time and temperature confirmed that the rate of the boride layer formation is strongly dependent on boriding duration and has a parabolic character. The activation energy of boride layer growth for electrochemical boriding was determined as (172.75 ± 8.6) kJ/mol.

Synthesis of Magnesium Nickel Boride Aggregates via Borohydride Autogenous Pressure.

Science.gov (United States)

Shahbazi, Mahboobeh; Cathey, Henrietta E; Mackinnon, Ian D R

2018-03-23

We demonstrate synthesis of the ternary intermetallic MgNi₃B₂ using autogenous pressure from the reaction of NaBH₄ with Mg and Ni metal powder. The decomposition of NaBH₄ to H₂ and B₂H₆ commences at low temperatures in the presence of Mg and/or Ni and promotes formation of Ni-borides and MgNi₃B₂ with the increase in temperature. MgNi₃B₂ aggregates with Ni-boride cores are formed when the reaction temperature is >670 °C and autogenous pressure is >1.7 MPa. Morphologies and microstructures suggest that solid-gas and liquid-gas reactions are dominant mechanisms and that Ni-borides form at a lower temperature than MgNi₃B₂. Magnetic measurements of the core-shell MgNi₃B₂ aggregates are consistent with ferromagnetic behaviour in contrast to stoichiometric MgNi₃B₂ which is diamagnetic at room temperature.

Theoretical study of phase stability and elastic properties of T0.75Y0.75B14 (T  =  Sc, Ti, V, Y, Zr, Nb, Si)

International Nuclear Information System (INIS)

Hunold, Oliver; Music, Denis; Schneider, Jochen M

2016-01-01

In this study the phase stability, elastic properties, and plastic behaviour of icosahedral transition metal borides T 0.75 Y 0.75 B 14 (T  =  Sc, Ti, V, Y, Zr, Nb, Si) have been investigated using density functional theory. Phase stability critically depends on the charge transferred by T and Y to the B icosahedra. For the metal sublattice occupancy investigated here, the minimum energy of formation is identified at an effective B icosahedra charge of  −1.8  ±  0.1. This charge corridor encompasses the highest phase stability among all the reported icosahedral transition metal boride systems so far. This data provides guidance for future experimental efforts: from a wear-resistance point of view, Sc 0.75 Y 0.75 B 14 , Ti 0.75 Y 0.75 B 14 , and Zr 0.75 Y 0.75 B 14 exhibit a rather unique and attractive combination of large Young’s modulus values ranging from 488 to 514 GPa with the highest phase stability for icosahedral transition metals borides reported so far. (paper)

Interlayer utilization (including metal borides) for subsequent deposition of NSD films via microwave plasma CVD on 316 and 440C stainless steels

Science.gov (United States)

Ballinger, Jared

. Surface boriding was implemented using the novel method of microwave plasma CVD with a mixture of hydrogen and diborane gases. On 440C bearings, dual phase boride layers of Fe2B and FeB were formed which supported adhered nanostructured diamond films. Continuity of the films was not seamless with limited regions remaining uncoated potentially corresponding to delamination of the film as evidenced by the presence of tubular structures presumably composed of sp2 bonded carbon. Surface boriding of 316 stainless steel discs was conducted at various powers and pressures to achieve temperatures ranging from 550-800 °C. The substrate boriding temperature was found to substantially influence the resultant interlayer by altering the metal boride(s) present. The lowest temperatures produced an interlayer where CrB was the single detected phase, higher temperatures yielded the presence of only Fe2B, and a combination of the two phases resulted from an intermediate boriding temperature. Compared with the more common, commercialized boriding methods, this a profound result given the problems posed by the FeB phase in addition to other advantages offered by CVD processes and microwave generated plasmas in general. Indentation testing of the boride layers revealed excellent adhesion strength for all borided interlayers, and above all, no evidence of cracking was observed for a sole Fe2B phase. As with boriding of 440C bearings, subsequent diamond deposition was achieved on these interlayers with substantially improved adhesion strength relative to diamond coated TiN interlayers. Both XRD and Raman spectroscopy confirmed a nanostructured diamond film with interfacial chromium carbides responsible for enhanced adhesion strength. Interlayers consisting solely of Fe2B have displayed an ability to support fully continuous nanostructured diamond films, yet additional study is required for consistent reproduction. This is in good agreement with initial work on pack borided high alloy steels

Boride particles in a powder metallurgy superalloy

Energy Technology Data Exchange (ETDEWEB)

Witt, M C; Charles, J A

1985-12-01

Using optical and electron metallography, the composition, morphology, and distribution of M/sub 3/B/sub 2/ borides in as-hipped (hot isostatically pressed) samples of the powder metallurgy superalloy Nimonic AP1 have been determined. Two types of boride are present depending on the HIP temperature. Hipping below the boride solvus results in low-aspect ratio particles, distributed both inter- and intragranularly. Hipping above the boride solvus produces high-aspect ratio particles which are exclusively intergranular. A small difference in both lattice parameter and composition has been measured. Electron energy loss spectroscopy of the particles has confirmed the presence of boron, and laser ion-induced mass analysis has indicated a low carbon level. The higher susceptibility to edge cracking during forging of material hipped above the boride solvus is related to the boride morphology. Studies of the subsequent recrystallization of the forged samples have indicated that necklace formation is neither inhibited nor accelerated by the presence of grain boundary borides. 18 references.

Structure of superhard tungsten tetraboride: A missing link between MB2 and MB12 higher borides

Science.gov (United States)

Lech, Andrew T.; Turner, Christopher L.; Mohammadi, Reza; Tolbert, Sarah H.; Kaner, Richard B.

2015-01-01

Superhard metals are of interest as possible replacements with enhanced properties over the metal carbides commonly used in cutting, drilling, and wear-resistant tooling. Of the superhard metals, the highest boride of tungsten—often referred to as WB4 and sometimes as W1–xB3—is one of the most promising candidates. The structure of this boride, however, has never been fully resolved, despite the fact that it was discovered in 1961—a fact that severely limits our understanding of its structure–property relationships and has generated increasing controversy in the literature. Here, we present a new crystallographic model of this compound based on refinement against time-of-flight neutron diffraction data. Contrary to previous X-ray–only structural refinements, there is strong evidence for the presence of interstitial arrangements of boron atoms and polyhedral bonding. The formation of these polyhedra—slightly distorted boron cuboctahedra—appears to be dependent upon the defective nature of the tungsten-deficient metal sublattice. This previously unidentified structure type has an intermediary relationship between MB2 and MB12 type boride polymorphs. Manipulation of the fractionally occupied metal and boron sites may provide insight for the rational design of new superhard metals. PMID:25733870

Electron momentum distribution and electronic response of ceramic borides

Energy Technology Data Exchange (ETDEWEB)

Heda, N.L. [Department of Pure and Applied Physics, University of Kota, Kota 324005 (India); Meena, B.S.; Mund, H.S. [Department of Physics, Mohanlal Sukhadia University, Udaipur 313001 (India); Sahariya, Jagrati [Department of Physics, Manipal University, Jaipur 303007 (India); Kumar, Kishor [Department of Physics, Mohanlal Sukhadia University, Udaipur 313001 (India); Ahuja, B.L., E-mail: blahuja@yahoo.com [Department of Physics, Mohanlal Sukhadia University, Udaipur 313001 (India)

2017-03-15

Isotropic Compton profiles of transition metal based ceramics TaB and VB have been measured using {sup 137}Cs (661.65 keV) γ-ray Compton spectrometer. The experimental momentum densities are compared with those deduced using linear combination of atomic orbitals (LCAO) with Hartree-Fock (HF), density functional theory (DFT) with Wu-Cohen generalized gradient approximation (WCGGA) and also the hybridization of HF and DFT (namely B3PW and PBE0) schemes. It is found that LCAO-DFT-WCGGA scheme based profiles give an overall better agreement with the experimental data, for both the borides. In addition, we have computed the Mulliken's population (MP) charge transfer data, energy bands, density of states and Fermi surface topology of both the borides using full potential-linearized augmented plane wave (FP-LAPW) and LCAO methods with DFT-WCGGA scheme. Cross-overs of Fermi level by the energy bands corresponding to B-2p and valence d-states of transition metals lead to metallic character in both the compounds. Equal-valence-electron-density profiles and MP analysis suggest more ionic character of VB than that of TaB.

Additive-assisted synthesis of boride, carbide, and nitride micro/nanocrystals

International Nuclear Information System (INIS)

Chen, Bo; Yang, Lishan; Heng, Hua; Chen, Jingzhong; Zhang, Linfei; Xu, Liqiang; Qian, Yitai; Yang, Jian

2012-01-01

General and simple methods for the syntheses of borides, carbides and nitrides are highly desirable, since those materials have unique physical properties and promising applications. Here, a series of boride (TiB 2 , ZrB 2 , NbB 2 , CeB 6 , PrB 6 , SmB 6 , EuB 6 , LaB 6 ), carbide (SiC, TiC, NbC, WC) and nitride (TiN, BN, AlN, MgSiN 2 , VN) micro/nanocrystals were prepared from related oxides and amorphous boron/active carbon/NaN 3 with the assistance of metallic Na and elemental S. In-situ temperature monitoring showed that the reaction temperature could increase quickly to ∼850 °C, once the autoclave was heated to 100 °C. Such a rapid temperature increase was attributed to the intense exothermic reaction between Na and S, which assisted the formation of borides, carbides and nitrides. The as-obtained products were characterized by XRD, SEM, TEM, and HRTEM techniques. Results in this report will greatly benefit the future extension of this approach to other compounds. - Graphical abstract: An additive-assisted approach is successfully developed for the syntheses of borides, carbides and nitrides micro/nanocrystals with the assistance of the exothermic reaction between Na and S. Highlights: ► An additive-assisted synthesis strategy is developed for a number of borides, carbides and nitrides. ► The reaction mechanism is demonstrated by the case of SiC nanowires. ► The formation of SiC nanowires is initiated by the exothermic reaction of Na and S.

Nanodispersed boriding of titanium alloy

International Nuclear Information System (INIS)

Kostyuk, K.O.; Kostyuk, V.O.

2015-01-01

The problem of improving the operational reliability of machines is becoming increasingly important due to the increased mechanical, thermal and other loads on the details. There are many surface hardening methods for machines parts which breakdown begins with surface corruption. The most promising methods are chemical-thermal treatment. The aim of this work is to study the impact of boriding on the structure and properties of titanium alloy. Materials and Methods: The material of this study is VT3-1 titanium alloy. The boriding were conducted using nanodispersed powder blend based on boric substances. It is established that boriding of paste compounds allows obtaining the surface hardness within 30 - 29 GPa and with declining to 27- 26 GPa in layer to the transition zone (with total thickness up to 110 μm) owing to changes of the layer phase composition where T 2 B, TiB, TiB 2 titanium borides are formed. The increasing of chemical-thermal treatment time from 15 minutes to 2 hours leads to thickening of the borated layer (30 - 110 μm) and transition zone (30 - 190 μm). Due to usage of nanodispersed boric powder, the boriding duration is decreasing in 2 - 3 times. This allows saving time and electric energy. The developed optimal mode of boriding the VT3-1 titanium alloy allows obtaining the required operational characteristics and to combine the saturation of the surface layer with atomic boron and hardening

Characterization of AISI 4140 borided steels

International Nuclear Information System (INIS)

Campos-Silva, I.; Ortiz-Dominguez, M.; Lopez-Perrusquia, N.; Meneses-Amador, A.; Escobar-Galindo, R.; Martinez-Trinidad, J.

2010-01-01

The present study characterizes the surface of AISI 4140 steels exposed to the paste-boriding process. The formation of Fe 2 B hard coatings was obtained in the temperature range 1123-1273 K with different exposure times, using a 4 mm thick layer of boron carbide paste over the material surface. First, the growth kinetics of boride layers at the surface of AISI 4140 steels was evaluated. Second, the presence and distribution of alloying elements on the Fe 2 B phase was measured using the Glow Discharge Optical Emission Spectrometry (GDOES) technique. Further, thermal residual stresses produced on the borided phase were evaluated by X-ray diffraction (XRD) analysis. The fracture toughness of the iron boride layer of the AISI 4140 borided steels was estimated using a Vickers microindentation induced-fracture testing at a constant distance of 25 μm from the surface. The force criterion of fracture toughness was determined from the extent of brittle cracks, both parallel and perpendicular to the surface, originating at the tips of an indenter impression. The fracture toughness values obtained by the Palmqvist crack model are expressed in the form K C (π/2) > K C > K C (0) for the different applied loads and experimental parameters of the boriding process.

Characterization of AISI 4140 borided steels

Science.gov (United States)

Campos-Silva, I.; Ortiz-Domínguez, M.; López-Perrusquia, N.; Meneses-Amador, A.; Escobar-Galindo, R.; Martínez-Trinidad, J.

2010-02-01

The present study characterizes the surface of AISI 4140 steels exposed to the paste-boriding process. The formation of Fe 2B hard coatings was obtained in the temperature range 1123-1273 K with different exposure times, using a 4 mm thick layer of boron carbide paste over the material surface. First, the growth kinetics of boride layers at the surface of AISI 4140 steels was evaluated. Second, the presence and distribution of alloying elements on the Fe 2B phase was measured using the Glow Discharge Optical Emission Spectrometry (GDOES) technique. Further, thermal residual stresses produced on the borided phase were evaluated by X-ray diffraction (XRD) analysis. The fracture toughness of the iron boride layer of the AISI 4140 borided steels was estimated using a Vickers microindentation induced-fracture testing at a constant distance of 25 μm from the surface. The force criterion of fracture toughness was determined from the extent of brittle cracks, both parallel and perpendicular to the surface, originating at the tips of an indenter impression. The fracture toughness values obtained by the Palmqvist crack model are expressed in the form KC( π/2) > KC > KC(0) for the different applied loads and experimental parameters of the boriding process.

Characterization of AISI 4140 borided steels

Energy Technology Data Exchange (ETDEWEB)

Campos-Silva, I., E-mail: icampos@ipn.mx [Instituto Politecnico Nacional, Grupo Ingenieria de Superficies, SEPI-ESIME U.P. Adolfo Lopez Mateos, Zacatenco, Mexico D.F., 07738 (Mexico); Ortiz-Dominguez, M.; Lopez-Perrusquia, N.; Meneses-Amador, A. [Instituto Politecnico Nacional, Grupo Ingenieria de Superficies, SEPI-ESIME U.P. Adolfo Lopez Mateos, Zacatenco, Mexico D.F., 07738 (Mexico); Escobar-Galindo, R. [Instituto de Ciencia de Materiales de Madrid (CSIC), E-28049 Cantoblanco, Madrid (Spain); Martinez-Trinidad, J. [Instituto Politecnico Nacional, Grupo Ingenieria de Superficies, SEPI-ESIME U.P. Adolfo Lopez Mateos, Zacatenco, Mexico D.F., 07738 (Mexico)

2010-02-01

The present study characterizes the surface of AISI 4140 steels exposed to the paste-boriding process. The formation of Fe{sub 2}B hard coatings was obtained in the temperature range 1123-1273 K with different exposure times, using a 4 mm thick layer of boron carbide paste over the material surface. First, the growth kinetics of boride layers at the surface of AISI 4140 steels was evaluated. Second, the presence and distribution of alloying elements on the Fe{sub 2}B phase was measured using the Glow Discharge Optical Emission Spectrometry (GDOES) technique. Further, thermal residual stresses produced on the borided phase were evaluated by X-ray diffraction (XRD) analysis. The fracture toughness of the iron boride layer of the AISI 4140 borided steels was estimated using a Vickers microindentation induced-fracture testing at a constant distance of 25 {mu}m from the surface. The force criterion of fracture toughness was determined from the extent of brittle cracks, both parallel and perpendicular to the surface, originating at the tips of an indenter impression. The fracture toughness values obtained by the Palmqvist crack model are expressed in the form K{sub C}({pi}/2) > K{sub C} > K{sub C}(0) for the different applied loads and experimental parameters of the boriding process.

Synthesis, characterization and investigation of thermoelectric properties of selected metal borides; Synthese, Charakterisierung und Untersuchung thermoelektrischer Eigenschaften ausgewaehlter Metallboride

Energy Technology Data Exchange (ETDEWEB)

Stober, Frederick

2012-06-04

The present work deals with the high-temperature thermoelectric properties of transition metal [eg V, Cr, Mn, Ni, Cu] and lanthanide [e.g. Sc, Y, Gd, Er, Dy]-borides. In particular, intercalation compounds of beta-rhombohedral boron, compounds of the type MB{sub 66}, dodecaborides and hexaborides were examined. In the case of intercalation compounds of beta-rhombohedral boron it was found that the incorporation of metals such as Sc, Mn or Cu result in favorable thermoelectric properties. The reason is most likely the preferred occupation of the metal position M2 instead of M4. Composites, for example, DyB{sub 66}-DyB{sub 12} show high electrical conductivities, high Seebeck effects at high temperatures due to the presence of DyB{sub 12} and low thermal conductivities as a result of the DyB{sub 66} matrix. At 1100K the composite DyB{sub 66}-DyB{sub 12} shows a ZT value of 0.55, thus exceeding the ZT of boron carbide (B{sub 13}C{sub 2}) at this temperature which is considered the best p-type boride material. A composite of ErB{sub 12}-ErB{sub 4}-ErB{sub 2} has negative Seebeck coefficients and shows a ZT value of 0.5 at 840K. Furthermore, the structure of tetragonal Scandiumdodecaboride ScB{sub 12} was solved on the basis of synchrotron data from a crystalline powder, after it has been debated for decades but never fully resolved.

Kinetics of borided gear steels

Indian Academy of Sciences (India)

ration (FeB + Fe2B) due to the high intensity stress states generally situated at the ... performed molten salt boriding of AISI D2 steel with borax (Na2B4O7) as the ... the borided layer thickness; silicon, chromium and aluminium have moderate.

The coloring problem in the solid-state metal boride carbide ScB{sub 2}C{sub 2}. A theoretical analysis

Energy Technology Data Exchange (ETDEWEB)

Lassoued, Souheila [Universite de Rennes, Ecole Nationale Superieure de Chimie, UMR 6226 CNRS (France). Inst. des Sciences Chimiques; Universite Kasdi Merbah-Ouargla (Algeria). Faculte des Mathematiques et des Sciences de la Matiere; Boucher, Benoit [Universite de Rennes, Ecole Nationale Superieure de Chimie, UMR 6226 CNRS (France). Inst. des Sciences Chimiques; Max-Planck-Institut fuer Chemische Physik Fester Stoffe, Dresden (Germany); Boutarfaia, Ahmed [Universite Kasdi Merbah-Ouargla (Algeria). Faculte des Mathematiques et des Sciences de la Matiere; Gautier, Regis; Halet, Jean-Francois [Universite de Rennes, Ecole Nationale Superieure de Chimie, UMR 6226 CNRS (France). Inst. des Sciences Chimiques

2016-08-01

The electronic properties of the layered ternary metal boride carbide ScB{sub 2}C{sub 2}, the structure of which consists of B/C layers made of fused five- and seven-membered rings alternating with scandium sheets, are analyzed. In particular, the respective positions of the B and C atoms (the so-called coloring problem) are tackled using density functional theory, quantum theory of atoms in molecules, and electron localizability indicator calculations. Results reveal that (i) the most stable coloring minimizes the number of B-B and C-C contacts and maximizes the number of boron atoms in the heptagons, (ii) the compound is metallic in character, and (iii) rather important covalent bonding occurs between the metallic sheets and the boron-carbon network.

A crossover from high stiffness to high hardness. The case of osmium and its borides

International Nuclear Information System (INIS)

Bian, Yongming; Li, Anhu; Liu, Xiaomei; Shanghai Univ. of Engineering Science; Liang, Yongcheng

2016-01-01

Transition-metal light-element compounds are currently raising great expectations for hard and superhard materials. Using the widely attracting osmium (Os) and its borides (OsB, Os_2B_3 and OsB_2) as prototypes, we demonstrate by first-principles calculations that heavy transition metals, which possess high stiffness but low hardness, can be converted into highly hard materials by incorporating of light elements to form compounds. Such a crossover is a manifestation that the underlying sources of high stiffness and high hardness are fundamentally different. The stiffness is related to elastic deformation that is closely associated with valence electron density, whereas the hardness depends strongly on plastic deformation that is determined by bonding nature. Therefore, the incorporation of light atoms into transition metal should be a valid pathway of designing hard and superhard materials. This strategy is in principle also applicable to other transition-metal borides, carbides, and nitrides.

A crossover from high stiffness to high hardness. The case of osmium and its borides

Energy Technology Data Exchange (ETDEWEB)

Bian, Yongming; Li, Anhu [Tongji Univ., Shanghai (China). School of Mechanical Engineering; Liu, Xiaomei [Tongji Univ., Shanghai (China). School of Mechanical Engineering; Shanghai Univ. of Engineering Science (China). College of Mechanical Engineering; Liang, Yongcheng [Shanghai Ocean Univ. (China). College of Engineering Science and Technology

2016-07-01

Transition-metal light-element compounds are currently raising great expectations for hard and superhard materials. Using the widely attracting osmium (Os) and its borides (OsB, Os{sub 2}B{sub 3} and OsB{sub 2}) as prototypes, we demonstrate by first-principles calculations that heavy transition metals, which possess high stiffness but low hardness, can be converted into highly hard materials by incorporating of light elements to form compounds. Such a crossover is a manifestation that the underlying sources of high stiffness and high hardness are fundamentally different. The stiffness is related to elastic deformation that is closely associated with valence electron density, whereas the hardness depends strongly on plastic deformation that is determined by bonding nature. Therefore, the incorporation of light atoms into transition metal should be a valid pathway of designing hard and superhard materials. This strategy is in principle also applicable to other transition-metal borides, carbides, and nitrides.

Characterization and diffusion model for the titanium boride layers formed on the Ti6Al4V alloy by plasma paste boriding

Energy Technology Data Exchange (ETDEWEB)

Keddam, Mourad, E-mail: keddam@yahoo.fr [Laboratoire de Technologie des Matériaux, Faculté de Génie Mécanique et Génie des Procédés, USTHB, B.P. No. 32, 16111 El-Alia, Bab-Ezzouar, Algiers (Algeria); Taktak, Sukru [Metallurgical and Materials Engineering, Faculty of Technology, Afyon Kocatepe University, ANS Campus, 03200, Afyonkarahisar (Turkey)

2017-03-31

Highlights: • Titanium boride layers were produced by plasma paste boriding on Ti6Al4V at 973–1073 K. • Formation rates of the Ti boride layers have parabolic character at all temperatures. • Boron diffusivities were estimated using a diffusion model including incubation times. • Activation energies of boron in TiB{sub 2} and TiB were 136 and 63 kJ/mol respectively. - Abstract: The present study is focused on the estimation of activation energy of boron in the plasma paste borided Ti6Al4V alloy, which is extensively used in technological applications, using an analytical diffusion model. Titanium boride layers were successfully produced by plasma paste boriding method on the Ti6Al4V alloy in the temperature range of 973–1073 K for a treatment time ranging from 3 to 7 h. The presence of both TiB{sub 2} top-layer and TiB whiskers sub-layer was confirmed by the XRD analysis and SEM observations. The surface hardness of the borided alloy was evaluated using Micro-Knoop indenter. The formation rates of the TiB{sub 2} and TiB layers were found to have a parabolic character at all applied process temperatures. A diffusion model was suggested to estimate the boron diffusivities in TiB{sub 2} and TiB layers under certain assumptions, by considering the effect of boride incubation times. Basing on own experimental data on boriding kinetics, the activation energies of boron in TiB{sub 2} and TiB phases were estimated as 136.24 ± 0.5 and 63.76 ± 0.5 kJ mol{sup −1}, respectively. Finally, the obtained values of boron activation energies for Ti6Al4V alloy were compared with the data available in the literature.

Synthesis, characterization and thermoelectric properties of metal borides, boron carbides and carbaborides; Synthese, Charakterisierung und thermoelektrische Eigenschaften ausgewaehlter Metallboride, Borcarbide und Carbaboride

Energy Technology Data Exchange (ETDEWEB)

Guersoy, Murat

2015-07-06

This work reports on the solid state synthesis and structural and thermoelectrical characterization of hexaborides (CaB{sub 6}, SrB{sub 6}, BaB{sub 6}, EuB{sub 6}), diboride dicarbides (CeB{sub 2}C{sub 2}, LaB{sub 2}C{sub 2}), a carbaboride (NaB{sub 5}C) and composites of boron carbide. The characterization was performed by X-ray diffraction methods and Rietveld refinements based on structure models from literature. Most of the compounds were densified by spark plasma sintering at 100 MPa. As high-temperature thermoelectric properties the Seebeck coefficients, electrical conductivities, thermal diffusivities and heat capacities were measured between room temperature and 1073 K. ZT values as high as 0.5 at 1273 K were obtained for n-type conducting EuB{sub 6}. High-temperature X-ray diffraction also confirmed its thermal stability. The solid solutions Ca{sub x}Sr{sub 1-x}B{sub 6}, Ca{sub x}Ba{sub 1-x}B{sub 6} and Sr{sub x}Ba{sub 1-x}B{sub 6} (x = 0, 0.25, 0.5, 0.75, 1) are also n-type but did not show better ZT values for the ternary compounds compared to the binaries, but for CaB{sub 6} the values of the figure of merit (ca. 0.3 at 1073 K) were significantly increased (ca. 50 %) compared to earlier investigations which is attributed to the densification process. Sodium carbaboride, NaB{sub 5}C, was found to be the first p-type thermoelectric material that crystallizes with the hexaboride-structure type. Seebeck coefficients of ca. 80 μV . K{sup -1} were obtained. Cerium diboride dicarbide, CeB{sub 2}C{sub 2}, and lanthanum diboride dicarbide, LaB{sub 2}C{sub 2}, are metallic. Both compounds were used as model compounds to develop compacting strategies for such layered borides. Densities obtained at 50 MPa were determined to be higher than 90 %. A new synthesis route using single source precursors that contain boron and carbon was developed to open the access to new metal-doped boron carbides. It was possible to obtain boron carbide, but metal-doping could not be

The complex metal-rich boride Ti{sub 1+x}Rh{sub 2-x+y}Ir{sub 3-y}B{sub 3} (x=0.68, y=1.06) with a new structure type containing B{sub 4} zigzag fragments: Synthesis, crystal chemistry and theoretical calculations

Energy Technology Data Exchange (ETDEWEB)

Goerens, Christian [Institute of Inorganic Chemistry, RWTH Aachen University, Landoltweg 1, 52064 Aachen (Germany); Fokwa, Boniface P.T., E-mail: boniface.fokwa@ac.rwth-aachen.de [Institute of Inorganic Chemistry, RWTH Aachen University, Landoltweg 1, 52064 Aachen (Germany)

2012-08-15

: Black-Right-Pointing-Pointer Synthesis of a new metal-rich complex boride. Black-Right-Pointing-Pointer New structure type containing isolated boron and trans zigzag B{sub 4} units. Black-Right-Pointing-Pointer Crystallographic parameters and bond length well reproduced by theory. Black-Right-Pointing-Pointer Strong boron-boron and metal-boron interactions responsible for structural stability. Black-Right-Pointing-Pointer Three-dimensional metallic network responsible for metallic behavior.

Electrochemical boriding and characterization of AISI D2 tool steel

International Nuclear Information System (INIS)

Sista, V.; Kahvecioglu, O.; Eryilmaz, O.L.; Erdemir, A.; Timur, S.

2011-01-01

D2 is an air-hardening tool steel and due to its high chromium content provides very good protection against wear and oxidation, especially at elevated temperatures. Boriding of D2 steel can further enhance its surface mechanical and tribological properties. Unfortunately, it has been very difficult to achieve a very dense and uniformly thick boride layers on D2 steel using traditional boriding processes. In an attempt to overcome such a deficiency, we explored the suitability and potential usefulness of electrochemical boriding for achieving thick and hard boride layers on this tool steel in a molten borax electrolyte at 850, 900, 950 and 1000 °C for durations ranging from 15 min to 1 h. The microstructural characterization and phase analysis of the resultant boride layers were performed using optical, scanning electron microscopy and X-ray diffraction methods. Our studies have confirmed that a single phase Fe 2 B layer or a composite layer consisting of FeB + Fe 2 B is feasible on the surface of D2 steel depending on the length of boriding time. The boride layers formed after shorter durations (i.e., 15 min) mainly consisted of Fe 2 B phase and was about 30 μm thick. The thickness of the layer formed in 60 min was about 60 μm and composed mainly of FeB and Fe 2 B. The cross sectional micro-hardness values of the boride layers varied between 14 and 22 GPa, depending on the phase composition.

Low-temperature heat capacity of molybdenum borides

International Nuclear Information System (INIS)

Bolgar, A.S.; Klinder, A.V.; Novoseletskaya, L.M.; Turov, V.P.; Klochkov, L.A.; Lyashchenko, A.B.

1988-01-01

Heat capacity of molybdenum borides Mo 2 B, MoB, Mo 2 B 5 is studied for the first time in the 60-300 K range using the adiabatic method. Standard (at 298.15 K) thermodynamic functions (enthalpy, heat capacity, entropy, reduced Gibbs energy) of molybdenum borides are calculated

Fracture toughness of borides formed on boronized ductile iron

International Nuclear Information System (INIS)

Sen, Ugur; Sen, Saduman; Koksal, Sakip; Yilmaz, Fevzi

2005-01-01

In this study, fracture toughness properties of boronized ductile iron were investigated. Boronizing was realized in a salt bath consisting of borax, boric acid and ferro-silicon. Boronizing heat treatment was carried out between 850 and 950 deg. C under the atmospheric pressure for 2-8 h. Borides e.g. FeB, Fe 2 B formed on ductile iron was verified by X-ray diffraction (XRD) analysis, SEM and optical microscope. Experimental results revealed that longer boronizing time resulted in thicker boride layers. Optical microscope cross-sectional observation of borided layers showed dentricular morphology. Both microhardness and fracture toughness of borided surfaces were measured via Vickers indenter. The harnesses of borides formed on the ductile iron were in the range of 1160-2140 HV 0.1 and fracture toughness were in the range of 2.19-4.47 MPa m 1/2 depending on boronizing time and temperature

Synthesis of cobalt boride nanoparticles using radio frequency thermal plasma

International Nuclear Information System (INIS)

Lapitan, Jr. Lorico DS.; Ying Ying Chen; Seesoek Choe; Watanabe, Takayuki

2012-01-01

Nano size cobalt boride particles were synthesized from vapor phase using a 30 kw-4 MHz radio frequency (RF) thermal plasma. Cobalt and boron powder mixtures used as precursors in different composition and feed rate were evaporated immediately in the high temperature plasma and cobalt boride nanoparticles were produced through the quenching process. The x-ray diffractometry (XRD) patterns of cobalt boride nanoparticles prepared from the feed powder ratio of 1:2 and 1:3 for Co: B showed peaks that are associated with the Co 2 B and CoB crystal phases of cobalt boride. The XRD analysis revealed that increasing the powder feed rate results in a higher mass fraction and a larger crystalline diameter of cobalt boride nanoparticles. The images obtained by field emission scanning electron microscopy (FE-SEM) revealed that cobalt boride nanoparticles have a spherical morphology. The crystallite size of the particles estimated with XRD was found to be 18-22 nm. (author)

Evaluation of High Temperature Particle Erosion Resistance of Vanadium-Boride Coating

International Nuclear Information System (INIS)

Lee, E. Y.; Kim, J. H.; Jeong, S. I.; Lee, S. H.; Eum, G. W.

2015-01-01

The components in ultra super critical (USC) steam turbine, which is under development for high efficient power generation, are encountering harsher solid particle erosion by iron oxide scales than ones in the existing steam turbines. Therefore, the currently used boride coating will not be able to hold effective protection from particle erosion in USC system and should be replaced by new particle erosion resistant coatings. One of the best protective coatings developed for USC steam turbine parts was found to be vanadium-boride (V-boride) coating which has a hardness of about 3000 HV, much higher than that of boride, 1600∼2000 HV. In order to evaluate particle erosion resistance of the various coatings such as V-boride, boride and Cr-carbide coatings at high temperature, particle erosion test equipment were designed and manufactured. In addition, erosion particle velocity was simulated using FLUENT software based on semi-implicity method for pressure linked equations revised (SIMPLER). Based on experimental results of this work, the vanadium-boride coating was found to be superior to others and to be a candidate coating to replace the boride coating

Evaluation of High Temperature Particle Erosion Resistance of Vanadium-Boride Coating

Energy Technology Data Exchange (ETDEWEB)

Lee, E. Y.; Kim, J. H.; Jeong, S. I. [Andong National University, Andong (Korea, Republic of); Lee, S. H.; Eum, G. W. [Corporate R and D Institute Doosan Heavy Industries and Construction Co., Changwon (Korea, Republic of)

2015-04-15

The components in ultra super critical (USC) steam turbine, which is under development for high efficient power generation, are encountering harsher solid particle erosion by iron oxide scales than ones in the existing steam turbines. Therefore, the currently used boride coating will not be able to hold effective protection from particle erosion in USC system and should be replaced by new particle erosion resistant coatings. One of the best protective coatings developed for USC steam turbine parts was found to be vanadium-boride (V-boride) coating which has a hardness of about 3000 HV, much higher than that of boride, 1600∼2000 HV. In order to evaluate particle erosion resistance of the various coatings such as V-boride, boride and Cr-carbide coatings at high temperature, particle erosion test equipment were designed and manufactured. In addition, erosion particle velocity was simulated using FLUENT software based on semi-implicity method for pressure linked equations revised (SIMPLER). Based on experimental results of this work, the vanadium-boride coating was found to be superior to others and to be a candidate coating to replace the boride coating.

Boriding with boron carbide base pastes

International Nuclear Information System (INIS)

Aliev, A.A.

1978-01-01

The aim of this paper is to develop an advanced technique of boriding using pastes under the conditions of furnace heating. The research is carried out on flat specimens of 20 and U8 steels pre-annealed in vacuum. B 4 C base pastes were used as saturating media, and the glue prepared by dissolving of nitrocellulose in the mixture of butylacetate and acetone was used as a bond. Measured was the depth of diffusion layers, produced on the 20 and u8 steels after boriding with the pastes under different temperatures and saturation times. The results of metallographic analysis show that borided layers have a specific needle-like structure. The surface of the specimens is clean and free from any paste residues and traces of partial melting

Electronic, structural and magnetic studies of niobium borides of group 8 transition metals, Nb2MB2 (M=Fe, Ru, Os) from first principles calculations

International Nuclear Information System (INIS)

Touzani, Rachid St.; Fokwa, Boniface P.T.

2014-01-01

The Nb 2 FeB 2 phase (U 3 Si 2 -type, space group P4/mbm, no. 127) is known for almost 50 years, but until now its magnetic properties have not been investigated. While the synthesis of Nb 2 OsB 2 (space group P4/mnc, no. 128, a twofold superstructure of U 3 Si 2 -type) with distorted Nb-layers and Os 2 -dumbbells was recently achieved, “Nb 2 RuB 2 ” is still not synthesized and its crystal structure is yet to be revealed. Our first principles density functional theory (DFT) calculations have confirmed not only the experimental structures of Nb 2 FeB 2 and Nb 2 OsB 2 , but also predict “Nb 2 RuB 2 ” to crystalize with the Nb 2 OsB 2 structure type. According to chemical bonding analysis, the homoatomic B–B interactions are optimized and very strong, but relatively strong heteroatomic M–B, B–Nb and M–Nb bonds (M=Fe, Ru, Os) are also found. These interactions, which together build a three-dimensional network, are mainly responsible for the structural stability of these ternary borides. The density-of-states at the Fermi level predicts metallic behavior, as expected, from metal-rich borides. Analysis of possible magnetic structures concluded preferred antiferromagnetic ordering for Nb 2 FeB 2 , originating from ferromagnetic interactions within iron chains and antiferromagnetic exchange interactions between them. -- Graphical abstract: Nb 2 FeB 2 (U 3 Si 2 structure type, space group P4/mbm, no. 127) is predicted to order antiferromagnetically, due to the presence of iron chains which show ferromagnetic interactions in the chains and antiferromagnetic interactions between them. “Nb 2 RuB 2 ” is predicted to crystallize with the recently discovered Nb 2 OsB 2 twofold superstructure (space group P4/mnc, no. 128) of U 3 Si 2 structure type. The building of ruthenium dumbbells instead of chains along [001] is found to be responsible for the stabilization of this superstructure. Highlights: • Nb 2 FeB 2 is predicted to order antiferromagnetically. �

Pulsed nanocrystalline plasma electrolytic boriding as a novel ...

Indian Academy of Sciences (India)

WINTEC

borided CP-Ti, treated by a relatively new method called pulsed plasma electrolytic boriding. The results ... ratio, high stiffness and strength (Donachie 2000; Lutjer- ing and Albrecht ..... both direct current and a.c. techniques. Although the main ...

Stability, elastic properties and fracture toughness of Al0.75X0.75B14 (X=Sc, Ti, V, Cr, Y, Zr, Nb, Mo) investigated using ab initio calculations

International Nuclear Information System (INIS)

Emmerlich, Jens; Thieme, Niklas; To Baben, Moritz; Music, Denis; Schneider, Jochen M

2013-01-01

The effect of the transition metal valence electron concentration on the energy of formation, effective charge of B icosahedra, elastic properties, surface energy and fracture toughness was calculated using density functional theory for icosahedral transition metal borides of AlXB 14 (X=Sc, Ti, V, Cr, Y, Zr, Nb, Mo). Consistent with previous work on AlYB 14 (Kölpin et al 2009 J. Phys.: Condens. Matter 21 355006) it is shown that phase stability is generally dependent on the effective charge of the icosahedral transition metal borides. Also, ionization potential and electronegativity are identified as parameters affecting the effective charge of B icosahedra suitable for use in predicting the phase stability. Al 0.75 Y 0.75 B 14 , Al 0.75 Sc 0.75 B 14 and Al 0.75 Zr 0.75 B 14 have been identified as promising phases for application as protective coatings as they exhibit high phase stability and stiffness combined with a comparatively high fracture toughness. (paper)

Identification of an eta boride phase as a crystallization product of a NiMoFeB amorphous alloy

International Nuclear Information System (INIS)

Kim, Y.W.; Rabenberg, L.; Bourell, D.L.

1988-01-01

A new, apparently metastable, Mo--Ni boride phase has been observed in transmission electron microscope samples of rapidly consolidated MoNiFeB metallic glass powders. The phase is cubic with lattice parameter 1.083 nm. Its space group as determined by electron diffraction is Fd3-barm and its approximate composition is Mo 3 Ni 3 B. Because its structure, its composition, and its role as a transition phase are analogous to those of eta carbide (M 6 C) in steels and cemented carbides, this phase has tentatively been named ''eta boride.''

Pulsed nanocrystalline plasma electrolytic boriding as a novel ...

Indian Academy of Sciences (India)

Potentiodynamic polarization and electrochemical impedance spectroscopy were employed to test borided CP-Ti, treated by a relatively new method called pulsed plasma electrolytic boriding. The results show excellent corrosion resistance for modified CP-Ti. The effect of frequency and duty cycle of pulsed current was ...

Boron-Based Hydrogen Storage: Ternary Borides and Beyond

Energy Technology Data Exchange (ETDEWEB)

Vajo, John J. [HRL Laboratories, LLC, Malibu, CA (United States)

2016-04-28

DOE continues to seek reversible solid-state hydrogen materials with hydrogen densities of ≥11 wt% and ≥80 g/L that can deliver hydrogen and be recharged at moderate temperatures (≤100 °C) and pressures (≤100 bar) enabling incorporation into hydrogen storage systems suitable for transportation applications. Boron-based hydrogen storage materials have the potential to meet the density requirements given boron’s low atomic weight, high chemical valance, and versatile chemistry. However, the rates of hydrogen exchange in boron-based compounds are thus far much too slow for practical applications. Although contributing to the high hydrogen densities, the high valance of boron also leads to slow rates of hydrogen exchange due to extensive boron-boron atom rearrangements during hydrogen cycling. This rearrangement often leads to multiple solid phases occurring over hydrogen release and recharge cycles. These phases must nucleate and react with each other across solid-solid phase boundaries leading to energy barriers that slow the rates of hydrogen exchange. This project sought to overcome the slow rates of hydrogen exchange in boron-based hydrogen storage materials by minimizing the number of solid phases and the boron atom rearrangement over a hydrogen release and recharge cycle. Two novel approaches were explored: 1) developing matched pairs of ternary borides and mixed-metal borohydrides that could exchange hydrogen with only one hydrogenated phase (the mixed-metal borohydride) and only one dehydrogenated phase (the ternary boride); and 2) developing boranes that could release hydrogen by being lithiated using lithium hydride with no boron-boron atom rearrangement.

Some mechanical properties of borided AISI H13 and 304 steels

International Nuclear Information System (INIS)

Taktak, Sukru

2007-01-01

In the present study, mechanical properties of borides formed on AISI H13 hot work tool and AISI 304 stainless steels have been investigated. Both steels have high chromium content and have a widespread use in the engineering application. Boriding treatment was carried out in slurry salt bath consisting of borax, boric acid, and ferrosilicon at temperature range of 800-950 deg. C for 3, 5, and 7 h. X-ray diffraction analysis of boride layers on the surface of steels revealed various peaks of FeB, Fe 2 B, CrB, and Ni 3 B. Metallographic studies showed that the boride layer has a flat and smooth morphology in the 304 steel while H13 steel was a ragged morphology. The characterization of the boride layer is also carried out by means of the micro-hardness, surface roughness, adhesion, and fracture toughness studies

Bonding and doping of simple icosahedral-boride semiconductors

International Nuclear Information System (INIS)

Emin, David

2004-01-01

A simple model of the bonding and doping of a series of icosahedral-boride insulators is presented. Icosahedral borides contain clusters of boron atoms that occupy the 12 vertices of icosahedra. This particular series of icosahedral borides share both the stoichiometry B 12 X 2 , where X denotes a group V element (P or As), and a common lattice structure. The inter-icosahedral bonding of these icosahedral borides is contrasted with that of B 12 O 2 and with that of α-rhombohedral boron. Knowledge of the various types of inter-icosahedral bonding is used as a basis to address effects of inter-icosahedral atomic substitutions. The inter-icosahedral bonding is maintained when an atom of a group V element is replaced with an atom of a group IV element, thereby producing a p-type dopant. However, changes of inter-icosahedral bonding occur upon replacing an atom of a group V element with an atom of a group VI element or with a vacancy. As a result, these substitutions do not produce effective n-type dopants. Moreover, partial substitution of boron atoms for atoms of group V elements generally renders these materials p-type semiconductors

Borides - a new generation of highly resistant materials?

International Nuclear Information System (INIS)

Telle, R.

1988-01-01

High-duty ceramics are on advance in all sectors where materials with extremely good resistance to high temperatures and wear are required. The group of oxides, nitrides and carbides in use for quite a time now recently has been increased by the metal borides which offer among others economic advantages in certain applications. The drawbacks of these materials still to be reduced are their brittleness and susceptibility to oxidation and corrosion. Current research work on the thermodynamics of such systems, on the interaction between structure and properties, and on means to improve strength and resistance to wear are expected to soon open up new applications. (orig.) [de

Structure, microstructure and residual stresses in borided steels

Czech Academy of Sciences Publication Activity Database

Pala, Z.; Mušálek, Radek; Kyncl, J.; Harcuba, P.; Stráský, J.; Kolařík, K.

2013-01-01

Roč. 20, č. 2 (2013), s. 93-95 ISSN 1211-5894. [Struktura 2013 - Kolokvium Krystalografické společnosti. Češkovice (Blansko), 09.09.2013-13.09.2013] Institutional support: RVO:61389021 Keywords : boriding * surface hardening * iron borides * tooth-shaped microstructure * residual stresses Subject RIV: JK - Corrosion ; Surface Treatment of Materials http://www.xray.cz/ms/bul2013-2/s6.pdf

Characterization of boride-based powders and detonation gun sprayed cermet coatings

International Nuclear Information System (INIS)

Keraenen, J.; Stenberg, T.; Maentylae, T.

1995-01-01

Detonation gun sprayed (DGS) cermet coatings containing complex ternary transition metal boride as hard particles dispersed in a stainless steel or nickel based superalloy matrix have been characterized. Microstructure of the coatings, as well as powders, were studied with optical microscopy, scanning electron microscopy (SEM), X-ray diffraction (XRD) and analytical transmission electron microscopy (AEM). X-ray microanalysis of the coatings were carried out using energy dispersive X-ray spectrometer (EDS) attached to the SEM and AEM. Moreover, abrasion wear resistance of the coatings was evaluated with a rubber wheel abrasion test equipment. The general microstructure of studied coatings appeared to be heterogeneous in the terms of the distribution, size and crystallographic nature of the phases. Nonetheless, very low porosities were obtained and in the coatings the oxide phase as well as the unmelted particles and the formation of oxide phase were avoided by optimization of DGS parameters. So far the abrasive wear resistance of boride-based cermet coatings is not so good as that of the WC-12Co coatings

Assessment of polyphase sintered iron-cobalt-iron boride cermets

International Nuclear Information System (INIS)

Nowacki, J.; Pieczonka, T.

2004-01-01

Sintering of iron, cobalt and boron powders has been analysed. As a result iron-iron boride, Fe-Fe 2 B and iron/cobalt boride with a slight admixture of molybdenum, Fe - Co - (FeMoCo) 2 B cermets have been produced. Iron was introduced to the mixture as the Astalloy Mo Hoeganaes grade powder. Elemental amorphous boron powder was used, and formation of borides occurred both during heating and isothermal sintering periods causing dimensional changes of the sintered body. Dilatometry was chosen to control basic phenomena taking place during multiphase sintering of investigated systems. The microstructure and phase constituents of sintered compacts were controlled as well. The cermets produced were substituted to: metallographic tests, X-ray analysis, measurements of hardness and of microhardness, and of wear in the process of sliding dry friction. Cermets are made up of two phases; hard grains of iron - cobalt boride, (FeCo) 2 B (1800 HV) constituting the reinforcement and a relatively soft and plastic eutectic mixture Fe 2 B - Co (400-500 HV) constituting the matrix. (author)

Electronic, structural and magnetic studies of niobium borides of group 8 transition metals, Nb{sub 2}MB{sub 2} (M=Fe, Ru, Os) from first principles calculations

Energy Technology Data Exchange (ETDEWEB)

Touzani, Rachid St.; Fokwa, Boniface P.T., E-mail: Boniface.Fokwa@ac.rwth-aachen.de

2014-03-15

The Nb{sub 2}FeB{sub 2} phase (U{sub 3}Si{sub 2}-type, space group P4/mbm, no. 127) is known for almost 50 years, but until now its magnetic properties have not been investigated. While the synthesis of Nb{sub 2}OsB{sub 2} (space group P4/mnc, no. 128, a twofold superstructure of U{sub 3}Si{sub 2}-type) with distorted Nb-layers and Os{sub 2}-dumbbells was recently achieved, “Nb{sub 2}RuB{sub 2}” is still not synthesized and its crystal structure is yet to be revealed. Our first principles density functional theory (DFT) calculations have confirmed not only the experimental structures of Nb{sub 2}FeB{sub 2} and Nb{sub 2}OsB{sub 2}, but also predict “Nb{sub 2}RuB{sub 2}” to crystalize with the Nb{sub 2}OsB{sub 2} structure type. According to chemical bonding analysis, the homoatomic B–B interactions are optimized and very strong, but relatively strong heteroatomic M–B, B–Nb and M–Nb bonds (M=Fe, Ru, Os) are also found. These interactions, which together build a three-dimensional network, are mainly responsible for the structural stability of these ternary borides. The density-of-states at the Fermi level predicts metallic behavior, as expected, from metal-rich borides. Analysis of possible magnetic structures concluded preferred antiferromagnetic ordering for Nb{sub 2}FeB{sub 2}, originating from ferromagnetic interactions within iron chains and antiferromagnetic exchange interactions between them. -- Graphical abstract: Nb{sub 2}FeB{sub 2} (U{sub 3}Si{sub 2} structure type, space group P4/mbm, no. 127) is predicted to order antiferromagnetically, due to the presence of iron chains which show ferromagnetic interactions in the chains and antiferromagnetic interactions between them. “Nb{sub 2}RuB{sub 2}” is predicted to crystallize with the recently discovered Nb{sub 2}OsB{sub 2} twofold superstructure (space group P4/mnc, no. 128) of U{sub 3}Si{sub 2} structure type. The building of ruthenium dumbbells instead of chains along [001] is found to be

Electronic Structure Properties and a Bonding Model of Thermoelectric Half-Heusler and Boride Phases

Science.gov (United States)

Simonson, Jack William

Half-Heusler alloys MNiSn and MCoSb (M = Ti, Zr, Hf) and layered boride intermetallics with structure types YCrB4 and Er 3CrB7 were designed, synthesized, and characterized. The thermoelectric properties of these two classes of alloys were measured from room temperature to 1100 K with the intent of indirectly studying their electronic structure properties and gauging not only their suitability but that of related alloys for high temperature thermoelectric power generation. In the case of the half-Heusler alloys, transition metals were substituted to both the M and Ni/Co sites to study the resultant modifications of the d-orbital-rich portion of the electronic structure near the Fermi energy. This modification and subsequent pinning of the Fermi energy within the gap is discussed herein in terms of first principles electronic structure calculations from the literature. In the half-Heusler alloys, it was found that substitution of transition metals invariably led to a decrease in the thermopower, while the resistivity typically maintained its semiconducting trend. On the other hand, Sn doping in MCoSb type alloys -- a dopant that has been known for some time to be efficient -- was shown to result in high ZT at temperatures in excess of 1000 K. Moreover, the band gaps of the transition metal-doped alloys measured in this work offer insight into the discrepancy between the predicted and measured band gaps in the undoped parent compositions. In the case of the layered boride alloys, on the other hand, few electronic calculations have been published, thus prompting the generalization of a well-known electron counting rule -- which is typically used to study molecular organometallics, boranes, and metallocenes -- to predict the trends in the densities of states of crystalline solids that possess the requisite deltahedral bonding geometry. In accordance with these generalized electronic counting rules, alloys of the form RMB4 (R = Y, Gd, Ho; M = Cr, Mo, W) were measured to

Microstructural evaluation of a low carbon steel submitted to boriding treatment pre and post GTAW welding; Avaliacao microestrutural de um aco de baixo carbono submetido ao tratamento de boretacao pre e pos-soldagem GTAW

Energy Technology Data Exchange (ETDEWEB)

Pollnow, Edilson Nunes; Osorio, Alice Goncalves, E-mail: edilson.pollnow@hotmail.com, E-mail: osorio.alice@gmail.com [Universidade Federal de Pelotas (CDTec/UFPel), Pelotas, RS (Brazil). Centro de Desenvolvimento Tecnologico; Araujo, Douglas Bezerra de, E-mail: dbaraujo@ufu.br [Universidade Federal de Uberlandia (FEMEC/UFU), Uberlandia, MG (Brazil). Faculdade de Engenharia Mecanica; Passos, Thais Andrezza dos; Souza, Daniel, E-mail: thais.andrezza.passos@gmail.com, E-mail: danielsouza@furg.br [Universidade Federal do Rio Grande (EE/FURG), Rio Grande, RS (Brazil). Escola de Engenharia

2017-04-15

Studies on surface engineering area are given great importance due to the improvement that surface modifications provide to materials. With a global market that has the need to provide parts and equipment with extended service life and low cost, to support stringent requests and thus maintain its high performance, surface treatments may bring what was impossible into reality. Among the surface treatments that have received attention recently, we have the thermochemical process of boriding. The boriding process consists of saturate the surface of steels and metal alloys with boron. This saturation provides an increase in the surface properties not inherent to the base metal, such as hardness, resistance to abrasion and corrosion. Although the properties of boriding steels have already been studied, the effects that the boriding process perform on the steel during or after the welding processes are not known. Hence, it is the purpose of this study to evaluate the microstructure of a low carbon steel treated with boriding before and after GTAW welding. The results indicated poor metallurgical weldability of low carbon steel with boride layer, with the presence of solidification cracks. Nonetheless, the steel welded previous to boring treatment presented a more ductile nucleus, with harder surface. Although the values of hardness within the nucleus of the steel had dropped drastically at the welded zone after the boring, the surface of this steel showed higher values of hardness due to the boriding layer. This fact should be considered when applications where wear resistance is needed. (author)

Preparation of iron boride layers from the gas phase

International Nuclear Information System (INIS)

Marx, G.; Plaenitz, H.; Treffer, G.; Koenig, H.; Altenburger, S.

1980-01-01

Coating of Armco iron, steel-C100W1, and steel-100Cr6 with borides by decomposition of boron tribromide on the surface of the specimens is described. The experiments were carried out in a laboratory apparatus at temperatures between 923 and 1223 K. The dependence of the thickness of the boride layers on time and temperature is presented in graphs

Structure and magnetic properties of the 3d transition-metal mono-borides TM–B (TM=Mn, Fe, Co) under pressures

International Nuclear Information System (INIS)

Bourourou, Y.; Beldi, L.; Bentria, B.; Gueddouh, A.; Bouhafs, B.

2014-01-01

In this paper, spin-polarization and pressure effects on the structural and electronic properties of the 3d transition-metal mono-borides TM–B (TM=Mn, Fe, Co) have been studied by using both local spin-density approximation (LSDA) and generalized gradient approximation (GGA) within the framework of density-functional theory (DFT). At equilibrium, spin-polarization calculations show that MnB and FeB compounds carry magnetic moment. The non-spin-polarization results show that the non-magnetic state is unstable for MnB and FeB compounds, but a stable non-magnetic phase for CoB compound, which is discussed in the framework of the well-known Stoner criterion. The calculated lattice parameters, bulk moduli, their first-pressure derivatives and magnetic moments agree well with experimental and other theoretical results. Significant differences in volume and in bulk modulus were found between the magnetic and non-magnetic case reached 4%, 22%, respectively. The effect of pressure on the crystal structure reflects in a compression of the unit cell volume with a decreasing in the magnetic moment. The density of states of MnB and FeB ferromagnetic compounds are significantly modified under high pressures. The exchange energy decreases with increasing pressure, at approximately V/V 0 =0.6, the exchange energy becomes absent in ferromagnetic compounds causes mirror in upper and lowers half panels. Finally, we notice that spin-polarization and pressure play a crucially important role in determining the electronic and structural properties of 3d transition-metal mono-borides. - Highlights: • Spin polarization and pressure effects on TM–B (TM=Mn, Fe, Co) have been investigated. • The non-spin-polarization results show that the non-magnetic state is stable for CoB. • The magnetic states of MnB and FeB are found more stable than their nonmagnetic states. • We report significant differences between the magnetic and non-magnetic cases. • The density of states of MnB and

High Temperature Sliding Wear of NiAl-based Coatings Reinforced by Borides

Directory of Open Access Journals (Sweden)

Oleksandr UMANSKYI

2016-05-01

Full Text Available The development of composite materials (CM in the systems “metal-refractory compound” is one of the up-to-date trends in design of novel materials aimed at operating under the conditions of significant loads at high temperature. To design such material, NiAl, which is widely used for deposition of protective coatings on parts of gas-turbine engines, was selected for a matrix. To strengthen a NiAl under the conditions of intense wear and a broad temperature range (up to 1000 °C, it is reasonable to add refractory inclusions. Introduction of refractory borides into matrix leads to a marked increase in metal wear resistance. In order to research the behavior of the designed composites at high temperatures and to study the influence of oxides on the friction processes, the authors carried out high temperature oxidation of CM of the above systems at 1000 °С for 90 min. It was determined that all of the composites were oxidized selectively and that the thickness of oxide layers formed on the boride inclusions is 3 – 7 times that on the oxides formed on the NiAl matrix. The mechanism of wear of gas-thermal coatings of the NiAl – МеB2 systems was studied for conditions of high temperature tribotests using the «pin-on-disc» technique. The obtained results indicate that introduction of TiB2, CrB2 and ZrB2 leads to their more intense oxidation during high temperature tribotests as compared to the matrix. The oxides formed on refractory borides act as solid lubricants, which promote a decrease in wear of the contact friction pairs. For more detailed investigation of the effect of tribo-oxidation products on the friction processes, tribotests were conducted for prior oxidized (at 900 °С coatings NiAl – 15 wt.% CrB2 (TiB2, ZrB2.DOI: http://dx.doi.org/10.5755/j01.ms.22.1.8093

Preparation of single phase molybdenum boride

International Nuclear Information System (INIS)

Camurlu, Hasan Erdem

2011-01-01

Highlights: → Formation of Mo and a mixture of molybdenum boride phases take place in preparation of molybdenum borides. → It is intricate to prepare single phase molybdenum borides. → Formation of single phase MoB from MoO 3 + B 2 O 3 + Mg mixtures has not been reported previously. → Single phase MoB was successfully prepared through a combination of mechanochemical synthesis and annealing process. - Abstract: The formation of MoB through volume combustion synthesis (VCS), and through mechanochemical synthesis (MCS) followed by annealing has been investigated. MoO 3 , B 2 O 3 and Mg were used as reactants while MgO and NaCl were introduced as diluents. Products were leached in dilute HCl solution and were subjected to X-ray diffraction (XRD) analysis and scanning electron microscopy (SEM) examinations. Mo was the major phase component in the VCS products under all the experimental conditions. Mo 2 B, MoB, MoB 2 and Mo 2 B 5 were found as minor phases. Products of MCS contained a mixture of Mo 2 B, MoB, MoB 2 and Mo. After annealing the MCS product at 1400 deg. C for 3 h, single phase α-MoB was obtained.

Investigation of diffusion kinetics of plasma paste borided AISI 8620 ...

Indian Academy of Sciences (India)

Henríquez 2009), plasma boriding (Rodríguez et al 1999) and plasma paste boriding (Gunes et al 2011; Yoon et al ... symmetric geometry with monochromatized radiation (Cu Kα, λ = 0.15418 nm). ..... cate the degree of reliability of the predicted results, when compared with that of the experiments. ... low alloy steels. Surf.

Characterization and wear performance of boride phases over tool steel substrates

Directory of Open Access Journals (Sweden)

Edgar E Vera Cárdenas

2016-02-01

Full Text Available This research work was conducted to characterize boride phases, obtained from the powder-pack process, on AISI H13 and D2 steel substrates, and investigate their tribological behavior. The boriding was developed at a temperature of 1273 K with an exposure time of 8 h. X-ray diffraction, scanning electron microscopy, and energy-dispersive X-ray spectroscopy were conducted on the borided material to characterize the presence of the FeB, Fe2B, and CrB phases and the distribution of heavy elements on the surface of the substrates. The adherence of the boride layers was evaluated, in a qualitative form, through the Daimler-Benz Rockwell-C indentation technique. Sliding wear tests were then performed using a reciprocating wear test machine. All tests were conducted in dry conditions at room temperature. A frequency of 10 Hz and 15-mm sliding distance were used. The applied Hertzian pressure was 2.01 GPa. Scanning electron microscopy was used to observe and analyze the wear mechanisms. Additionally, the variation of the friction coefficient versus the number of cycles was obtained. Experimental results showed that the characteristic wear mechanism for the borided surface was plastic deformation and mild abrasive wear; for unborided substrates, cracking and spalling were observed.

Ni/boride interfaces and environmental embrittlement in Ni-based superalloys: A first-principles study

International Nuclear Information System (INIS)

Sanyal, Suchismita; Waghmare, Umesh V.; Hanlon, Timothy; Hall, Ernest L.

2011-01-01

Highlights: ► Fracture strengths of Ni/boride interfaces through first-principles calculations. ► Fracture strengths of Ni/boride interfaces are higher than Ni/Ni 3 Al and NiΣ5 grain boundaries. ► Ni/boride interfaces have higher resistance to O-embrittlement than Ni/Ni 3 Al and NiΣ5 grain boundaries. ► CrMo-borides are more effective than Cr-borides in resisting O-embrittlement. ► Electronegativity differences between alloying elements correlate with fracture strengths. - Abstract: Motivated by the vital role played by boride precipitates in Ni-based superalloys in improving mechanical properties such as creep rupture strength, fatigue crack growth rates and improved resistance towards environmental embrittlement , we estimate fracture strength of Ni/boride interfaces through determination of their work of separation using first-principles simulations. We find that the fracture strength of Ni/boride interfaces is higher than that of other commonly occurring interfaces in Ni-alloys, such as Ni Σ-5 grain boundaries and coherent Ni/Ni 3 Al interfaces, and is less susceptible to oxygen-induced embrittlement. Our calculations show how the presence of Mo in Ni/M 5 B 3 (M = Cr, Mo) interfaces leads to additional reduction in oxygen-induced embrittlement. Through Electron-Localization-Function based analyses, we identify the electronic origins of effects of alloying elements on fracture strengths of these interfaces and observe that chemical interactions stemming from electronegativity differences between different atomic species are responsible for the trends in calculated strengths. Our findings should be useful towards designing Ni-based alloys with higher interfacial strengths and reduced oxygen-induced embrittlement.

Novel boride base cermets with very high strength

International Nuclear Information System (INIS)

Ken-ichi Takagi; Mari Yonetsu; Yuji Yamasaki

2001-01-01

Mo 2 NiB 2 boride base cermets consist of a Mo 2 NiB 2 type complex boride as a hard phase and a Ni base binder. The addition of Cr and V to the cermets changed the boride structure from orthorhombic to tetragonal and resulted in the improvement of mechanical properties and microstructural refinement. The tetragonal Mo 2 NiB 2 was formed through the orthorhombic Mo 2 NiB 2 by the solid state reaction during sintering and not formed directly from the raw material powders. Ni-4.5B-46.9Mo-12.5V-xMn (wt.%) model cermets with five levels of Mn content from 0 to 10 wt.% were prepared to investigate the effects of Mn on the mechanical properties and microstructure Of Mo 2 NiB 2 base cermets. The transverse rupture strength (TRS) of the cermets depended strongly on the microstructure, which varied significantly with Mn content. The maximum TRS obtained at 2.5 wt.%Mn were 3.5 Gpa with hardness of 87 R A . (author)

Laser borided composite layer produced on austenitic 316L steel

Directory of Open Access Journals (Sweden)

Mikołajczak Daria

2016-12-01

Full Text Available Abstract Austenitic 316L steel is well-known for its good resistance to corrosion and oxidation. Therefore, this material is often used wherever corrosive media or high temperatures are to be expected. The main drawback of this material is very low hardness and low resistance to mechanical wear. In this study, the laser boriding was used in order to improve the wear behavior of this material. As a consequence, a composite surface layer was produced. The microstructure of laser-borided steel was characterized by only two zones: re-melted zone and base material. In the re-melted zone, a composite microstructure, consisting of hard ceramic phases (borides and a soft austenitic matrix, was observed. A significant increase in hardness and wear resistance of such a layer was obtained.

A novel route to nanosized molybdenum boride and carbide and/or metallic molybdenum by thermo-synthesis method from MoO3, KBH4, and CCl4

International Nuclear Information System (INIS)

Li Yuanzhi; Fan Yining; Chen Yi

2003-01-01

Nanosized molybdenum boride and carbide were synthesized from MoO 3 , KBH 4 , and CCl 4 by thermo-synthesis method at lower temperature. The relative content of Mo, Mo 2 C, and molybdenum boride in the product was decided by the molar ratio between MoO 3 , KBH 4 , and CCl 4 . Increasing the molar ratio of CCl 4 to MoO 3 was favorable to the production of Mo 2 C. Increasing the molar ratio of KBH 4 to MoO 3 was favorable to the production of molybdenum boride. By carefully adjusting the reaction conditions and annealing in Ar at 900 deg. C, a single phase of MoB could be obtained

Swelling and fracturing of borides under neutron irradiation

International Nuclear Information System (INIS)

Krainy, A.G.; Ogorodnikov, V.V.; Grinik, E.U.; Chirko, L.I.; Shinakov, A.A.

1994-01-01

The neutron irradiation of high temperature borides, which are included in boron-containing reactor materials, results in high internal stresses, leading to considerable swelling and micro- and macro-fracturing. Experimental results over a large range of temperature and fluences, show a change of damage mechanism for borides within 400-530 C: the macro-cracking with formation of annular and radial cracks is observed below this temperature zone. The accumulation of micro-fractures and the process of gas swelling take place at irradiation temperatures above 530 C. The effect of the high internal stresses is compared to external pressure. 12 refs., 4 figs

Quantity, size and distribution of borides for aluminium grain refinement by neutron-induced autoradiography (NIAR). Pt. 2

International Nuclear Information System (INIS)

Rachlitz, R.; Gaertner, S.; Holze, J.; Krumnacker, M.

1990-01-01

Al-Ti-B grain refiners improve the cast structure of aluminium and its alloys, but also cause problems related to the great hardness of the borides and their tendency to agglomerate and settle. Accurate information about the distribution, quantity and size of the TiB 2 particles is needed if material properties are to be improved and the quantity of additives minimized. This information is obtained mostly by NIAR. In laboratory-scale tests Al 99.8 and Al 99.5 were refined using different master alloys added in various quantities. In all cases the commercial master alloy gave the best refining effect. Besides boride particle size distribution and the presence of nuclei and nucleus stabilizers, morphological properties (duplex particles) are obviously of essential importance. It has been demonstrated that the TiB 2 size distribution values determined by NIAR are comparable with those established by optical microscopy measurements. (orig.) [de

New ternary tantalum borides containing boron dumbbells: Experimental and theoretical studies of Ta2OsB2 and TaRuB

International Nuclear Information System (INIS)

Mbarki, Mohammed; Touzani, Rachid St.; Rehorn, Christian W.G.; Gladisch, Fabian C.; Fokwa, Boniface P.T.

2016-01-01

The new ternary transition metal-rich borides Ta 2 OsB 2 and TaRuB have been successfully synthesized by arc-melting the elements in a water-cooled crucible under an argon atmosphere. The crystal structures of both compounds were solved by single-crystal X-ray diffraction and their metal compositions were confirmed by EDX analysis. It was found that Ta 2 OsB 2 and TaRuB crystallize in the tetragonal Nb 2 OsB 2 (space group P4/mnc, no. 128) and the orthorhombic NbRuB (space group Pmma, no. 51) structure types with lattice parameters a=5.878(2) Å, c=6.857(2) Å and a=10.806(2) Å, b=3.196(1) Å, c=6.312(2) Å, respectively. Furthermore, crystallographic, electronic and bonding characteristics have been studied by density functional theory (DFT). Electronic structure relaxation has confirmed the crystallographic parameters while COHP bonding analysis indicates that B 2 -dummbells are the strongest bonds in both compounds. Moreover, the formation of osmium dumbbells in Ta 2 OsB 2 through a Peierls distortion along the c-axis, is found to be the origin of superstructure formation. Magnetic susceptibility measurements reveal that the two phases are Pauli paramagnets, thus confirming the theoretical DOS prediction of metallic character. Also hints of superconductivity are found in the two phases, however lack of single phase samples has prevented confirmation. Furthermore, the thermodynamic stability of the two modifications of AMB (A=Nb, Ta; M =Ru, Os) are studied using DFT, as new possible phases containing either B 4 - or B 2 -units are predicted, the former being the most thermodynamically stable modification. - Graphical abstract: The two new ternary tantalum borides, Ta 2 OsB 2 and TaRuB, have been discovered. Their crystal structures contain boron dumbbells, which are the strongest bonds. Peirls distortion is found responsible for Os 2 -dumbbells formation in Ta 2 OsB 2 . Ta 2 OsB 2 and TaRuB are Pauli paramagnet and potential superconductors. - Highlights: �

Characterisation of Wear Resistant Boride Layers on a Tool Steel by Activity Controlled Pack Boronising

DEFF Research Database (Denmark)

Fernandes, Frederico Augusto Pires; Christiansen, Thomas Lundin; Somers, Marcel A. J.

2015-01-01

The present work addresses the production and characterisation of iron boride layers by pack boronising of a Vanadis 6 tool steel. The boride layers were produced at 900°C for 2h using different pack compositions in order to obtain a single-phase boride layer. The layers were characterized...... by electron microscopy, glow discharge optical emission spectroscopy, X-ray diffraction, Vickers hardness tests and wear testing with a pin-on-disc tribometer. It was found that the type of boride phases (FeB and/or Fe2B) present in the treated layer can be controlled by changing the boron activity...... by pack boronising for all conditions as compared to the heat treated tool steel....

Platinum boride nanowires: Synthesis and characterization

International Nuclear Information System (INIS)

Ding Zhanhui; Qiu Lixia; Zhang Jian; Yao Bin; Cui Tian; Guan Weiming; Zheng Weitao; Wang Wenquan; Zhao Xudong; Liu Xiaoyang

2012-01-01

Highlights: ► Platinum boride nanowires have been synthesized via the direct current arc discharge method. ► XRD, TEM and SAED indicate that the nanowires are single-crystal PtB. ► Two broad photoluminescence emission peaks at about 586 nm and 626 nm have been observed in the PL spectroscopy of PtB nanowires. - Abstract: Platinum boride (PtB) nanowires have been successfully fabricated with direct current arc discharge method using a milled mixture of platinum (Pt) and boron nitride (BN) powders. X-ray diffraction (XRD), scanning electron microscopy (SEM) and transmission electron microscopy (TEM) were used to characterize the compositions, morphology, and structures of the samples. The results show that PtB nanowires are 30–50 nm thick and 20–30 μm long. TEM and selected area electron diffraction (SAED) patterns identify that the PtB nanowires are single-crystalline in nature. A growth mechanism based on vapor–liquid–solid (VLS) process is proposed for the formation of nanowires.

Corrosion behavior of boride layers evaluated by the EIS technique

Energy Technology Data Exchange (ETDEWEB)

Campos, I. [Instituto Politecnico Nacional. SEPI-ESIME U.P. Adolfo Lopez Mateos, Zacatenco, Mexico D.F. 07738 (Mexico)], E-mail: icampos@ipn.mx; Palomar-Pardave, M. [Universidad Autonoma Metropolitana-Azcapotzalco, Materials Department, Avenue San Pablo 180 Col. Reynosa Tamaulipas, Mexico D.F. 02200 (Mexico); Amador, A. [Tecnologico de Monterrey, Campus Ciudad de Mexico, Calle del Puente 222 Col. Ejidos de Huipulco, Mexico D.F. 14380 (Mexico); VillaVelazquez, C. [Instituto Politecnico Nacional. SEPI-ESIME U.P. Adolfo Lopez Mateos, Zacatenco, Mexico D.F. 07738 (Mexico); Hadad, J. [Tecnologico de Monterrey, Campus Ciudad de Mexico, Calle del Puente 222 Col. Ejidos de Huipulco, Mexico D.F. 14380 (Mexico)

2007-09-30

The corrosion behavior of boride layers at the AISI 304 steel surface is evaluated in the present study. Electrochemical impedance spectroscopy (EIS) technique was used for the evaluation of the polarization resistance at the steel surface, with the aid of AUTOLAB potentiostat. Samples were treated with boron paste thickness of 4 and 5 mm, in the range of temperatures 1123 {<=} T {<=} 1273 K and exposed time of 4 and 6 h. The electrochemical technique employed 10 mV AC with a frequency scan range from 8 kHz to 3 mHz in deaerated 0.1 M NaCl solution. Nyquist diagrams show that the highest values of corrosion resistance are present in the samples borided at the temperature of 1273 K, with treatment time of 4 h and 4 mm of boron paste thickness. The values of corrosion resistance on borided steels are compared with the porosity exhibited in the layers.

Quantitative electron probe microanalysis of boron in binary borides

International Nuclear Information System (INIS)

Bastin, G.F.; Heijligers, H.J.M.

1986-01-01

Quantitative electron probe microanalysis has been performed in 27 binary borides in the range of 4-30 keV, both for the metals as well as for Boron. The procedures along which accurate intensity measurements for B-K α must be carried out are discussed in detail. A total of 196 k-ratios with respect to elemental standards for the metal X-ray lines and 180 k-ratios for B-K α relative to elemental Boron have been obtained. These data have been used to arrive at an improved parameterization for the φ(ρz) approach in matrix correction. The resulting new program (BAS861) was compared to 5 other current correction programs. At the same occasion the available set of mass absorption coefficients for Boron was tested on its consistency and better values suggested where necessary. Finally it is shown that the modified version of the Gaussian φ(ρz) approach (BAS861 program) is highly successful in the matrix correction for B-K α : a relative root-mean-square value of 6.30% was obtained. (Auth.)

Hard Surface Layers by Pack Boriding and Gaseous Thermo-Reactive Deposition and Diffusion Treatments

DEFF Research Database (Denmark)

Christiansen, Thomas Lundin; Bottoli, Federico; Dahl, Kristian Vinter

2017-01-01

) layers with hardnesses up to 1800 HV. Titanizing of ARNE tool steel results in a surface layer consisting of TiC with a hardness of approximately 4000 HV. Duplex treatments, where boriding is combined with subsequent (TRD) titanizing, result in formation of hard TiB2 on top of a thick layer of Fe......Thermo-reactive deposition and diffusion (TRD) and boriding are thermochemical processes that result in very high surface hardness by conversion of the surface into carbides/nitrides and borides, respectively. These treatments offer significant advantages in terms of hardness, adhesion, tribo...... subjected to TRD (chromizing and titanizing) and boriding treatments. For the steels with low carbon content, chromizing results in surface alloying with chromium, i.e., formation of a (soft) “stainless” surface zone. Steels containing higher levels of carbon form chromium carbide (viz. Cr23C6, Cr7C3...

Study of microcracks morphology produced by Vickers indentation on AISI 1045 borided steels

International Nuclear Information System (INIS)

Campos, I.; Ramirez, G.; VillaVelazquez, C.; Figueroa, U.; Rodriguez, G.

2008-01-01

In this work, we analyzed the roughness morphology of indentation microcracks produced by the Vickers microindentation in the iron boride Fe 2 B. Using the paste boriding process, the boride layers were formed at the surface of AISI 1045 steels. The diffusion processes were carried out with 5 mm of boron paste thickness over the substrate surface at three different temperatures (1193, 1223 and 1273 K) with two different time exposures. The indentations in each Fe 2 B layer were made using a constant load of 200 g at four different distances from the surface. The fracture behavior of the Fe 2 B borided phase is found to be brittle in nature. The profiles of microcracks formed at the corners of the indentations were obtained using the scanning electronic microscopy and were analyzed within the framework of fractal geometry. We found that all indentation microcracks display a self-affine invariance characterized by the same roughness (Hurst) exponent H = 0.8 ± 0.1. The effect of the self-affine roughness of indentation microcracks on the measured fracture toughness is discussed within the framework of the mechanics of self-affine cracks. It is pointed out that the arrest of indentation microcracks is controlled by the fractal fracture toughness, which for the Fe 2 B borided phase is found to be K fc = 0.42 ± 0.02 MPa m 0.75 at all distances from the surface

Wear behavior of tempered and borided tool steels under various conditions

International Nuclear Information System (INIS)

Al-Haidary, T. J.; Faleh, M. N.

2000-01-01

. Tool steel 61CrV5, 50 NiCr13 and X1000Cr MoV51 were used in the first stage of this investigation. They have been treated as follows: boriding, boriding and tempering and hardening and tempering. The wear tests were conducted under fixed conditions (150 N/mm 2 , 0.48m/sec) with and without lubricant. The wear rate and coefficient of friction of 61Cr Si V5 steel have been studied in the second stage hoping to find the influence of working conditions on these parameters and then to compare these results with the case of hardening and tempering which is the usual case in the actual working field. The study gives a good indication about the improvement achieved in boriding and tempering cases (∼ 30%) as compared with hardening tempering cases in dry sliding conditions -∼5% with lubricating ones. (authors). 13 refs., 19 figs., 1 table

Kinetics of boride layers formed on the surface of AISI 4140 steel

International Nuclear Information System (INIS)

Sen, S.; Sen, U.; Bindal, C.

2004-01-01

The present study reports on boride layer growth kinetics of borided AISI 4140 steel. Steels were boronized in molten borax, boric acid and ferro-silicon bath at 1123 K 1173 K and 1223 K for 2, 4, 6 and 8 hours. Boride layer thickness ranged from 38.4 to 225 μm. Layer growth kinetics were analysed by measuring the extent of penetration of FeB and Fe 2 B sublayers as a function of boronizing time and temperature in the range of 1123-1223 K. The depth of the tips of the most deeply penetrated FeB and Fe 2 B needles are taken as measures for diffusion in the fast directions. The kinetics of the reaction, K=K 0 exp(-Q/RT) have also been determined by varying the boriding temperature and time. The results showed that K increase with boronizing temperature. Activation energy (Q) for present study was determined as 215 kj.mol -1 . The diffusion coefficient (K) ranged from 3 x 10 -9 cm 2 s -1 to 2 x 10 -8 cm 2 s -1 . Also temperature-dependent constant (K 0 ) at temperatures 1123 K, 1173 K and 1223 K was 179.4 cm 2 s -1 . (orig.)

Complete titanium substitution by boron in a tetragonal prism: exploring the complex boride series Ti(3-x)Ru(5-y)Ir(y)B(2+x) (0 ≤ x ≤ 1 and 1 theory.

Science.gov (United States)

Fokwa, Boniface P T; Hermus, Martin

2011-04-18

Polycrystalline samples and single crystals of four members of the new complex boride series Ti(3-x)Ru(5-y)Ir(y)B(2+x) (0 ≤ x ≤ 1 and 1 X-ray diffraction as well as energy- and wavelength-dispersive X-ray spectroscopy analyses. They crystallize with the tetragonal Ti(3)Co(5)B(2) structure type in space group P4/mbm (No. 127). Tetragonal prisms of Ru/Ir atoms are filled with titanium in the boron-poorest phase (Ti(3)Ru(2.9)Ir(2.1)B(2)). Gradual substitution of titanium by boron then results in the successive filling of this site by a Ti/B mixture en route to the complete boron occupation, leading to the boron-richest phase (Ti(2)Ru(2.8)Ir(2.2)B(3)). Furthermore, both ruthenium and iridium share two sites in these structures, but a clear Ru/Ir site preference is found. First-principles density functional theory calculations (Vienna ab initio simulation package) on appropriate structural models (using a supercell approach) have provided more evidence on the stability of the boron-richest and -poorest phases, and the calculated lattice parameters corroborate very well with the experimentally found ones. Linear muffin-tin orbital atomic sphere approximation calculations further supported these findings through crystal orbital Hamilton population bonding analyses, which also show that the Ru/Ir-B and Ru/Ir-Ti heteroatomic interactions are mainly responsible for the structural stability of these compounds. Furthermore, some stable and unstable phases of this complex series could be predicted using the rigid-band model. According to the density of states analyses, all phases should be metallic conductors, as was expected from these metal-rich borides.

Superconductivity in borides and carbides

International Nuclear Information System (INIS)

Muranaka, Takahiro

2007-01-01

It was thought that intermetallic superconductors do not exhibit superconductivity at temperatures over 30 K because of the Bardeen-Cooper-Schrieffer (BCS) limit; therefore, researchers have been interested in high-T c cuprates. Our group discovered high-T c superconductivity in MgB 2 at 39 K in 2001. This discovery has initiated a substantial interest in the potential of high-T c superconductivity in intermetallic compounds that include 'light' elements (borides, carbides, etc.). (author)

Structural, electronic and thermal properties of super hard ternary boride, WAlB

Science.gov (United States)

Rajpoot, Priyanka; Rastogi, Anugya; Verma, U. P.

2018-04-01

A first principle study of the structural, electronic and thermal properties of Tungsten Aluminum Boride (WAlB) using full-potential linearized augmented plane wave (FP-LAPW) in the frame work of density function theory (DFT) have been calculated. The calculated equilibrium structural parameters are in excellent agreement with available experimental results. The calculated electronic band structure reveals that WAlB is metallic in nature. The quasi-harmonic Debye model is applied to study of the temperature and pressure effect on volume, Debye temperature, thermal expansion coefficient and specific heat at constant volume and constant pressure. To the best of our knowledge theoretical investigation of these properties of WAlB is reported for the first time.

The effect of boriding on wear resistance of cold work tool steel

International Nuclear Information System (INIS)

Anzawa, Y; Koyama, S; Shohji, I

2017-01-01

Recently, boriding has attracted extensive attention as surface stiffening processing of plain steel. In this research, the influence of processing time on the formation layer of cold work tool steel (KD11MAX) by Al added fused salt bath was examined. In addition, in order to improve the abrasion resistance of KD11MAX, the effect of the treatment of boronization on the formation layer has been investigated. Boriding were performed in molten borax which contained about 10 mass% Al at processing time of 1.8 ∼ 7.2 ks (processing temperature of 1303 K). As a result of the examination, the hardness of the boriding layer becomes about 1900 HV when the processing time of 3.6 ks. Also the abrasion resistance has improved remarkably. Furthermore, it was revealed that the formation layer was boronized iron from the Vickers hardness and analysis of the X-ray diffraction measurement. (paper)

Thermodynamic properties of molybdenum borides at temperatures above 300 K

International Nuclear Information System (INIS)

Bolgar, A.S.; Blinder, A.V.; Serbova, M.I.

1990-01-01

Enthalpy of Mo 2 B, MoB, Mo 2 B 5 borides within the range of temperatures above 300 K has been experimentally studied. Parameters of temperature dependences of enthalpy, heat capacity, entropy and the reduced Gibbs energy of the studied substances are calculated within a wide range. It is stated that high-temperature heat capacity of the studied borides can be presented as a sum of the electron component, a harmonic part of the lattice component and a contribution caused by anharmonic oscillations of lattice atoms. Values of coefficients of isothermal compressibility of Mo 2 , MoB, Mo 2 B 5 within the high temperature range are estimated

Kinetics of boride layers formed on the surface of AISI 4140 steel

Energy Technology Data Exchange (ETDEWEB)

Sen, S.; Sen, U. [Sakarya Univ., Dept. of Metal Education, Sakarya (Turkey); Bindal, C. [Sakarya Univ., Dept. of Materials and Metallurgy, Sakarya (Turkey)

2004-07-01

The present study reports on boride layer growth kinetics of borided AISI 4140 steel. Steels were boronized in molten borax, boric acid and ferro-silicon bath at 1123 K 1173 K and 1223 K for 2, 4, 6 and 8 hours. Boride layer thickness ranged from 38.4 to 225 {mu}m. Layer growth kinetics were analysed by measuring the extent of penetration of FeB and Fe{sub 2}B sublayers as a function of boronizing time and temperature in the range of 1123-1223 K. The depth of the tips of the most deeply penetrated FeB and Fe{sub 2}B needles are taken as measures for diffusion in the fast directions. The kinetics of the reaction, K=K{sub 0} exp(-Q/RT) have also been determined by varying the boriding temperature and time. The results showed that K increase with boronizing temperature. Activation energy (Q) for present study was determined as 215 kj.mol{sup -1}. The diffusion coefficient (K) ranged from 3 x 10{sup -9} cm{sup 2}s{sup -1} to 2 x 10{sup -8} cm{sup 2}s{sup -1}. Also temperature-dependent constant (K{sub 0}) at temperatures 1123 K, 1173 K and 1223 K was 179.4 cm{sup 2}s{sup -1}. (orig.)

New ternary tantalum borides containing boron dumbbells: Experimental and theoretical studies of Ta{sub 2}OsB{sub 2} and TaRuB

Energy Technology Data Exchange (ETDEWEB)

Mbarki, Mohammed; Touzani, Rachid St.; Rehorn, Christian W.G.; Gladisch, Fabian C. [Institute of Inorganic Chemistry, RWTH Aachen University, D-52056 Aachen (Germany); Fokwa, Boniface P.T., E-mail: bfokwa@ucr.edu [Institute of Inorganic Chemistry, RWTH Aachen University, D-52056 Aachen (Germany); Department of Chemistry, University of California Riverside (UCR), Riverside, CA 92521 (United States)

2016-10-15

The new ternary transition metal-rich borides Ta{sub 2}OsB{sub 2} and TaRuB have been successfully synthesized by arc-melting the elements in a water-cooled crucible under an argon atmosphere. The crystal structures of both compounds were solved by single-crystal X-ray diffraction and their metal compositions were confirmed by EDX analysis. It was found that Ta{sub 2}OsB{sub 2} and TaRuB crystallize in the tetragonal Nb{sub 2}OsB{sub 2} (space group P4/mnc, no. 128) and the orthorhombic NbRuB (space group Pmma, no. 51) structure types with lattice parameters a=5.878(2) Å, c=6.857(2) Å and a=10.806(2) Å, b=3.196(1) Å, c=6.312(2) Å, respectively. Furthermore, crystallographic, electronic and bonding characteristics have been studied by density functional theory (DFT). Electronic structure relaxation has confirmed the crystallographic parameters while COHP bonding analysis indicates that B{sub 2}-dummbells are the strongest bonds in both compounds. Moreover, the formation of osmium dumbbells in Ta{sub 2}OsB{sub 2} through a Peierls distortion along the c-axis, is found to be the origin of superstructure formation. Magnetic susceptibility measurements reveal that the two phases are Pauli paramagnets, thus confirming the theoretical DOS prediction of metallic character. Also hints of superconductivity are found in the two phases, however lack of single phase samples has prevented confirmation. Furthermore, the thermodynamic stability of the two modifications of AMB (A=Nb, Ta; M =Ru, Os) are studied using DFT, as new possible phases containing either B{sub 4}- or B{sub 2}-units are predicted, the former being the most thermodynamically stable modification. - Graphical abstract: The two new ternary tantalum borides, Ta{sub 2}OsB{sub 2} and TaRuB, have been discovered. Their crystal structures contain boron dumbbells, which are the strongest bonds. Peirls distortion is found responsible for Os{sub 2}-dumbbells formation in Ta{sub 2}OsB{sub 2}. Ta{sub 2}OsB{sub 2} and

Hardness optimization of boride diffusion layer on Astm F-75 alloy using response surface methodology

Energy Technology Data Exchange (ETDEWEB)

Arguelles O, J. L.; Corona R, M. A. [Universidad Autonoma de San Luis Potosi, Doctorado Institucional en Ingenieria y Ciencia de Materiales, San Luis Potosi 78000, SLP (Mexico); Marquez H, A.; Saldana R, A. L.; Saldana R, A. [Universidad de Guanajuato, Ingenieria Mecanica Agricola DICIVA, Irapuato, Guanajuato 36500 (Mexico); Moreno P, J., E-mail: amarquez@ugto.mx [Universidad de Guanajuato, Departamento de Minas, Metalurgia y Geologia, Ex-Hacienda San Matias s/n, Guanajuato, Guanajuato 36020 (Mexico)

2017-11-01

In this study, the Response Surface Methodology (Rsm) and Central Composite Design (Ccd) were used to optimize the hardness of boride diffusion layer on Astm F-75 alloy (also called Haynes alloy). A boronizing thermochemical treatment was carried out at different temperatures and for different time periods. Hardness tests were conducted. The boride diffusion layer was verified by the X-ray diffraction (XRD) analysis indicating the formation of Co B, Co{sub 2}B, Cr B and Mo{sub 2}B phases. An optimal hardness of 3139.7 Hv was obtained for the samples subjected to the boriding process for a duration of 6.86 h at 802.4 degrees Celsius. (Author)

Growth kinetics of borided layers: Artificial neural network and least square approaches

Science.gov (United States)

Campos, I.; Islas, M.; Ramírez, G.; VillaVelázquez, C.; Mota, C.

2007-05-01

The present study evaluates the growth kinetics of the boride layer Fe 2B in AISI 1045 steel, by means of neural networks and the least square techniques. The Fe 2B phase was formed at the material surface using the paste boriding process. The surface boron potential was modified considering different boron paste thicknesses, with exposure times of 2, 4 and 6 h, and treatment temperatures of 1193, 1223 and 1273 K. The neural network and the least square models were set by the layer thickness of Fe 2B phase, and assuming that the growth of the boride layer follows a parabolic law. The reliability of the techniques used is compared with a set of experiments at a temperature of 1223 K with 5 h of treatment time and boron potentials of 2, 3, 4 and 5 mm. The results of the Fe 2B layer thicknesses show a mean error of 5.31% for the neural network and 3.42% for the least square method.

Deposition and characterization of aluminum magnesium boride thin film coatings

Science.gov (United States)

Tian, Yun

Boron-rich borides are a special group of materials possessing complex structures typically comprised of B12 icosahedra. All of the boron-rich borides sharing this common structural unit exhibit a variety of exceptional physical and electrical properties. In this work, a new ternary boride compound AlMgB14, which has been extensively studied in bulk form due to its novel mechanical properties, was fabricated into thin film coatings by pulsed laser deposition (PLD) technology. The effect of processing conditions (laser operating modes, vacuum level, substrate temperature, and postannealing, etc.) on the composition, microstructure evolution, chemical bonding, and surface morphology of AlMgB14 thin film coatings has been investigated by X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS), transmission electron microscopy (TEM), atomic force microscopy (AFM) and Fourier transform infrared (FTIR) spectrometry; the mechanical, electrical, and optical properties of AlMgB14 thin films have been characterized by nanoindentation, four-point probe, van der Pauw Hall measurement, activation energy measurement, and UV-VIS-NIR spectrophotometer. Experimental results show that AlMgB14 films deposited in the temperature range of 300 K - 873 K are amorphous. Depositions under a low vacuum level (5 x 10-5 Torr) can introduce a significant amount of C and O impurities into AlMgB14 films and lead to a complex oxide glass structure. Orthorhombic AlMgB14 phase cannot be obtained by subsequent high temperature annealing. By contrast, the orthorhombic AlMgB 14 crystal structure can be attained via high temperature-annealing of AlMgB14 films deposited under a high vacuum level (boride films, high vacuum level-as deposited AlMgB14 films also possess a low n-type electrical resistivity, which is a consequence of high carrier concentration and moderate carrier mobility. The operative electrical transport mechanism and doping behavior for high vacuum level-as deposited AlMgB14

Borides and vitreous compounds sintered as high-energy fuels

International Nuclear Information System (INIS)

Mota, J.M.; Abenojar, J.; Martinez, M.A.; Velasco, F.; Criado, A.J.

2004-01-01

Boron was chosen as fuel in view of its excellent thermodynamic values for combustion, as compared to traditional fuels. The problem of the boron in combustion is the formation of a surface layer of oxide, which delays the ignition process, reducing the performance of the rocket engine. This paper presents a high-energy fuel for rocket engines. It is composed of sintered boron (borides and carbides and vitreous compounds) with a reducing chemical agent. Borides and boron carbide were prepared since the combustion heat of the latter is similar to that of the amorphous boron (in: K.K. Kuo (Ed.), Boron-Based Solid Propellant and Solid Fuel, Vol. 427, CRC Press, Boca Raton, FL, 1993). Several chemical reducing elements were used, such as aluminum, magnesium, and coke. As the raw material for boron, different compounds were used: amorphous boron, boric acid and boron oxide

Preparation of molybdenum borides by combustion synthesis involving solid-phase displacement reactions

International Nuclear Information System (INIS)

Yeh, C.L.; Hsu, W.S.

2008-01-01

Preparation of molybdenum borides of five different phases in the Mo-B binary system (including Mo 2 B, MoB, MoB 2 , Mo 2 B 5 , and MoB 4 ) was performed by self-propagating high-temperature synthesis (SHS) with two kinds of the reactant samples. When elemental powder compacts with an exact stoichiometry corresponding to the boride phase were employed, self-sustaining reaction was only achieved in the sample with Mo:B = 1:1 and nearly single-phase MoB was yielded. Therefore, the other four boride compounds were prepared from the reactant compacts composed of MoO 3 , Mo, and B powders, within which the displacement reaction of MoO 3 with boron was involved in combustion synthesis. Experimental evidence shows that the extent of displacement reaction in the overall reaction has a significant impact on sustainability of the synthesis reaction, combustion temperature, reaction front velocity, and composition of the end product. An increase in the solid-phase displacement reaction taking place during the SHS process contributes more heat flux to the synthesis reaction, thus resulting in the increase of combustion temperature and enhancement of the reaction front velocity. Based upon the XRD analysis, formation of Mo 2 B, MoB 2 , and Mo 2 B 5 as the dominant boride phase in the end product was successful through the SHS reaction with powder compacts under appropriate stoichiometries between MoO 3 , Mo, and B. However, a poor conversion was observed in the synthesis of MoB 4 . The powder compact prepared for the production of MoB 4 yielded mostly Mo 2 B 5

Magnesium Aluminum Borides as Explosive Materials

Science.gov (United States)

2011-12-20

pestle and screened -325 mesh to remove the filter paper. However, some of the filter paper remained in this powder. Table 13 Compositions of...Property of Si-B System Ceramics,” J. Japan Soc. Pow. and Pow. Met., 41[11] 1299-1303 (1994). 53. H. Nakamura, K. Murata, T. Anan, and Y. Hara...Oxidation of Zirconium Borides,” J. Japan Explosives Society, 55[4] 142-146 (1994). 54. M. Woerle, R.Nesper, G. Mair, M. Schwarz, and H. G. von Schnering

Fluorinated cobalt for catalyzing hydrogen generation from sodium borohydride

Energy Technology Data Exchange (ETDEWEB)

Akdim, O.; Demirci, U.B.; Brioude, A.; Miele, P. [Laboratoire des Multimateriaux et Interfaces, UMR 5615 CNRS Universite Lyon 1, Universite de Lyon, 43 boulevard du 11 Novembre 1918, F-69622 Villeurbanne (France)

2009-07-15

The present paper reports preliminary results relating to a search for durable cobalt-based catalyst intended to catalyze the hydrolysis of sodium borohydride (NaBH{sub 4}). Fluorination of Co [Suda S, Sun YM, Liu BH, Zhou Y, Morimitsu S, Arai K, et al. Catalytic generation of hydrogen by applying fluorinated-metal hydrides as catalysts. Appl Phys A 2001; 72: 209-12.] has attracted our attention whereas the fluorination of Co boride has never been envisaged so far. Our first objective was to compare the reactivity of fluorinated Co with that of Co boride. We focused our attention on the formation of Co boride from fluorinated Co. Our second objective was to show the fluorination effect on the reactivity of Co. Our third objective was to find an efficient, durable Co catalyst. It was observed a limited stabilization of the Co surface by virtue of the fluorination, which made the formation of surface Co boride more difficult while the catalytic activity was unaltered. The fluorination did not affect the number of surface active sites. Nevertheless, it did not prevent the formation of Co boride. The fluorination of Co boride was inefficient. Hence, fluorination is a way to gain in stabilization of the catalytic surface but it is quite inefficient to hinder the boride formation. Accordingly, it did not permit to compare the reactivity of Co boride with that of Co. (author)

Synthesis of borides in molybdenum implanted by B+ ions under thermal and electron annealing

International Nuclear Information System (INIS)

Kazdaev, Kh.R.; Akchulakov, M.T.; Bayadilov, E.M.; Ehngel'ko, V.I.; Lazarenko, A.V.; Chebukov, E.S.

1989-01-01

The possibility of formation of borides in the near surface layers of monocrystalline molybdenum implanted by boron ions at 35 keV energy under thermal and pulsed electron annealing by an electon beam at 140 keV energy is investigated. It is found that implantation of boron ions into molybdenum with subsequent thermal annealing permits to produce both molybdenum monoboride (α-MoB) and boride (γ-Mo 2 B) with rather different formation mechanisms. Formation of the α-MoB phase occurs with the temperature elevation from the centers appeared during implantation, while the γ-Mo 2 B phase appears only on heating the implanted layers up to definite temperature as a result of the phase transformation of the solid solution into a chemical compound. Pulsed electron annealing instead of thermal annealing results mainly in formation of molybdenum boride (γ-Mo 2 B), the state of structure is determined by the degree of heating of implanted layers and their durable stay at temperatures exceeding the threshold values

Elevated temperature tensile properties of borated 304 stainless steel: Effect of boride dispersion on strength and ductility

International Nuclear Information System (INIS)

Stephens, J.J.; Sorenson, K.B.; McConnell, P.

1991-01-01

This paper has documented the increase in strain to fracture and yield strength obtained with Grade A versions of types 304B5 and 304B7 relative to their respective Grade B, counterparts. The apparent microstructural reason for these property increases is the finer dispersion of boride in the Grade A material, obtained by means of a Powder Metallurgy process, relative to the conventional Grade B material which is produced using an Ingot Metallurgy process. The area size distribution of borides can be well approximated using a log-normal distribution, with the largest boride particles in the Grade B material having areas in the range of 450--600 μm 2 . By comparison, the largest boride particles in the Grade A material have areas nearly an order of magnitude smaller than the largest particles in their Grade B counterparts. A Section III ASME B ampersand PV code case inquiry has been initiated for non-welded versions of 304B4A, 3045A and 3046A ,material

Ultrahigh stability of atomically thin metallic glasses

Energy Technology Data Exchange (ETDEWEB)

Cao, C. R.; Huang, K. Q.; Zhao, N. J.; Sun, Y. T.; Bai, H. Y.; Gu, L., E-mail: l.gu@iphy.ac.cn, E-mail: dzheng@iphy.ac.cn, E-mail: whw@iphy.ac.cn; Zheng, D. N., E-mail: l.gu@iphy.ac.cn, E-mail: dzheng@iphy.ac.cn, E-mail: whw@iphy.ac.cn; Wang, W. H., E-mail: l.gu@iphy.ac.cn, E-mail: dzheng@iphy.ac.cn, E-mail: whw@iphy.ac.cn [Institute of Physics, Chinese Academy of Sciences, Beijing 100190 (China)

2014-07-07

We report the fabrication and study of thermal stability of atomically thin ZrCu-based metallic glass films. The ultrathin films exhibit striking dynamic properties, ultrahigh thermal stability, and unique crystallization behavior with discrete crystalline nanoparticles sizes. The mechanisms for the remarkable high stability and crystallization behaviors are attributed to the dewetting process of the ultrathin film. We demonstrated a promising avenue for understanding some fundamental issues such as glassy structure, crystallization, deformation, and glass formation through atomic resolution imaging of the two dimensional like metallic glasses.

Micro-Abrasion Wear Resistance of Borided 316L Stainless Steel and AISI 1018 Steel

Science.gov (United States)

Reséndiz-Calderon, C. D.; Rodríguez-Castro, G. A.; Meneses-Amador, A.; Campos-Silva, I. E.; Andraca-Adame, J.; Palomar-Pardavé, M. E.; Gallardo-Hernández, E. A.

2017-11-01

The 316L stainless steel has high corrosion resistance but low tribological performance. In different industrial sectors (biomedical, chemical, petrochemical, and nuclear engineering), improvement upon wear resistance of 316L stainless steel components using accessible and inexpensive methods is critical. The AISI 1018 steel is widely used in industry, but its tribological performance is not the best among steels. Therefore, in this study the behavior of the borided 316L stainless steel and 1018 steel is evaluated under micro-abrasion wear. The boriding was carried out at 1223 K over 6 h of exposure time, resulting in a biphase layer composed of FeB/Fe2B phases. In order to evaluate Fe2B phase with no influence from FeB phase, AISI 1018 steel samples were borided at 1273 K for over 20 min and then diffusion annealed at 1273 K over 2 h to obtain a Fe2B mono-phase layer. Micro-abrasion wear resistance was evaluated by a commercial micro-abrasion testing rig using a mix of F-1200 SiC particles with deionized water as abrasive slurry. The obtained wear rates for FeB and Fe2B phases and for the 316L stainless steel were compared. Wear resistance of 316L stainless steel increases after boriding. The wear mechanisms for both phases and for the stainless steel were identified. Also, transient conditions for rolling and grooving abrasion were determined for the FeB and Fe2B phases.

Subminiature eddy current transducers for studying boride coatings

Science.gov (United States)

Dmitriev, S. F.; Ishkov, A. V.; Malikov, V. N.; Sagalakov, A. M.

2016-07-01

Strengthening of parts and units of machines, increased reliability and longer service life is an important task of modern mechanical engineering. The main objects of study in the work were selected steel 65G and 50HGA, wear-resistant boride coatings ternary system Fe-B-Fe n B which were investigated by scanning electron microscopy and eddy-current nondestructive methods.

Stabilization of heavy metals in Tehran agricultural land

International Nuclear Information System (INIS)

Torabian, A.; Sadeghi, Sh.

2001-01-01

In order to prevent contamination of heavy metals accumulation in soil, plant, and ground water, several methods of prevention are studied, and tested worldwide. One of the method which has not been studied and applied in Iran is stabilization of heavy metals in soil by using clay minerals. Clay minerals due to hydration properties can adsorb organic and inorganic substances. Two clay minerals were used in this research: Bentonite with chemical structure of 2 to 1 (Two layers of silica and one layer of Aluminium) with CEC equal to 85 m eq/100 grams and Kao line with chemical structure of one to one (one layer silica and one layer Aluminum) and CEC=3 m eq/100 grams of soil. The physical and chemical properties of these two kinds of clays were different. Stabilization of heavy metals with different percentages of these two clays (7%, 15%, 22%) with different p H (4,7,8,11.5) were studied. The results indicate that with increasing of stabilizing agent at p H=7.8 and greater, stabilization of heavy metals increased significantly. The results also indicate the stabilization of heavy metals decreased rapidly at p H 4 and lower. The results of this study agree with the work of pervious researchers

Comparative NMR investigation of the Re-based borides

Science.gov (United States)

Lue, C. S.; Tao, Y. F.; Su, T. H.

2008-07-01

We report a systematic study of the rhenium-based borides, ReB2 , Re7B3 , and Re3B , by means of the B11 nuclear magnetic resonance (NMR) spectroscopy. While Re7B3 and Re3B are superconductors, ReB2 exhibits no superconducting signature but is of current interest due to its superhard mechanical property. Since the major focus of this investigation is their electronic characteristics in the normal states, we performed the measurements at temperatures between 77 and 295 K. For Re7B3 and Re3B , s -character electrons were found to be responsible for the observed B11 NMR Knight shift and spin-lattice relaxation rate (1/T1) . From T1 analysis, we thus deduce the partial Bs Fermi-level density of states (DOS) of both borides. On the other hand, the relaxation rate of ReB2 is mainly associated with p electrons, similar to the cases of OsB2 and RuB2 . In addition, the extracted B2p Fermi-level DOS is in good agreement with the theoretical prediction from band-structure calculations.

Wear resistance of laser-deposited boride reinforced Ti-Nb-Zr-Ta alloy composites for orthopedic implants

International Nuclear Information System (INIS)

Samuel, Sonia; Nag, Soumya; Scharf, Thomas W.; Banerjee, Rajarshi

2008-01-01

The inherently poor wear resistance of titanium alloys limits their application as femoral heads in femoral (hip) implants. Reinforcing the soft matrix of titanium alloys (including new generation β-Ti alloys) with hard ceramic precipitates such as borides offers the possibility of substantially enhancing the wear resistance of these composites. The present study discusses the microstructure and wear resistance of laser-deposited boride reinforced composites based on Ti-Nb-Zr-Ta alloys. These composites have been deposited using the LENS TM process from a blend of elemental Ti, Nb, Zr, Ta, and boron powders and consist of complex borides dispersed in a matrix of β-Ti. The wear resistance of these composites has been compared with that of Ti-6Al-4V ELI, the current material of choice for orthopedic femoral implants, against two types of counterfaces, hard Si 3 N 4 and softer SS440C stainless steel. Results suggest a substantial improvement in the wear resistance of the boride reinforced Ti-Nb-Zr-Ta alloys as compared with Ti-6Al-4V ELI against the softer counterface of SS440. The presence of an oxide layer on the surface of these alloys and composites also appears to have a substantial effect in terms of enhanced wear resistance

Metal Stabilization of Collagen and de Novo Designed Mimetic Peptides.

Science.gov (United States)

Parmar, Avanish S; Xu, Fei; Pike, Douglas H; Belure, Sandeep V; Hasan, Nida F; Drzewiecki, Kathryn E; Shreiber, David I; Nanda, Vikas

2015-08-18

We explore the design of metal binding sites to modulate triple-helix stability of collagen and collagen-mimetic peptides. Globular proteins commonly utilize metals to connect tertiary structural elements that are well separated in sequence, constraining structure and enhancing stability. It is more challenging to engineer structural metals into fibrous protein scaffolds, which lack the extensive tertiary contacts seen in globular proteins. In the collagen triple helix, the structural adjacency of the carboxy-termini of the three chains makes this region an attractive target for introducing metal binding sites. We engineered His3 sites based on structural modeling constraints into a series of designed homotrimeric and heterotrimeric peptides, assessing the capacity of metal binding to improve stability and in the case of heterotrimers, affect specificity of assembly. Notable enhancements in stability for both homo- and heteromeric systems were observed upon addition of zinc(II) and several other metal ions only when all three histidine ligands were present. Metal binding affinities were consistent with the expected Irving-Williams series for imidazole. Unlike other metals tested, copper(II) also bound to peptides lacking histidine ligands. Acetylation of the peptide N-termini prevented copper binding, indicating proline backbone amide metal-coordination at this site. Copper similarly stabilized animal extracted Type I collagen in a metal-specific fashion, highlighting the potential importance of metal homeostasis within the extracellular matrix.

Effect of borides on hot deformation behavior and microstructure evolution of powder metallurgy high borated stainless steel

Energy Technology Data Exchange (ETDEWEB)

Zhou, Xuan [State Key Laboratory of Metastable Materials Science and Technology, College of Materials Science and Engineering, Yanshan University, Qinhuangdao 066004 (China); Wang, Mingjia, E-mail: mingjiawangysu@126.com [State Key Laboratory of Metastable Materials Science and Technology, College of Materials Science and Engineering, Yanshan University, Qinhuangdao 066004 (China); Fu, Yifeng [State Key Laboratory of Metastable Materials Science and Technology, College of Materials Science and Engineering, Yanshan University, Qinhuangdao 066004 (China); Wang, Zixi; Li, Yanmei [Yanming Alloy Roll Co. Ltd, Qinhuangdao 066004 (China); Yang, Shunkai; Zhao, Hongchang; Li, Hangbo [State Key Laboratory of Metastable Materials Science and Technology, College of Materials Science and Engineering, Yanshan University, Qinhuangdao 066004 (China)

2017-02-15

To investigate borides effect on the hot deformation behavior and microstructure evolution of powder metallurgy high borated stainless steel, hot compression tests at the temperatures of 950– 1150 °C and the strain rates of 0.01– 10 s{sup −1} were performed. Flow stress curves indicated that borides increased the material's stress level at low temperature but the strength was sacrificed at temperatures above 1100 °C. A hyperbolic-sine equation was used to characterize the dependence of the flow stress on the deformation temperature and strain rate. The hot deformation activation energy and stress exponent were determined to be 355 kJ/mol and 3.2, respectively. The main factors leading to activation energy and stress exponent of studied steel lower than those of commercial 304 stainless steel were discussed. Processing maps at the strains of 0.1, 0.3, 0.5, and 0.7 showed that flow instability mainly concentrated at 950– 1150 °C and strain rate higher than 0.6 s{sup −1}. Results of microstructure illustrated that dynamic recrystallization was fully completed at both high temperature-low strain rate and low temperature-high strain rate. In the instability region cracks were generated in addition to cavities. Interestingly, borides maintained a preferential orientation resulting from particle rotation during compression. - Highlights: •The decrement of activation energy was affected by boride and boron solution. •The decrease of stress exponent was influenced by composition and Cottrell atmosphere. •Boride represented a preferential orientation caused by particle rotation.

Comparative study of resist stabilization techniques for metal etch processing

Science.gov (United States)

Becker, Gerry; Ross, Matthew F.; Wong, Selmer S.; Minter, Jason P.; Marlowe, Trey; Livesay, William R.

1999-06-01

This study investigates resist stabilization techniques as they are applied to a metal etch application. The techniques that are compared are conventional deep-UV/thermal stabilization, or UV bake, and electron beam stabilization. The electron beam tool use din this study, an ElectronCure system from AlliedSignal Inc., ELectron Vision Group, utilizes a flood electron source and a non-thermal process. These stabilization techniques are compared with respect to a metal etch process. In this study, two types of resist are considered for stabilization and etch: a g/i-line resist, Shipley SPR-3012, and an advanced i-line, Shipley SPR 955- Cm. For each of these resist the effects of stabilization on resist features are evaluated by post-stabilization SEM analysis. Etch selectivity in all cases is evaluated by using a timed metal etch, and measuring resists remaining relative to total metal thickness etched. Etch selectivity is presented as a function of stabilization condition. Analyses of the effects of the type of stabilization on this method of selectivity measurement are also presented. SEM analysis was also performed on the features after a compete etch process, and is detailed as a function of stabilization condition. Post-etch cleaning is also an important factor impacted by pre-etch resist stabilization. Results of post- etch cleaning are presented for both stabilization methods. SEM inspection is also detailed for the metal features after resist removal processing.

Microstructure and High Temperature Mechanical Property of Fe-Cr-B Based Metal/Ceramic Composite Manufactured by Metal Injection Molding Process

Science.gov (United States)

Lee, Kee-Ahn; Gwon, Jin-Han; Yoon, Tae-Sik

2018-03-01

This study investigated the microstructure and the room and high temperature mechanical properties of Fe-Cr-B alloy manufactured by metal injection molding. In addition, hot isostatic pressing was performed to increase the density of the material, and a comparison of properties was made. Microstructural observation confirmed a bi-continuous structure composed of a three-dimensional network of α-Fe phase and (Cr,Fe)2B phase. The HIPed specimen featured a well-formed adhesion between the α-Fe phase and boride, and the number of fine pores was significantly reduced. The tensile results confirmed that the HIPed specimen (RT to 900 °C) had higher strengths compared to the as-sintered specimen, and the change of elongation starting from 700 °C was significantly greater in the HIPed specimen. Fractography suggested that cracks propagated mostly along the interface between the α-Fe matrix and boride in the as-sintered specimen, while direct fracture of boride was observed in addition to interface separation in the HIPed specimen.

Growth kinetics of boride layers formed on 99.0% purity nickel

Indian Academy of Sciences (India)

abrasion wear, corrosion and high oxidation resistance com- pared with other ... Ni and Ni-base alloys are used in various industrial plants and equipment for their high ... with 1000-grit emery paper before the boronizing process. The boriding ...

Radiation stability of colloidal metals in aqueous solutions: silver and other metals

International Nuclear Information System (INIS)

Ershov, B.G.

1998-01-01

The effect of accelerated electrons and γ-rays of 60N i on the stability of aqueous solutions of colloidal silver was studied. The threshold of absorbed dose, at which the stability dramatically decreases and coagulation of the metal occurs, was found. This critical dose corresponds to the reduction of silver ions determining the electrical potential of the sols. Radiation neutralization was also found for cadmium was not observed in the case of thallium, copper and platinum. A mechanism of the effect of radiation, taking into account the electrostatic factor in the stability of metal sols, was considered. (author)

Synthesis, crystal structure investigation and magnetism of the complex metal-rich boride series Cr{sub x}(Rh{sub 1-y}Ru{sub y}){sub 7-x}B{sub 3} (x=0.88-1; y=0-1) with Th{sub 7}Fe{sub 3}-type structure

Energy Technology Data Exchange (ETDEWEB)

Misse, Patrick R.N.; Mbarki, Mohammed [Institute of Inorganic Chemistry, RWTH Aachen University, 52066 Aachen (Germany); Fokwa, Boniface P.T., E-mail: boniface.fokwa@ac.rwth-aachen.de [Institute of Inorganic Chemistry, RWTH Aachen University, 52066 Aachen (Germany)

2012-08-15

Powder samples and single crystals of the new complex boride series Cr{sub x}(Rh{sub 1-y}Ru{sub y}){sub 7-x}B{sub 3} (x=0.88-1; y=0-1) have been synthesized by arc-melting the elements under purified argon atmosphere on a water-cooled copper crucible. The products, which have metallic luster, were structurally characterized by single-crystal and powder X-ray diffraction as well as EDX measurements. Within the whole solid solution range the hexagonal Th{sub 7}Fe{sub 3} structure type (space group P6{sub 3}mc, no. 186, Z=2) was identified. Single-crystal structure refinement results indicate the presence of chromium at two sites (6c and 2b) of the available three metal Wyckoff sites, with a pronounced preference for the 6c site. An unexpected Rh/Ru site preference was found in the Ru-rich region only, leading to two different magnetic behaviors in the solid solution: The Rh-rich region shows a temperature-independent (Pauli) paramagnetism whereas an additional temperature-dependent paramagnetic component is found in the Ru-rich region. - Graphical abstract: The new complex boride series Cr{sub x}(Rh{sub 1-y}Ru{sub y}){sub 7-x}B{sub 3} (x=0.88-1; y=0-1) has been synthesized by arc melting the elements under purified argon atmosphere. Beside the 3d/4d site preference within the whole solid solution, an unexpected Rh/Ru site preference was found in the Ru-rich region only, leading to two different magnetic behaviors: The Rh-rich region shows a temperature-independent (Pauli) paramagnetism whereas an additional temperature-dependent paramagnetic component is found in the Ru-rich region. Highlights: Black-Right-Pointing-Pointer Synthesis of a new boride series fulfilling Vegard Acute-Accent s rule. Black-Right-Pointing-Pointer 3d/4d site preference. Black-Right-Pointing-Pointer Unexpected Ru/Rh site preference. Black-Right-Pointing-Pointer Rh-rich region is Pauli paramagnetic. Black-Right-Pointing-Pointer Ru-rich region is Pauli and temperature-dependent paramagnetic.

Nanosize boride particles in heat-treated nickel base superalloys

International Nuclear Information System (INIS)

Zhang, H.R.; Ojo, O.A.; Chaturvedi, M.C.

2008-01-01

Grain boundary microconstituents in aged nickel-based superalloys were studied by transmission electron microscopy techniques. A nanosized M 5 B 3 boride phase, possibly formed by intergranular solute desegregation-induced precipitation, was positively identified. The presence of these intergranular nanoborides provides reasonable clarification of a previously reported reduction of grain boundary liquation temperature during the weld heat affected zone thermal cycle

Heavy metal stabilization in contaminated road-derived sediments.

Science.gov (United States)

Rijkenberg, Micha J A; Depree, Craig V

2010-02-01

There is increasing interest in the stabilization of heavy metals in road-derived sediments (RDS), to enable environmentally responsible reuse applications and circumvent the need for costly landfill disposal. To reduce the mobility of heavy metals (i.e. Cu, Pb and Zn) the effectiveness of amendments using phosphate, compost and fly ash addition were investigated using batch leaching experiments. In general, phosphate amendments of RDS were found to be ineffective at stabilizing heavy metals, despite being used successfully in soils. Phosphate amendment resulted in enhanced concentrations of dissolved organic carbon (DOC), which increased the solubilisation of heavy metals via complexation. Amendment with humified organic matter (compost) successfully stabilized Cu and Pb in high DOC leaching RDS with an optimum loading of 15-20% (w/w). Compost, however, was ineffective at stabilizing Zn. Increasing the pH by amending RDS/compost blends with 2.5-15% (w/w) coal fly ash resulted in the stabilization of Zn, Cu and Pb. However, above a pH of approximately 7.5 and 8 enhanced leaching of organic matter resulted in an increase in leached Cu and Pb, respectively. Accordingly, the optimum level of fly ash amendment for the RDS/compost blends was estimated to be ca. 10%. Boosted regression trees analysis (BRT) of the data revealed that DOC accounted for 56% and 65% of the Cu and Pb leaching, respectively, whereas pH only accounted for ca. 18% of Cu and Pb leaching. RDS sample characteristics (i.e. metal concentrations, size fractionation and organic matter content) were more important at reconciling the leaching concentrations of copper Cu (27%) than Pb (16%). The most important parameter explaining Zn leaching was pH. Overall, the choice of a suitable stabilization agent/s depends on the composition of RDS with respect to the amount of organic matter present, and the sorption chemistry of the heavy metal of interest. Copyright 2009 Elsevier B.V. All rights reserved.

Synergistic effect of metal deactivator and antioxidant on oxidation stability of metal contaminated Jatropha biodiesel

Energy Technology Data Exchange (ETDEWEB)

Sarin, Amit [Department of Applied Sciences, Amritsar College of Engineering and Technology, Amritsar 143001 (India); Arora, Rajneesh; Singh, N.P. [Punjab Technical University, Jalandhar (India); Sarin, Rakesh; Malhotra, R.K. [Indian Oil Corporation Ltd., R and D Centre, Sector-13, Faridabad 121007 (India); Sharma, Meeta [Indian Oil Corporation Ltd., R and D Centre, Sector-13, Faridabad 121007 (India); University School of Basic and Applied Sciences, Guru Gobind Singh Indraprastha University, Kashmere Gate, Delhi 110403 (India); Khan, Arif Ali [University School of Basic and Applied Sciences, Guru Gobind Singh Indraprastha University, Kashmere Gate, Delhi 110403 (India)

2010-05-15

Biodiesel is relatively unstable on storage and European biodiesel standard EN-14214 calls for determining oxidation stability at 110 C with a minimum induction time of 6 h by the Rancimat method (EN-14112). According to proposed National Mission on biodiesel in India, we have undertaken studies on stability of biodiesel from tree borne non-edible oil seeds Jatropha. Neat Jatropha biodiesel exhibited oxidation stability of 3.95 h. It is found possible to meet the desired EN specification for neat Jatropha biodiesel and metal contaminated Jatropha biodiesel by using antioxidants; it will have a cost implication, as antioxidants are costly chemicals. Research was conducted to increase the oxidation stability of metal contaminated Jatropha biodiesel by doping metal deactivator with antioxidant, with varying concentrations in order to meet the aforementioned standard required for oxidation stability. It was found that usage of antioxidant can be reduced by 30-50%, therefore the cost, even if very small amount of metal deactivator is doped in Jatropha biodiesel to meet EN-14112 specification. (author)

New ternary tantalum borides containing boron dumbbells: Experimental and theoretical studies of Ta2OsB2 and TaRuB

Science.gov (United States)

Mbarki, Mohammed; Touzani, Rachid St.; Rehorn, Christian W. G.; Gladisch, Fabian C.; Fokwa, Boniface P. T.

2016-10-01

The new ternary transition metal-rich borides Ta2OsB2 and TaRuB have been successfully synthesized by arc-melting the elements in a water-cooled crucible under an argon atmosphere. The crystal structures of both compounds were solved by single-crystal X-ray diffraction and their metal compositions were confirmed by EDX analysis. It was found that Ta2OsB2 and TaRuB crystallize in the tetragonal Nb2OsB2 (space group P4/mnc, no. 128) and the orthorhombic NbRuB (space group Pmma, no. 51) structure types with lattice parameters a=5.878(2) Å, c=6.857(2) Å and a=10.806(2) Å, b=3.196(1) Å, c=6.312(2) Å, respectively. Furthermore, crystallographic, electronic and bonding characteristics have been studied by density functional theory (DFT). Electronic structure relaxation has confirmed the crystallographic parameters while COHP bonding analysis indicates that B2-dummbells are the strongest bonds in both compounds. Moreover, the formation of osmium dumbbells in Ta2OsB2 through a Peierls distortion along the c-axis, is found to be the origin of superstructure formation. Magnetic susceptibility measurements reveal that the two phases are Pauli paramagnets, thus confirming the theoretical DOS prediction of metallic character. Also hints of superconductivity are found in the two phases, however lack of single phase samples has prevented confirmation. Furthermore, the thermodynamic stability of the two modifications of AMB (A=Nb, Ta; M =Ru, Os) are studied using DFT, as new possible phases containing either B4- or B2-units are predicted, the former being the most thermodynamically stable modification.

Process Stability of Ultrasonic-Wave-Assisted Gas Metal Arc Welding

Science.gov (United States)

Fan, Chenglei; Xie, Weifeng; Yang, Chunli; Lin, Sanbao; Fan, Yangyang

2017-10-01

As a newly developed arc welding method, ultrasonic-wave-assisted arc welding successfully introduced power ultrasound into the arc and weld pool, during which the ultrasonic acts on the top of the arc in the coaxial alignment direction. The advanced process for molten metals can be realized by using an additional ultrasonic field. Compared with the conventional gas metal arc welding (GMAW), the welding arc is compressed, the droplet size is decreased, and the droplet transfer frequency is increased significantly in ultrasonic-wave-assisted GMAW (U-GMAW). However, the stability of the metal transfer has deep influence on the welding quality equally, and the ultrasonic wave effect on the stability of the metal transfer is a phenomenon that is not completely understood. In this article, the stabilities of the short-circuiting transfer process and globular transfer process are studied systematically, and the effect of ultrasonic wave on the metal transfer is analyzed further. The transfer frequency and process stability of the U-GMAW process are much higher than those of the conventional GMAW. Analytical results show that the additional ultrasonic wave is helpful for improving welding stability.

Metals and Alloys Material Stabilization Process Plan

Energy Technology Data Exchange (ETDEWEB)

RISENMAY, H.R.; BURK, R.A.

2000-05-18

This Plan outlines the process for brushing metal and alloys in accordance with the path forward discussed in the Integrated Project Management Plan for the Plutonium Finishing Plant Stabilization and Deactivation Project, HNF-3617, and requirements set forth in the Project Management Plan for Materials Stabilization, HNF-3605. This plan provides the basis for selection of the location to process, the processes involved, equipment to be used, and the characterization of the contents of the can. The scope of the process is from retrieval of metals and alloys from storage to transfer back to storage in a repackaged configuration.

Metals and Alloys Material Stabilization Process Plan

International Nuclear Information System (INIS)

RISENMAY, H.R.; BURK, R.A.

2000-01-01

This Plan outlines the process for brushing metal and alloys in accordance with the path forward discussed in the Integrated Project Management Plan for the Plutonium Finishing Plant Stabilization and Deactivation Project, HNF-3617, and requirements set forth in the Project Management Plan for Materials Stabilization, HNF-3605. This plan provides the basis for selection of the location to process, the processes involved, equipment to be used, and the characterization of the contents of the can. The scope of the process is from retrieval of metals and alloys from storage to transfer back to storage in a repackaged configuration

Computer simulation of monolayer growth kinetics of Fe2B phase during the paste-boriding process: Influence of the paste thickness

International Nuclear Information System (INIS)

Keddam, M.

2006-01-01

This paper deals with the effect of boron paste thickness on the study of the monolayer growth kinetics of Fe 2 B phase forming on AISI 1045 steel by the paste-boriding process. A mathematical diffusion model based on the Fick's phenomenological equations was applied in order to estimate the growth rate constant at (Fe 2 B/γ-Fe) interface, the layer thickness of iron boride as well as the associated mass gain depending on the boriding parameters such as time, temperature and surface boron concentration related to the boron paste thickness. The simulation results are found to be in a fairly good agreement with the experimental data derived from the literature

Increasing the Stability of Metal-Organic Frameworks

Directory of Open Access Journals (Sweden)

Mathieu Bosch

2014-01-01

Full Text Available Metal-organic frameworks (MOFs are a new category of advanced porous materials undergoing study by many researchers for their vast variety of both novel structures and potentially useful properties arising from them. Their high porosities, tunable structures, and convenient process of introducing both customizable functional groups and unsaturated metal centers have afforded excellent gas sorption and separation ability, catalytic activity, luminescent properties, and more. However, the robustness and reactivity of a given framework are largely dependent on its metal-ligand interactions, where the metal-containing clusters are often vulnerable to ligand substitution by water or other nucleophiles, meaning that the frameworks may collapse upon exposure even to moist air. Other frameworks may collapse upon thermal or vacuum treatment or simply over time. This instability limits the practical uses of many MOFs. In order to further enhance the stability of the framework, many different approaches, such as the utilization of high-valence metal ions or nitrogen-donor ligands, were recently investigated. This review details the efforts of both our research group and others to synthesize MOFs possessing drastically increased chemical and thermal stability, in addition to exemplary performance for catalysis, gas sorption, and separation.

Electrosynthesis of tantalum borides in oxygen-free and oxygen-containing fluoride melts

DEFF Research Database (Denmark)

Polyakova, L.P.; Polyakov, E.G.; Makarova, O.V.

2001-01-01

Results of electrosynthesis of tantalum borides in fluoride and oxyfluoride melts are compared. It is shown that the single-phase X-ray-amorphous micro-layered coatings form only in the latter case. Linear and square-wave voltammetry, complemented by X-ray diffraction analysis, IR spectroscopy...

Metal stabilization of collagen and de novo designed mimetic peptides

OpenAIRE

Parmar, Avanish S.; Xu, Fei; Pike, Douglas H.; Belure, Sandeep V.; Hasan, Nida F.; Drzewiecki, Kathryn E.; Shreiber, David I.; Nanda, Vikas

2015-01-01

We explore the design of metal binding sites to modulate triple-helix stability of collagen and collagen-mimetic peptides. Globular proteins commonly utilize metals to connect tertiary structural elements that are well separated in sequence, constraining structure and enhancing stability. It is more challenging to engineer structural metals into fibrous protein scaffolds, which lack the extensive tertiary contacts seen in globular proteins. In the collagen triple helix, the structural adjacen...

PREFACE: The 16th International Symposium on Boron, Borides and Related Materials (ISBB 2008)

Science.gov (United States)

Tanaka, Takaho

2009-07-01

This volume of Journal of Physics: Conference Series contains invited and contributed peer-reviewed papers that were presented at the 16th International Symposium on Boron, Borides and Related Materials (ISBB 2008), which was held on 7-12 September 2008, at Kunibiki Messe, Matsue, Japan. This triennial symposium has a half-century long history starting from the 1st meeting in 1959 at Asbury Park, New Jersey. We were very pleased to organize ISBB 2008, which gathered chemists, physicists, materials scientists as well as diamond and high-pressure researchers. This meeting had a strong background in the boron-related Japanese research history, which includes the discovery of superconductivity in MgB2 and development of Nd-Fe-B hard magnets and of YB66 soft X-ray monochromator. The scope of ISBB 2008 spans both basic and applied interdisciplinary research that is centered on boron, borides and related materials, and the collection of articles defines the state of the art in research on these materials. The topics are centered on: 1. Preparation of new materials (single crystals, thin films, nanostructures, ceramics, etc) under normal or extreme conditions. 2. Crystal structure and chemical bonding (new crystal structures, nonstoichiometry, defects, clusters, quantum-chemical calculations). 3. Physical and chemical properties (band structure, phonon spectra, superconductivity; optical, electrical, magnetic, emissive, mechanical properties; phase diagrams, thermodynamics, catalytic activity, etc) in a wide range of temperatures and pressures. 4. Applications and prospects (thermoelectric converters, composites, ceramics, coatings, etc) There were a few discoveries of new materials, such as nanomaterials, and developments in applications. Many contributions were related to 4f heavy Fermion systems of rare-earth borides. Exotic mechanisms of magnetism and Kondo effects have been discussed, which may indicate another direction of development of boride. Two special sessions

Suppression of Boride Formation in Transient Liquid Phase Bonding of Pairings of Parent Superalloy Materials with Different Compositions and Grain Structures and Resulting Mechanical Properties

Science.gov (United States)

Steuer, Susanne; Singer, Robert F.

2014-07-01

Two Ni-based superalloys, columnar grained Alloy 247 and single-crystal PWA1483, are joined by transient liquid phase bonding using an amorphous brazing foil containing boron as a melting point depressant. At lower brazing temperatures, two different morphologies of borides develop in both base materials: plate-like and globular ones. Their ratio to each other is temperature dependent. With very high brazing temperatures, the deleterious boride formation in Alloy 247 can be totally avoided, probably because the three-phase-field moves to higher alloying element contents. For the superalloy PWA1483, the formation of borides cannot be completely avoided at high brazing temperatures as incipient melting occurs. During subsequent solidification of these areas, Chinese-script-like borides precipitate. The mechanical properties (tensile tests at room and elevated temperatures and short-term creep rupture tests at elevated temperatures) for brazed samples without boride precipitation are very promising. Tensile strengths and creep times to 1 pct strain are comparable, respectively, higher than the ones of the weaker parent material for all tested temperatures and creep conditions (from 90 to 100 pct rsp. 175 to 250 pct).

Effects of process parameters on tungsten boride production from WO{sub 3} by self propagating high temperature synthesis

Energy Technology Data Exchange (ETDEWEB)

Yazici, Sertac [Metallurgical and Materials Engineering Department, Istanbul Technical University, Maslak, Istanbul 34469 (Turkey); Derin, Bora, E-mail: bderin@itu.edu.tr [Metallurgical and Materials Engineering Department, Istanbul Technical University, Maslak, Istanbul 34469 (Turkey)

2013-01-01

Highlights: Black-Right-Pointing-Pointer We produced tungsten boride compounds by SHS method. Black-Right-Pointing-Pointer Mg containing byproducts were leached out by using a hot aqueous HCl media. Black-Right-Pointing-Pointer The ratio of W{sub 2}B{sub 5}/WB was found to be {approx}2.0 containing minor phases of W{sub 2}B and W. - Abstract: In the present study, the production parameters of tungsten boride compounds by self-propagating high-temperature synthesis (SHS) method and following leaching process were investigated. In the SHS stage, the products consisting of tungsten borides, magnesium oxide, magnesium borate, and also minor compounds were obtained by using different initial molar ratios of WO{sub 3}, Mg and B{sub 2}O{sub 3} as starting materials. In the leaching step, Mg containing byproducts, i.e. MgO and Mg{sub 3}B{sub 2}O{sub 6}, existed in the selected SHS product synthesized at 1:8:2.5 initial molar ratio of WO{sub 3}:Mg:B{sub 2}O{sub 3} were leached out by using aqueous HCl solution to obtain clean tungsten boride compounds at different experimental parameters which are time, acid concentration and temperature. The acid leaching experiments of the SHS product showed that optimum leaching conditions could be achieved by using 5.8 M HCl at 1/10 S/L ratio and the temperature of 80 Degree-Sign C for 60 min.

Half-Metallic Ferromagnetism and Stability of Transition Metal Pnictides and Chalcogenides

Science.gov (United States)

Liu, Bang-Gui

It is highly desirable to explore robust half-metallic ferromagnetic materials compatible with important semiconductors for spintronic applications. A state-of-the-art full potential augmented plane wave method within the densityfunctional theory is reliable enough for this purpose. In this chapter we review theoretical research on half-metallic ferromagnetism and structural stability of transition metal pnictides and chalcogenides. We show that some zincblende transition metal pnictides are half-metallic and the half-metallic gap can be fairly wide, which is consistent with experiment. Systematic calculations reveal that zincblende phases of CrTe, CrSe, and VTe are excellent half-metallic ferromagnets. These three materials have wide half-metallic gaps, are low in total energy with respect to the corresponding ground-state phases, and, importantly, are structurally stable. Halfmetallic ferromagnetism is also found in wurtzite transition metal pnictides and chalcogenides and in transition-metal doped semiconductors as well as deformed structures. Some of these half-metallic materials could be grown epitaxially in the form of ultrathin .lms or layers suitable for real spintronic applications.

Synthesis of metallic nanoshells on porphyrin-stabilized emulsions

Science.gov (United States)

Wang, Haorong [Albuquerque, NM; Song, Yujiang [Albuquerque, NM; Shelnutt, John A [Tijeras, NM; Medforth, Craig J [Winters, CA

2011-12-13

Metal nanostructures formed by photocatalytic interfacial synthesis using a porphyrin-stabilized emulsion template and the method for making the nanostructures. Catalyst-seeded emulsion droplets are employed as templates for hollow-nanoshell growth. The hollow metal nanospheres may be formed with or without inclusions of other materials.

Point defect stability in a semicoherent metallic interface

Science.gov (United States)

González, C.; Iglesias, R.; Demkowicz, M. J.

2015-02-01

We present a comprehensive density functional theory (DFT) -based study of different aspects of one vacancy and He impurity atom behavior at semicoherent interfaces between the low-solubility transition metals Cu and Nb. Such interfaces have not been previously modeled using DFT. A thorough analysis of the stability and mobility of the two types of defects at the interfaces and neighboring internal layers has been performed and the results have been compared to the equivalent cases in the pure metallic matrices. The different behavior of fcc and bcc metals on both sides of the interface has been specifically assessed. The modeling effort undertaken is the first attempt to study the stability and defect energetics of noncoherent Cu/Nb interfaces from first principles, in order to assess their potential use in radiation-resistant materials.

Determination of stability constants of aminoglycoside antibiotics with their metal complexes

Science.gov (United States)

Tiwow, Vanny M. A.

2014-03-01

One group of aminoglycoside antibiotics contains aminosugars. The aminosugar neomycin B with its derivate product neamine (2-Deoxy-4-0-(2,6-diamino-2,6-dideoxy-α-D-glucopyranosyl)-D-Streptamine) was identified as a free ligands and metal complexes. In particular, the stability constants of metal complexes by potentiometric titration techniques were investigated. Our previous study had determined the acid dissociation constants of these aminosugars with few metal complexes in fair depth. In this work, the complexation of two pyridine-containing amino alcohols and an amino sugar (neamine) have been measured potentiometrically. For instance, the stability constant of copper(II) complexation were determine and the model system generated an excellent fit. Stability constants with several metals have been determined and will be reported.

Synthesis, crystal structure investigation and magnetism of the complex metal-rich boride series Crx(Rh1-yRuy)7-xB3 (x=0.88-1; y=0-1) with Th7Fe3-type structure

Science.gov (United States)

Misse, Patrick R. N.; Mbarki, Mohammed; Fokwa, Boniface P. T.

2012-08-01

Powder samples and single crystals of the new complex boride series Crx(Rh1-yRuy)7-xB3 (x=0.88-1; y=0-1) have been synthesized by arc-melting the elements under purified argon atmosphere on a water-cooled copper crucible. The products, which have metallic luster, were structurally characterized by single-crystal and powder X-ray diffraction as well as EDX measurements. Within the whole solid solution range the hexagonal Th7Fe3 structure type (space group P63mc, no. 186, Z=2) was identified. Single-crystal structure refinement results indicate the presence of chromium at two sites (6c and 2b) of the available three metal Wyckoff sites, with a pronounced preference for the 6c site. An unexpected Rh/Ru site preference was found in the Ru-rich region only, leading to two different magnetic behaviors in the solid solution: The Rh-rich region shows a temperature-independent (Pauli) paramagnetism whereas an additional temperature-dependent paramagnetic component is found in the Ru-rich region.

Metal-dielectric interfaces in gigascale electronics thermal and electrical stability

CERN Document Server

He, Ming

2012-01-01

Metal-dielectric interfaces are ubiquitous in modern electronics. As advanced gigascale electronic devices continue to shrink, the stability of these interfaces is becoming an increasingly important issue that has a profound impact on the operational reliability of these devices. In this book, the authors present the basic science underlying  the thermal and electrical stability of metal-dielectric interfaces and its relationship to the operation of advanced interconnect systems in gigascale electronics. Interface phenomena, including chemical reactions between metals and dielectrics, metallic-atom diffusion, and ion drift, are discussed based on fundamental physical and chemical principles. Schematic diagrams are provided throughout the book to illustrate  interface phenomena and the principles that govern them. Metal-Dielectric Interfaces in Gigascale Electronics  provides a unifying approach to the diverse and sometimes contradictory test results that are reported in the literature on metal-dielectric i...

Microbial exopolysaccharide-mediated synthesis and stabilization of metal nanoparticles.

Science.gov (United States)

Sathiyanarayanan, Ganesan; Dineshkumar, Krishnamoorthy; Yang, Yung-Hun

2017-11-01

Exopolysaccharides (EPSs) are structurally and functionally valuable biopolymer secreted by different prokaryotic and eukaryotic microorganisms in response to biotic/abiotic stresses and to survive in extreme environments. Microbial EPSs are fascinating in various industrial sectors due to their excellent material properties and less toxic, highly biodegradable, and biocompatible nature. Recently, microbial EPSs have been used as a potential template for the rapid synthesis of metallic nanoparticles and EPS-mediated metal reduction processes are emerging as simple, harmless, and environmentally benign green chemistry approaches. EPS-mediated synthesis of metal nanoparticles is a distinctive metabolism-independent bio-reduction process due to the formation of interfaces between metal cations and the polyanionic functional groups (i.e. hydroxyl, carboxyl and amino groups) of the EPS. In addition, the range of physicochemical features which facilitates the EPS as an efficient stabilizing or capping agents to protect the primary structure of the metal nanoparticles with an encapsulation film in order to separate the nanoparticle core from the mixture of composites. The EPS-capping also enables the further modification of metal nanoparticles with expected material properties for multifarious applications. The present review discusses the microbial EPS-mediated green synthesis/stabilization of metal nanoparticles, possible mechanisms involved in EPS-mediated metal reduction, and application prospects of EPS-based metal nanoparticles.

Enhanced X-ray yields in PIXE analysis of some binary metal fluorides

International Nuclear Information System (INIS)

Peisach, M.; Pineda, C.A.; Pillay, A.E.

1993-01-01

Enhanced X-ray yields from the metal components of homogeneous thick targets of binary metal fluorides were observed during PIXE irradiations with protons, deuterons and 3 He ions. The absence of these effects in the pure metals and in the corresponding metal oxides, nitrides and borides suggests that the fluoride component in such compounds plays a key role in producing the enhancement. Coulomb excitation of the extremely low-lying levels of the fluorine nucleus is discussed as a possible mechanism for the improved yields via secondary excitation. (orig.)

The complex metal-rich boride Ti1+xRh2-x+yIr3-yB3 (x=0.68, y=1.06) with a new structure type containing B4 zigzag fragments: Synthesis, crystal chemistry and theoretical calculations

Science.gov (United States)

Goerens, Christian; Fokwa, Boniface P. T.

2012-08-01

Polycrystalline samples and single crystals of the new complex boride Ti1+xRh2-x+yIr3-yB3 (x=0.68; y=1.06) were synthesized by arc-melting the elements in a water-cooled copper crucible under an argon atmosphere and characterized by X-Ray diffraction as well as EDX measurements. The crystal structure was refined on the basis of single crystal data. The new phase, which represents a new structure type containing trans zigzag B4 fragments as well as isolated boron atoms crystallizes in the orthorhombic space group Pbam (Nr. 55) with the lattice parameters a=8.620(1) Å, b=14.995(2) Å and c=3.234(1) Å. First-principles density functional theory calculations using the Vienna ab-initio simulation package (VASP) were performed on an appropriate structural model (using a supercell approach) and the experimental crystallographic data could be reproduced accurately. Based on this model, the density of states and crystal orbital Hamilton population (for bonding analysis) were calculated, using the linear muffin-tin orbital atomic sphere approximation (LMTO-ASA) method. According to these calculations, this metal-rich compound should be metallic, as expected. Furthermore, very strong boron-boron interactions are observed in the trans zigzag B4 fragment, which induce a clear differentiation of two types of metal-boron contacts with different strength. The observed three-dimensional metal-metal interaction is in good agreement with the predicted metallic behavior.

Surface decoration through electrostatic interaction leading to enhanced reactivity: Low temperature synthesis of nanostructured chromium borides (CrB and CrB2)

International Nuclear Information System (INIS)

Menaka,; Kumar, Bharat; Kumar, Sandeep; Ganguli, A.K.

2013-01-01

The present study describes a novel low temperature route at ambient pressure for the synthesis of nanocrystalline chromium borides (CrB and CrB 2 ) without using any flux or additives. The favorable and intimate mixing of nanoparticles of chromium acetate (Cr source) and boron forms an active chromium–boron precursor which decomposes at much lower temperature (400 °C) to form CrB (which is ∼1000 °C less than the known ambient pressure synthesis). The chromium acetate nanoparticles (∼5 nm) decorate the larger boron particles (150–200 nm) due to electrostatic interactions resulting from opposing surface charges of boron (zeta potential:+48.101 mV) and chromium acetate (zeta potential:−4.021 mV) in ethanolic medium and is evident in the TEM micrographs. The above method leads to the formation of pure CrB film like structure at 400 °C and nanospheres (40–60 nm) at 600 °C. Also, chromium diboride (CrB 2 ) nanoparticles (25 nm) could be obtained at 1000 °C. - Graphical abstract: Variation of surface charge of reactants, precursor and the products, chromium borides (CrB and CrB 2 ). Highlights: ► Novel borothermal reduction process for synthesis of chromium boride. ► Significant lowering of reaction temperature to obtain nanocrystalline chromium boride. ► Enhanced reactivity due to appropriate surface interactions

Development of high temperature stable Ohmic and Schottky contacts on n-gallium nitride

Science.gov (United States)

Khanna, Rohit

compounds. The barrier height obtained on n GaN was ˜0-5-0.6 eV which was low compared to those obtained by Pt or Ni. This barrier height is too low for use as a gate contact and they can only have limited use, perhaps, in gas sensors where large leakage current can be tolerated in exchange for better thermal reliability. AlGaN/GaN High Electron Mobility Transistors (HEMTs) were fabricated with Ti/Al/TiB2/Ti/Au source/drain ohmic contacts and a variety of gate metal schemes (Pt/Au, Ni/Au, Pt/TiB2/Au or Ni/TiB 2/Au) and were subjected to long-term annealing at 350°C. By comparison with companion devices with conventional Ti/Al/Pt/Au ohmic contacts and Pt/Au gate contacts, the HEMTs with boride-based ohmic metal and either Pt/Au, Ni/Au or Ni/TiB2/Au gate metal showed superior stability of both source-drain current and transconductance after 25 days aging at 350°C. The need for sputter deposition of the borides causes' problem in achieving significantly lower specific contact resistance than with conventional schemes deposited using e-beam evaporation. The borides also seem to be, in general, good getters for oxygen leading to sheet resistivity issues. Ir/Au Schottky contacts and Ti/Al/Ir/Au ohmic contacts on n-type GaN were investigated as a function of annealing temperature and compared to their more common Ni-based counterparts. The Ir/Au ohmic contacts on n-type GaN with n˜1017 cm-3 exhibited barrier heights of 0.55 eV after annealing at 700°C and displayed less intermixing of the contact metals compared to Ni/Au. A minimum specific contact resistance of 1.6 x 10-6 O.cm2 was obtained for the ohmic contacts on n-type GaN with n˜1018 cm-3 after annealing at 900°C. The measurement temperature dependence of contact resistance was similar for both Ti/Al/Ir/Au and Ti/Al/Ni/Au, suggesting the same transport mechanism was present in both types of contacts. The Ir-based ohmic contacts displayed superior thermal aging characteristics at 350°C. Auger Electron Spectroscopy

The Effects of a High Magnetic Field on the Annealing of [(Fe0.5Co0.50.75B0.2Si0.05]96Nb4 Bulk Metallic Glass

Directory of Open Access Journals (Sweden)

Peng Jia

2016-11-01

Full Text Available In contrast with amorphous alloys, nanocrystalline soft magnetic materials show improved thermal stability and higher soft magnetic properties. The nanocrystalline soft magnetic composites are usually fabricated by partially crystallizing from parent amorphous alloys. This paper reports our experimental observation on the sequence of crystallization in metallic glass under a high magnetic field (HMF. An application of a HMF to bulk metallic glass (BMG of [(Fe0.5Co0.50.75B0.2Si0.05]96Nb4 prioritizes the precipitation of α-(Fe,Co phase separated from the subsequent precipitation of borides, (Fe,Co23B6, upon isothermal annealing at a glass transition temperature. Furthermore, it was observed that, through the annealing treatment under a HMF, a soft magnetic nanocomposite, in which only α-(Fe,Co phase uniformly distributes in amorphous matrix, was achieved for boron-bearing BMG. The promotion of the α-Fe or (Fe,Co phase and the prevention of the boride phases during the isothermal annealing process help to produce high-quality soft magnetic nanocomposite materials. The mechanism by which a HMF influences the crystallization sequence was interpreted via certain changes in Gibbs free energies for two ferromagnetic phases. This finding evidences that the annealing treatment under a HMF is suitable for enhancing the soft magnetic properties of high B content (Fe,Co-based bulk amorphous and nanocrystalline materials.

Stability of bulk metallic glass structure

Energy Technology Data Exchange (ETDEWEB)

Jain, H.; Williams, D.B.

2003-06-18

The fundamental origins of the stability of the (Pd-Ni){sub 80}P{sub 20} bulk metallic glasses (BMGs), a prototype for a whole class of BMG formers, were explored. While much of the properties of their BMGs have been characterized, their glass-stability have not been explained in terms of the atomic and electronic structure. The local structure around all three constituent atoms was obtained, in a complementary way, using extended X-ray absorption fine structure (EXAFS), to probe the nearest neighbor environment of the metals, and extended energy loss fine structure (EXELFS), to investigate the environment around P. The occupied electronic structure was investigated using X-ray photoelectron spectroscopy (XPS). The (Pd-Ni){sub 80}P{sub 20} BMGs receive their stability from cumulative, and interrelated, effects of both atomic and electronic origin. The stability of the (Pd-Ni){sub 80}P{sub 20} BMGs can be explained in terms of the stability of Pd{sub 60}Ni{sub 20}P{sub 20} and Pd{sub 30}Ni{sub 50}P{sub 20}, glasses at the end of BMG formation. The atomic structure in these alloys is very similar to those of the binary phosphide crystals near x=0 and x=80, which are trigonal prisms of Pd or Ni atoms surrounding P atoms. Such structures are known to exist in dense, randomly-packed systems. The structure of the best glass former in this series, Pd{sub 40}Ni{sub 40}P{sub 20} is further described by a weighted average of those of Pd{sub 30}Ni{sub 50}P{sub 20} and Pd{sub 60}Ni{sub 20}P{sub 20}. Bonding states present only in the ternary alloys were found and point to a further stabilization of the system through a negative heat of mixing between Pd and Ni atoms. The Nagel and Tauc criterion, correlating a decrease in the density of states at the Fermi level with an increase in the glass stability, was consistent with greater stability of the Pd{sub x}Ni{sub (80-x)}P{sub 20} glasses with respect to the binary alloys of P. A valence electron concentration of 1.8 e/a, which

Formation of boride layers on steel substrates

International Nuclear Information System (INIS)

Stergioudis, G.

2006-01-01

Boronizing coatings were prepared by means of pack cementation technique. It was found that using the appropriate substrate and controlling parameters of the boribing process such as boron activity of the mixture, temperature and time of treatment, it is possible to obtain a structure predominantly consisting of the Fe 2 B phase. In the present study low alloy ferritic steels were chosen as substrates. Changing the boron carbide concentration in the mixture and the temperature and time of boronizing process the conditions of the boronizing were altered. As a result the formation of the Fe 2 B phase is enhanced. Characterization of the as-borided steels is discussed based on X-ray diffraction and Curie temperature measurements. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Assessing fly ash treatment: Remediation and stabilization of heavy metals

DEFF Research Database (Denmark)

Lima, A.T.; Ottosen, Lisbeth M.; Ribeiro, Alexandra B.

2012-01-01

Fly ashes from Municipal Solid Waste (MSW), straw (ST) and co-combustion of wood (CW) are here analyzed with the intent of reusing them. Two techniques are assessed, a remediation technique and a solidification/stabilization one. The removal of heavy metals from fly ashes through the electrodialy......Fly ashes from Municipal Solid Waste (MSW), straw (ST) and co-combustion of wood (CW) are here analyzed with the intent of reusing them. Two techniques are assessed, a remediation technique and a solidification/stabilization one. The removal of heavy metals from fly ashes through...

Dynamic stabilization of imploding liquid metal liner

International Nuclear Information System (INIS)

Itoh, Yasuyuki; Fujiie, Yoichi

1979-01-01

The rotational stabilization has been proposed against the Rayleigh-Taylor instability of the imploding liquid metal liner. In this paper, the discussion is made on the possibility of the dynamic stabilization by applying the oscillating azimuthal magnetic field in addition to the axial field. In contrast to the rotational stabilization, the required (field) energy for this stabilization is also used for the liner driving or the plasma confinement. In the analysis, the liner subjected to the acceleration is assumed to be infinitely long, at rest and have the situation at the start of the implosion or turnaround. At turnaround, the existence of the plasma is taken into account. The perturbed motion of the liner is discussed with a linear stability analysis. Results are as follows: (1) The dynamic stabilization at the start of the implosion is possible if the distance from the conducting wall to the liner outer surface is comparable with or less than the liner thickness. (2) At turnaround, the stability is improved with decreasing the ratio of the plasma radius to that of the liner inner surface however the kink mode (m = 1) cannot be suppressed. (author)

The effect of environmental conditions on the stability of heavy metal-filter material complex as assessed by the leaching of adsorbed metal ions

Energy Technology Data Exchange (ETDEWEB)

Khokhotva, Oleksandr, E-mail: khokhotva@bigmir.net [School of Sustainable Development of Society and Technology, Maelardalen University, Box 883, SE-721 23, Vaesteras (Sweden); Waara, Sylvia, E-mail: sylvia.waara@hh.se [School of Sustainable Development of Society and Technology, Maelardalen University, Box 883, SE-721 23, Vaesteras (Sweden)

2011-06-15

In this study the influence of environmental conditions, most likely prevailing in filter beds used for intermittently discharged pollutant streams such as landfill leachate and storm water, on the stability of the heavy metal-filter complex was investigated for 2 filter materials; non-treated and urea treated pine bark, using leaching experiments. The metal-filter complex stability was higher for urea treated than for non-treated pine bark and dependent on the metal adsorbed. The type of environmental condition applied was of less importance for the extent of leaching. - Highlights: > Metal-pine bark complex stability under changing environmental conditions is studied. > Metal leaching from non-treated bark is much higher than from urea-treated bark. > No significant influence of changing environmental conditions on the leaching extent. > Metal leaching from wet bark samples exposed to freezing is somewhat higher.> Zn leaching is the highest and Cu leaching is the lowest for both bark samples. - The study assess the metal-filter material complex stability when metal removal using filter material is used in locations with fluctuating environmental conditions.

The effect of environmental conditions on the stability of heavy metal-filter material complex as assessed by the leaching of adsorbed metal ions

International Nuclear Information System (INIS)

Khokhotva, Oleksandr; Waara, Sylvia

2011-01-01

In this study the influence of environmental conditions, most likely prevailing in filter beds used for intermittently discharged pollutant streams such as landfill leachate and storm water, on the stability of the heavy metal-filter complex was investigated for 2 filter materials; non-treated and urea treated pine bark, using leaching experiments. The metal-filter complex stability was higher for urea treated than for non-treated pine bark and dependent on the metal adsorbed. The type of environmental condition applied was of less importance for the extent of leaching. - Highlights: → Metal-pine bark complex stability under changing environmental conditions is studied. → Metal leaching from non-treated bark is much higher than from urea-treated bark. → No significant influence of changing environmental conditions on the leaching extent. → Metal leaching from wet bark samples exposed to freezing is somewhat higher.→ Zn leaching is the highest and Cu leaching is the lowest for both bark samples. - The study assess the metal-filter material complex stability when metal removal using filter material is used in locations with fluctuating environmental conditions.

Synthesis and characterization of new metal-rich borides with boron fragments; Synthese und Charakterisierung von neuartigen metallreichen Boriden mit Borfragmenten

Energy Technology Data Exchange (ETDEWEB)

Mbarki, Mohammed

2016-03-30

The present dissertation deals with the synthesis and characterization of new metal-rich borides of the Ce{sub 7}Ni{sub 5±x}Ge{sub 3±x}In{sub 6{sup -}}, Nb{sub 2}OsB{sub 2{sup -}} and NbRuB-type.The samples are synthesized by a solid state reaction route from elements using an electric arc furnace. The structural characterization of the compounds was carried out by using X-ray diffraction methods on powder samples and single crystals. The chemical composition of single-crystals was verified by EDX analyses. Moreover, the magnetic properties of suitable samples were investigated by SQUID magnetometry.The crystal structure of compounds with the nominal composition NbFe{sub 1-x}Ir{sub 6+x}B{sub 8} is successfully solved from single crystal X-ray data. The most prominent feature in this structure are one-dimensional chains along the c-axis formed by the magnetically active element iron on a site of mixed occupation with Iridium (Fe: Ir = 0.77 (2) 0.23 (2)). Thermomagnetic investigations reveal, that ferromagnetic ordering is observed below the Curie temperature (TC) of 350 K. Theoretical investigations suggest that the iron-chains are mainly responsible for the ferromagnetic ordering. In addition, the magnetocaloric effect (MCE) is calculated using isothermal magnetization measurements at several temperatures. The maximal magnetic entropy change ΔS = 0.032 J kg{sup -1} K{sup -1} is observed in the vicinity of T{sub C}. For the phases Nb{sub 6}Mn{sub 0,75(2)}Ir{sub 6,25(2)}B{sub 8} and Nb{sub 6}Co{sub 1,09(2)}Ir{sub 5,91(2)}B{sub 8} a relationship between the measured ferrimagnetic ordering and the crystal structure is found. Tiny superstructure reflections measured by Selected Area Electron Diffraction (SEAD) indicate a different crystal system for those compounds, which allows a ferrimagnetic spin arrangement within this crystal structure.In the second part of the thesis new results about the Nb{sub 2}OsB{sub 2-} and NbRuB-type borides are presented, which both

Pyrolysis and reutilization of plant residues after phytoremediation of heavy metals contaminated sediments: For heavy metals stabilization and dye adsorption.

Science.gov (United States)

Gong, Xiaomin; Huang, Danlian; Liu, Yunguo; Zeng, Guangming; Wang, Rongzhong; Wei, Jingjing; Huang, Chao; Xu, Piao; Wan, Jia; Zhang, Chen

2018-04-01

This study aimed to investigate the effect of pyrolysis on the stabilization of heavy metals in plant residues obtained after phytoremediation. Ramie residues, being collected after phytoremediation of metal contaminated sediments, were pyrolyzed at different temperatures (300-700 °C). Results indicated that pyrolysis was effective in the stabilization of Cd, Cr, Zn, Cu, and Pb in ramie residues by converting the acid-soluble fraction of metals into residual form and decreasing the TCLP-leachable metal contents. Meanwhile, the reutilization potential of using the pyrolysis products generated from ramie residues obtained after phytoremediation as sorbents was investigated. Adsorption experiments results revealed that the pyrolysis products presented excellent ability to adsorb methylene blue (MB) with a maximum adsorption capacity of 259.27 mg/g. This study demonstrated that pyrolysis could be used as an efficient alternative method for stabilizing heavy metals in plant residues obtained after phytoremediation, and their pyrolysis products could be reutilized for dye adsorption. Copyright © 2018 Elsevier Ltd. All rights reserved.

Colour interceptions, thermal stability and surface morphology of polyester metal complexes

International Nuclear Information System (INIS)

Zohdy, M.H.

2005-01-01

Chelating copolymers via grafting of acrylic acid (AAc) and acrylamide (AAm/AAc) comonomer mixture onto polyester micro fiber fabrics (PETMF) using gamma-radiation technique were prepared. The prepared graft chains (PETMF-g-AAc) and (PETMF-g-PAAc/PAAm) acted as chelating sites for some selected transition metal ions. The prepared graft copolymers and their metal complexes were characterized using thermogravimetric analysis (TGA), colour parameters and surface morphology measurements. The colour interception and strength measurements showed that the metal complexation is homogeneously distributed. The results showed that the thermal stability of PETMF was improved after graft copolymerization and metal complexes. Moreover, the degree of grafting enhanced the thermal stability values of the grafted and complexed copolymers up to 25% of magnitude, on the other hand the activation energy of the grafted-copolymer with acrylic acid increased up to 80%. The SEM observation gives further supports to the homogenous distribution of grafting and metal complexation

Stabilization of Rocky Flats combustible residues contaminated with plutonium metal and organic solvents

International Nuclear Information System (INIS)

Bowen, S.M.; Cisneros, M.R.; Jacobson, L.L.; Schroeder, N.C.; Ames, R.L.

1998-01-01

This report describes tests on a proposed flowsheet designed to stabilize combustible residues that were generated at the Rocky Flats Environmental Technology Site (RFETS) during the machining of plutonium metal. Combustible residues are essentially laboratory trash contaminated with halogenated organic solvents and plutonium metal. The proposed flowsheet, designed by RFETS, follows a glovebox procedure that includes (1) the sorting and shredding of materials, (2) a low temperature thermal desorption of solvents from the combustible materials, (3) an oxidation of plutonium metal with steam, and (4) packaging of the stabilized residues. The role of Los Alamos National Laboratory (LANL) in this study was to determine parameters for the low temperature thermal desorption and steam oxidation steps. Thermal desorption of carbon tetrachloride (CCl 4 ) was examined using a heated air stream on a Rocky Flats combustible residue surrogate contaminated with CCl 4 . Three types of plutonium metal were oxidized with steam in a LANL glovebox to determine the effectiveness of this procedure for residue stabilization. The results from these LANL experiments are used to recommend parameters for the proposed RFETS stabilization flowsheet

Origin of Shear Stability and Compressive Ductility Enhancement of Metallic Glasses by Metal Coating

Science.gov (United States)

Sun, B. A.; Chen, S. H.; Lu, Y. M.; Zhu, Z. G.; Zhao, Y. L.; Yang, Y.; Chan, K. C.; Liu, C. T.

2016-01-01

Metallic glasses (MGs) are notorious for the poor macroscopic ductility and to overcome the weakness various intrinsic and extrinsic strategies have been proposed in past decades. Among them, the metal coating is regarded as a flexible and facile approach, yet the physical origin is poorly understood due to the complex nature of shear banding process. Here, we studied the origin of ductile enhancement in the Cu-coating both experimentally and theoretically. By examining serrated shear events and their stability of MGs, we revealed that the thin coating layer plays a key role in stopping the final catastrophic failure of MGs by slowing down shear band dynamics and thus retarding its attainment to a critical instable state. The mechanical analysis on interplay between the coating layer and shear banding process showed the enhanced shear stability mainly comes from the lateral tension of coating layer induced by the surface shear step and the bonding between the coating layer and MGs rather than the layer thickness is found to play a key role in contributing to the shear stability. PMID:27271435

Inhibition of the bioavailability of heavy metals in sewage sludge biochar by adding two stabilizers

Science.gov (United States)

Huang, Zhujian; Lu, Qin; Wang, Jun; Chen, Xian; He, Zhenli

2017-01-01

Agricultural application of sewage sludge (SS) after carbonization is a plausible way for disposal. Despite its benefits of improving soil fertility and C sequestration, heavy metals contained in sewage sludge biochars (SSB) are still a concern. In this study, two types of heavy metal stabilizers were chosen: fulvic acid (FA) and phosphogypsum (with CaSO4, CS, as the main component). The two stabilizers were incorporated into SS prior to 350°C carbonization for 1 h at the rates of 1%, 2%, or 4%. The obtained SSBs were then analyzed by Fourier transform infrared spectroscopy (FTIR) and X-ray photoelectron spectroscopy (XPS). Total and available concentrations of four heavy metals, i.e., Zn, Pb, Cd, and Ni, in the SSBs were determined. In addition, a series of pot soil culture experiments was conducted to investigate the effects of stabilizers incorporation into SSB on heavy metal bioavailability and the uptake by plants (corn as an indicator) and plant biomass yield, with SS and SSB (no stabilizers) as controls. The results showed that incorporation of both FA and CS increased functional groups such as carboxyl, phenol, hydroxyl, amine and quinine groups in the SSBs. The percentage of heavy metals in sulfuric and oxidizable state and residual state of SSBs were significantly increased after carbonization, and hence the mobility of the heavy metals in SSBs was decreased. The introduction of the stabilizers (i.e., FA or CS) significantly lowered the total and available concentrations of Zn, Pb, Cd, and Ni. The reduction in available heavy metal concentration increased with incorporation rate of the stabilizers from 1% to 4%. In the treatments with FA or CS incorporated SSB, less heavy metals were taken up by plants and more plant biomass yields were obtained. The mitigating effects were more pronounced at higher rates of FA or CS stabilizer. These findings provide a way to lower bioavailability of heavy metals in SS or SSB for land application or horticulture as a

Enhanced Stability of Li Metal Anode by using a 3D Porous Nickel Substrate

Energy Technology Data Exchange (ETDEWEB)

Yu, Lu; Canfield, Nathan L.; Chen, Shuru; Lee, Hongkyung; Ren, Xiaodi; Engelhard, Mark H.; Li, Qiuyan; Liu, Jun; Xu, Wu; Zhang, Jiguang

2018-03-02

Lithium (Li) metal is considered the “holy grail” anode for high energy density batteries, but its applications in rechargeable Li metal batteries are still hindered by the formation of Li dendrites and low Coulombic efficiency for Li plating/stripping. An effective strategy to stabilize Li metal is by embedding Li metal anode in a three-dimensional (3D) current collector. Here, a highly porous 3D Ni substrate is reported to effectively stabilize Li metal anode. Using galvanostatic intermittent titration technique combined with scanning electron microscopy, the underlying mechanism on the improved stability of Li metal anode is revealed. It is clearly demonstrated that the use of porous 3D Ni substrate can effectively suppress the formation of “dead” Li and forms a dense surface layer, whereas a porous “dead” Li layer is accumulated on the 2D Li metal which eventually leads to mass transport limitations. X-ray photoelectron spectroscopy results further revealed the compositional differences in the solid-electrolyte interphase layer formed on the Li metal embedded in porous 3D Ni substrate and the 2D copper substrate.

On thermal stability of cyanocomplexes of some transition metals

International Nuclear Information System (INIS)

Sergeeva, A.N.; Pavlenko, L.I.; Dovgej, V.V.; Zubritskaya, D.I.; Tkachenko, Zh.I.

1981-01-01

The experimental data on the study of thermal stability of the coordination cyanides of the composition M'sub(x)[M''(CN)sub(y)]xnHsub(2)O, where M'=K; M''=V(2,3), Mo(2,4), Re(3,5), Ru(2); x=3,4; y=6-8; n=1-3, are generalized and systematized. Three main stages of decomposition of cyanocomlexes, proceeding in argon medium at 20-900 deg, are established. Hexacyanocomplexes of Re(3), Mo(2), Ru(2), V(2) according to their increasing thermal stability can be arranged in the series: K 3 [Re(CN) 6 ] 4 [Mo(CN) 6 ] 4 [Ru(CN) 6 ] 4 [V(CN) 6 ], from which it follows that cyanocomplexes of d-metals of periods 6 and 5 are less thermally stable than similar complexes of d-metal of period 4. The decomposition of cyanides of the type M(CN) 2 in the case of ruthenium ends with the formation of free metal at 470-670 deg, for rhenium - with the formation of free metal and rhenium nitride ReN 2 at 680-700 deg, for molybdenum - molybdenum carbide Mo 2 C at > 670 deg, for vanadium - vanadium carbide VC at 705 deg [ru

Mechanochemically Driven Syntheses of Boride Nanomaterials

Science.gov (United States)

Blair, Richard G.

Solid state metathesis reactions have proven to be a viable route to the production of unfunctionalized nanomaterials. However, current implementations of this approach are limited to self-propagating reactions. We have been investigating mechanically driven metathesis reactions. The use of high-energy ball mills allows control of crystallite sizes without the use of a capping group. Reinforcement materials with crystallite sizes on the order of 5-30 nm can be produced in such a manner. Borides are of particular interest due to their strength, high melting point, and electrical conductivity. The ultimate goal of this work is to prepare oxide and capping group-free nanoparticles suitable for incorporation in thermoelectric, polymer, and ceramic composites. Ultimately this work will facilitate the production of improved thermoelectric materials that will provide robust, deployable, power generation modules to supplement or replace fuel cell, Stirling, and battery-derived power sources. It will also result in scalable, bulk syntheses of tough, refractory, conductive nanomaterials for polymer composites with improved electrical properties, ceramic composites with enhanced fracture toughness, and composites with enhanced neutron reflectance and/or absorbance.

Microstructural study of metal-metal composites elaborated by interdiffusion between pure nickel and devitrified Fe-Ni-Mo-B glasses

International Nuclear Information System (INIS)

Ratovondrahona, E.; Bouquet, G.; Portier, R.

1993-01-01

It is well known that amorphous metallic alloys are able to give rise to microcrystallized structures when submitted to the effect of temperature, i.e. when devitrification takes place. These microstructures are particularly interesting for various applications. Materials produced from devitrified amorphous phase generally exhibit good mechanical properties, but are accompanied by some brittleness. In order to avoid this disadvantage, the authors tried to elaborate a composite material resulting from diffusion heat treatments carried out on alternate stackings of amorphous alloys and pure metal sheets. The idea is that by choosing discerning metallic glass and an appropriate diffusion heat treatment temperature, it might be possible to obtain mechanically hard phases, such as metallic borides, and disperse these compounds in the pure metallic matrix to be reinforced. Here, the authors only present the microstructural results of this study, although some preliminary mechanical tests have been preformed

A new method for evaluating structural stability of bulk metallic glasses

Energy Technology Data Exchange (ETDEWEB)

Zhao, Lei; Jia, Haoling [Key Laboratory of Aerospace Materials and Performance, Ministry of Education, School of Materials Science and Engineering, Beihang University, Beijing 100191 (China); Xie, Shenghui; Zeng, Xierong [College of Materials Science and Engineering, Shenzhen University and Shenzhen Key Laboratory of Special Functional Materials, ShenZhen 518060 (China); Zhang, Tao [Key Laboratory of Aerospace Materials and Performance, Ministry of Education, School of Materials Science and Engineering, Beihang University, Beijing 100191 (China); Ma, Chaoli, E-mail: machaoli@buaa.edu.c [Key Laboratory of Aerospace Materials and Performance, Ministry of Education, School of Materials Science and Engineering, Beihang University, Beijing 100191 (China)

2010-08-15

This paper proposed a new method for evaluating the structural stability of bulk metallic glasses (BMGs) based on dilatometric measurements. During heating in the dilatometric experiments, the BMGs expanded continuously with increasing temperature. When the temperature reached the glass transition temperature (T{sub g}), viscous shrinkage occurred due to the viscosity of material becoming lower. Since the inhomogeneous nature of the metallic glasses at atomic level, the processes of rigid expansion and the viscous shrinkage co-exist in a certain temperature region. The expansion stopped completely at a temperature (named T{sub p} here) beyond T{sub g}. The values of the temperature region, {Delta}T{sub gp} = T{sub p} - T{sub g}, and the corresponding time interval ({Delta}t{sub gp}) and the activation energy (E{sub p}) corresponding to the expansion processes, are the reflection of the structural stability of BMGs. Investigating the co-existing processes kinetically and thermodynamically, we can make an insight into the structural stability of metallic glasses. Based on this idea, the thermal expansion behaviors of Mg-, Pd-, Zr-, Ti- and Fe-based BMG were studied, and their structural stability was evaluated by the parameters of {Delta}T{sub gp}, {Delta}t{sub gp} and E{sub p}.

Microstructure of Vacuum-Brazed Joints of Super-Ni/NiCr Laminated Composite Using Nickel-Based Amorphous Filler Metal

Science.gov (United States)

Ma, Qunshuang; Li, Yajiang; Wu, Na; Wang, Juan

2013-06-01

Vacuum brazing of super-Ni/NiCr laminated composite and Cr18-Ni8 stainless steel was carried out using Ni-Cr-Si-B amorphous filler metal at 1060, 1080, and 1100 °C, respectively. Microstructure and phase constitution were investigated by means of optical and scanning electron microscopy, energy-dispersive spectroscopy, x-ray diffraction, and micro-hardness tester. When brazed at 1060-1080 °C, the brazed region can be divided into two distinct zones: isothermally solidified zone (ISZ) consisting of γ-Ni solid solution and athermally solidified zone (ASZ) consisting of Cr-rich borides. Micro-hardness of the Cr-rich borides formed in the ASZ was as high as 809 HV50 g. ASZ decreased with increase of the brazing temperature. Isothermal solidification occurred sufficiently at 1100 °C and an excellent joint composed of γ-Ni solid solution formed. The segregation of boron from ISZ to residual liquid phase is the reason of Cr-rich borides formed in ASZ. The formation of secondary precipitates in diffusion-affected zone is mainly controlled by diffusion of B.

Theoretical bases on thermal stability of layered metallic systems

International Nuclear Information System (INIS)

Kadyrzhanov, K.K.; Rusakov, V.S.; Turkebaev, T.Eh.; Zhankadamova, A.M.; Ensebaeva, M.Z.

2003-01-01

The paper is dedicated to implementation of the theoretical bases for layered metallic systems thermal stabilization. The theory is based on the stabilization mechanism expense of the intermediate two-phase field formation. As parameters of calculated model are coefficients of mutual diffusion and inclusions sizes of generated phases in two-phase fields. The stabilization time dependence for beryllium-iron (Be (1.1 μm)-Fe(5.5 μm)) layered system from iron and beryllium diffusion coefficients, and inclusions sizes is shown as an example. Conclusion about possible mechanisms change at transition from microscopic consideration to the nano-crystal physics level is given

Stability analysis for single-phase liquid metal rectangular natural circulation loops

International Nuclear Information System (INIS)

Lu, Daogang; Zhang, Xun; Guo, Chao

2014-01-01

Highlights: • The stability for asymmetric liquid metal natural circulation loops is analyzed. • The Na and NaK loops have higher critical Reynolds number than Pb and LBE loops. • Decreasing the ratio of height to width of loop can increase loop stability. • The length of heater would not affect the loop stability obviously. • Adding the length or heat transfer coefficient of cooler can increase loop stability. - Abstract: Natural circulation systems are preferred in some advanced nuclear power plants as they can simplify the designs and improve the inherent safety. The stability and steady-state characteristics of natural circulation are important for the applications of natural circulation loops (NCLs). A linear stability analysis method was used to study the stability behavior of liquid metal NCLs. The influences of the types of working fluids and loop geometry parameters on the stability of NCLs were evaluated. The liquid sodium (Na) loop and sodium–potassium alloy (NaK) loop would be more stable than lead bismuth eutectics (LBE) loop. The pressure drop could stabilize the loop behavior and also lead an increase of operating temperature for the loop. The NCL with a lower aspect ratio (ratio of vertical center distance between the heating and cooling section to the horizontal length of loop) is supposed to be more stable. It was found that the length of heating section would not have an obvious effect on the stability of NCL. However, the loop behavior could be stabilized by adding the length or heat transfer coefficient of the cooling section

Effects of thermal treatment on mineralogy and heavy metal behavior in iron oxide stabilized air pollution control residues

DEFF Research Database (Denmark)

Sørensen, Mette Abildgaard; Bender-Koch, C.; Starckpoole, M. M.

2000-01-01

Stabilization of air pollution control residues by coprecipitation with ferrous iron and subsequent thermal treatment (at 600 and 900 °C) has been examined as a means to reduce heavy metal leaching and to improve product stability. Changes in mineralogy and metal binding were analyzed using various...... analytical and environmental techniques. Ferrihydrite was formed initially but transformed upon thermal treatment to more stable and crystalline iron oxides (maghemite and hematite). For some metals leaching studies showed more substantial binding after thermal treatment, while other metals either....... Thermal treatment of the stabilized residues produced structures with an inherently better iron oxide stability. However, the concentration of metals in the leachate generally increased as a consequence of the decreased solubility of metals in the more stable iron oxide structure....

V{sub 1+x}Nb{sub 1-x}IrB{sub 2} (x ∼ 0.1), the first quaternary metal-rich -boride adopting the Mo{sub 2}IrB{sub 2}-type structure: Synthesis, crystal and electronic structure and bonding analysis

Energy Technology Data Exchange (ETDEWEB)

Goerens, Christian; Fokwa, Boniface P.T. [Institute of Inorganic Chemistry, RWTH Aachen University (Germany)

2013-02-15

Polycrystalline samples and single crystals of the new metal-rich boride V{sub 1+x}Nb{sub 1-x}IrB{sub 2} (x ∼ 0.1), were synthesized by arc-melting the elements in a water-cooled copper crucible under an argon atmosphere and characterized by X-ray diffraction and EDX measurements. The crystal structure was refined on the basis of single crystal data. The new phase adopts the Mo{sub 2}IrB{sub 2}-type structure (space group Pnnm, no. 58) with the lattice parameters a = 7.301(7) Aa, b = 9.388(9) Aa and c = 3.206(5) Aa. It is the first quaternary representative of Mo{sub 2}IrB{sub 2}-type structure. The structure contains zigzag B{sub 4}-fragments with boron-boron distances of 1.83-1.85 Aa. The electronic density of states and crystal orbital Hamilton population (for bonding analysis) were calculated, using the linear muffin-tin orbital atomic sphere approximation (LMTO-ASA) method. According to these calculations, this metal-rich compound should be metallic, as expected. Furthermore, very strong boron-boron interactions are observed in the zigzag B{sub 4}-fragment and two significantly different Ir-B interactions are observed in the new phase and the prototype Mo{sub 2}IrB{sub 2}. (Copyright copyright 2013 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

[Effect of inorganic amendments on the stabilization of heavy metals in contaminated soils].

Science.gov (United States)

Cao, Meng-hua; Zhu, Xi; Liu, Huang-cheng; Wang, Lin-ling; Chen, Jing

2013-09-01

Effects of single and mixed inorganic amendments on the stabilization of heavy metals in contaminated soils were investigated. Significant synergistic effects on the stabilization of Zn and Cu were observed with the mixed inorganic amendments of KH2PO4 and Ca(OH)2 in the laboratory test. In the field test, the stabilization ratios of Zn, Cu and Cd were 41.8%, 28.2% and 48.4%, respectively, with the dosage of 0.5 kg x m(-2). The growth of peanut was inhibited by the addition of the inorganic amendments. Meanwhile, the uptake of heavy metals was reduced in peanut.

A search for superconductivity below 1 K in transition metal borides

International Nuclear Information System (INIS)

Leyarovska, L.; Leyarovski, E.

1979-01-01

Some AlB 2 -type (C32 structure) boron compounds were examined for superconductivity down to 0.42 K; the compounds have the formula MeB 2 (Me equivalent to Ti, Zr, Hf, V, Nb, Ta, Cr, Mo) (the atomic ratio of metal to boron was 0.5). Only NbB 2 was found to be superconducting with Tsub(c) = 0.62 K and a surprisingly high value of Hsub(c)(0), about 1600 Oe. Other transition metal as well as non-transition metal boron phases were also tested for superconductivity down to 0.42 K; these compounds were MeB 2 (Me equivalent to Ca, Sr, Ba), W 2 B 5 , CrB, Cr 5 B 3 , UB 2 , UB 4 and UB 12 . None of these compounds proved to be superconducting above 0.42 K; nor was any trace of superconductivity down to 0.42 K observed in MoB and NbB. (Auth.)

Stability of surface plastic flow in large strain deformation of metals

Science.gov (United States)

Viswanathan, Koushik; Udapa, Anirduh; Sagapuram, Dinakar; Mann, James; Chandrasekar, Srinivasan

We examine large-strain unconstrained simple shear deformation in metals using a model two-dimensional cutting system and high-speed in situ imaging. The nature of the deformation mode is shown to be a function of the initial microstructure state of the metal and the deformation geometry. For annealed metals, which exhibit large ductility and strain hardening capacity, the commonly assumed laminar flow mode is inherently unstable. Instead, the imposed shear is accommodated by a highly rotational flow-sinuous flow-with vortex-like components and large-amplitude folding on the mesoscale. Sinuous flow is triggered by a plastic instability on the material surface ahead of the primary region of shear. On the other hand, when the material is extensively strain-hardened prior to shear, laminar flow again becomes unstable giving way to shear banding. The existence of these flow modes is established by stability analysis of laminar flow. The role of the initial microstructure state in determining the change in stability from laminar to sinuous / shear-banded flows in metals is elucidated. The implications for cutting, forming and wear processes for metals, and to surface plasticity phenomena such as mechanochemical Rehbinder effects are discussed.

Stability of metallic foams studied under microgravity

CERN Document Server

Wuebben, T; Banhart, J; Odenbach, S

2003-01-01

Metal foams are prepared by mixing a metal powder and a gas-releasing blowing agent, by densifying the mix to a dense precursor and finally foaming by melting the powder compact. The foaming process of aluminium foams is monitored in situ by x-ray radioscopy. One observes that foam evolution is accompanied by film rupture processes which lead to foam coalescence. In order to elucidate the importance of oxides for foam stability, lead foams were manufactured from lead powders having two different oxide contents. The two foam types were generated on Earth and under weightlessness during parabolic flights. The measurements show that the main function of oxide particles is to prevent coalescence, while their influence on bulk viscosity of the melt is of secondary importance.

Design for low-cost gas metal arc weld-based aluminum 3-D printing

Science.gov (United States)

Haselhuhn, Amberlee S.

Additive manufacturing, commonly known as 3-D printing, has the potential to change the state of manufacturing across the globe. Parts are made, or printed, layer by layer using only the materials required to form the part, resulting in much less waste than traditional manufacturing methods. Additive manufacturing has been implemented in a wide variety of industries including aerospace, medical, consumer products, and fashion, using metals, ceramics, polymers, composites, and even organic tissues. However, traditional 3-D printing technologies, particularly those used to print metals, can be prohibitively expensive for small enterprises and the average consumer. A low-cost open-source metal 3-D printer has been developed based upon gas metal arc weld (GMAW) technology. Using this technology, substrate release mechanisms have been developed, allowing the user to remove a printed metal part from a metal substrate by hand. The mechanical and microstructural properties of commercially available weld alloys were characterized and used to guide alloy development in 4000 series aluminum-silicon alloys. Wedge casting experiments were performed to screen magnesium, strontium, and titanium boride alloying additions in hypoeutectic aluminum-silicon alloys for their properties and the ease with which they could be printed. Finally, the top performing alloys, which were approximately 11.6% Si modified with strontium and titanium boride were cast, extruded, and drawn into wire. These wires were printed and the mechanical and microstructural properties were compared with those of commercially available alloys. This work resulted in an easier-to-print aluminum-silicon-strontium alloy that exhibited lower porosity, equivalent yield and tensile strengths, yet nearly twice the ductility compared to commercial alloys.

First-principles calculation of the structural stability of 6d transition metals

International Nuclear Information System (INIS)

Oestlin, A.; Vitos, L.

2011-01-01

The phase stability of the 6d transition metals (elements 103-111) is investigated using first-principles electronic-structure calculations. Comparison with the lighter transition metals reveals that the structural sequence trend is broken at the end of the 6d series. To account for this anomalous behavior, the effect of relativity on the lattice stability is scrutinized, taking different approximations into consideration. It is found that the mass-velocity and Darwin terms give important contributions to the electronic structure, leading to changes in the interstitial charge density and, thus, in the structural energy difference.

Quantitative electron probe microanalysis of borides in aluminium

International Nuclear Information System (INIS)

Karduck, P.; Schuerhoff, H.J.; Burchard, W.G.

1983-01-01

A procedure for the quantitative analysis of borides in aluminium was introduced. For this purpose the optimal apparative boundary conditions for the EPMA of boron were worked out. With these conditions a satisfactory peak to background ratio of 57 could be achieved for B-Kα-radiation. By application of this method the following conclusion should be drawn concerning the kind of nuclei during grain refinement of aluminium with titanium and boron: For grain refinement of aluminium with titanium and boron in the hypoperitectic region of the binary system Al-Ti TiB 2 -particles in clusters provide the high efficiency of refinement. This entails that the TiB 2 -particles already present in the master alloy remain inert in the melt. Hence, the good efficiency of refinement in this region cannot be attributed to the presence of particles like Al 3 Ti, AlB 2 or (Al, Ti) B 2 . (Author)

Effect of Mg, Ca, and Zn on stability of LiBH{sub 4} through computational thermodynamics

Energy Technology Data Exchange (ETDEWEB)

Lee, Sung Hoon; Manga, Venkateswara Rao; Liu, Zi-Kui [Department of Materials Science and Engineering, The Pennsylvania State University, University Park, PA 16802 (United States)

2010-07-15

The effect of divalent metal-dopants, Mg, Ca, and Zn, on the stability of LiBH{sub 4} is studied by using the first-principles calculations and CALPHAD (CALculation of PHAse Diagram) modeling. The ground states of Mg{sub 1/2}BH{sub 4}, Ca{sub 1/2}BH{sub 4}, and Zn{sub 1/2}BH{sub 4} are shown to be I anti 4m2, F2dd, and I anti 4m2, respectively, through first-principles calculations. Positive enthalpy of mixing between Li and the alloying element is predicted, indicating unfavorable solubility of alloying elements in LiBH{sub 4} and thus offering possibility to decrease the stability of LiBH{sub 4}. The ionic sublattice model of (Li{sup +}, M{sup 2+}, Va){sub 1}(BH{sub 4}{sup -}){sub 1} is adopted for the metal substituted LiBH{sub 4} phase. It is observed that the addition of Mg or Zn has limited effect as the decomposition temperature is between those of LiBH{sub 4} and M{sub 1/2}BH{sub 4} for Mg and Zn substitutions. LiBH{sub 4} is destabilized with magnesium borides or LiZn{sub 4} formation but its decomposition temperature is higher than that of M{sub 1/2}BH{sub 4}. On the other hand, the addition of Ca significantly reduces the H{sub 2} releasing temperature due to the formation of highly stable CaB{sub 6}. (author)

Stability of Bulk Metallic Glass Structure. Final Report

Energy Technology Data Exchange (ETDEWEB)

Jain, H.; Williams, D. B.

2003-06-01

The fundamental origins of the stability of the (Pd-Ni){sub 80}P{sub 20} bulk metallic glasses (BMGs), a prototype for a whole class of BMG formers, were explored. While much of the properties of their BMGs have been characterized, their glass-stability have not been explained in terms of the atomic and electronic structure. The local structure around all three constituent atoms was obtained, in a complementary way, using extended X-ray absorption fine structure (EXAFS), to probe the nearest neighbor environment of the metals, and extended energy loss fine structure (EXELFS), to investigate the environment around P. The occupied electronic structure was investigated using X-ray photoelectron spectroscopy (XPS). The (Pd-Ni){sub 80}P{sub 20} BMGs receive their stability from cumulative, and interrelated, effects of both atomic and electronic origin. The stability of the (Pd-Ni){sub 80}P{sub 20} BMGs can be explained in terms of the stability of Pd{sub 60}Ni{sub 20}P{sub 20} and Pd{sub 30}Ni{sub 50}P{sub 20}, glasses at the end of BMG formation. The atomic structure in these alloys is very similar to those of the binary phosphide crystals near x=0 and x=80, which are trigonal prisms of Pd or Ni atoms surrounding P atoms. Such structures are known to exist in dense, randomly-packed systems. The structure of the best glass former in this series, Pd{sub 40}Ni{sub 40}P{sub 20} is further described by a weighted average of those of Pd{sub 30}Ni{sub 50}P{sub 20} and Pd{sub 60}Ni{sub 20}P{sub 20}. Bonding states present only in the ternary alloys were found and point to a further stabilization of the system through a negative heat of mixing between Pd and Ni atoms. The Nagel and Tauc criterion, correlating a decrease in the density of states at the Fermi level with an increase in the glass stability, was consistent with greater stability of the Pd{sub x}Ni{sub 80-x}P{sub 20} glasses with respect to the binary alloys of P. A valence electron concentration of 1.8 e/a, which

Metal ion-specific thermal stability of bacterial S-Layers

Energy Technology Data Exchange (ETDEWEB)

Drobot, Bjoern; Raff, Johannes [Helmholtz-Zentrum Dresden-Rossendorf e.V., Dresden (Germany). Div. Biogeochemistry; Fahmy, Karim [Helmholtz-Zentrum Dresden-Rossendorf e.V., Dresden (Germany). Div. Biophysics

2016-07-01

Many bacteria are covered by a surface layer (S-layer), i.e., a para-crystalline two-dimensional array of proteins which control cell shape, act as molecular sieves and have potential applications as radionuclide-binding material for bioremediation of polluted areas. Knowledge and control of the metal-dependent stability of the purified proteins is required for their technical application. Here, we have explored by differential scanning calorimetry the thermal stability of the S-layer protein slp-B53 from Lysinibacillus sphaericus, a Gram-positive bacterium isolated from a uranium mining waste pile [1].

Slag-based materials for toxic metal and radioactive waste stabilization

International Nuclear Information System (INIS)

Langton, C.A.

1989-01-01

This paper discusses a salt solution that is a hazardous waste and has both corrosive and metal toxicity characteristics. Objectives of a wasteform designed to stabilize this solution are presented. Disposal site characterization studies are examined

Stability of biogenic metal(loid) nanomaterials related to the colloidal stabilization theory of chemical nanostructures.

Science.gov (United States)

Piacenza, Elena; Presentato, Alessandro; Turner, Raymond J

2018-02-25

In the last 15 years, the exploitation of biological systems (i.e. plants, bacteria, mycelial fungi, yeasts, and algae) to produce metal(loid) (Me)-based nanomaterials has been evaluated as eco-friendly and a cost-effective alternative to the chemical synthesis processes. Although the biological mechanisms of biogenic Me-nanomaterial (Bio-Me-nanomaterials) production are not yet completely elucidated, a key advantage of such bio-nanostructures over those chemically synthesized is related to their natural thermodynamic stability, with several studies ascribed to the presence of an organic layer surrounding these Bio-Me-nanostructures. Different macromolecules (e.g. proteins, peptides, lipids, DNA, and polysaccharides) or secondary metabolites (e.g. flavonoids, terpenoids, glycosides, organic acids, and alkaloids) naturally produced by organisms have been indicated as main contributors to the stabilization of Bio-Me-nanostructures. Nevertheless, the chemical-physical mechanisms behind the ability of these molecules in providing stability to Bio-Me-nanomaterials are unknown. In this context, transposing the stabilization theory of chemically synthesized Me-nanomaterials (Ch-Me-nanomaterials) to biogenic materials can be used towards a better comprehension of macromolecules and secondary metabolites role as stabilizing agents of Bio-Me-nanomaterials. According to this theory, nanomaterials are generally featured by high thermodynamic instability in suspension, due to their high surface area and surface energy. This feature leads to the necessity to stabilize chemical nanostructures, even during or directly after their synthesis, through the development of (i) electrostatic, (ii) steric, or (iii) electrosteric interactions occurring between molecules and nanomaterials in suspension. Based on these three mechanisms, this review is focused on parallels between the stabilization of biogenic or chemical nanomaterials, suggesting which chemical-physical mechanisms may be

Characterization of the core-shell interaction of differently stabilized transition-metal nanoparticles by means of X-ray absorption spectroscopy

International Nuclear Information System (INIS)

Bucher, S.

2002-05-01

Transition metal nanoparticles with different surfactants were investigated using X-ray absorption spectroscopy (XAS) to obtain information about the interaction between metal core and protecting shell. For tetraalkylammoniumchloride stabilized Pd- and Co-colloids, a detailed model of the interaction between the metal core and the stabilizing shell could be established, in which chlorine is the connecting element between the metal core and the organic protection cover. Different lengths of the alkyl-chains can cause different equilibrium positions for the chlorine atoms. At aluminum-organic stabilized Pt-colloids, Al K-XANES and Pt L III -XAS were carried out. In this case, it turned out that aluminum is the connecting element between metal core and protection shell. After modification of the shell by connecting different molecules to the outside of the shell, rearrangements of the shell could be observed. In contrast to the surfactant stabilized systems discussed above, metallic covers, especially gold coatings, of Co-particles did not lead to a complete protection shell. In all cases, the cobalt in the nanoparticles was oxidized. A core shell structure could not be verified for any of the metallic stabilized colloids. (orig.)

Using proven, cost-effective chemical stabilization to remediate radioactive and heavy metal contaminated sites

International Nuclear Information System (INIS)

Jensen, R.; Sogue, A.

1999-01-01

Rocky Mountain Remediation Services, L.L.C. (RMRS) has deployed a cost-effective metals stabilization method which can be used to reduce the cost of remediation projects where radioactivity and heavy metals are the contaminants of concern. The Envirobond TM process employs the use of a proprietary chemical process to stabilize metals in many waste forms, and provides an excellent binding system that can easily be compacted to reduce the waste into a shippable brick called Envirobric TM . The advantages of using chemical stabilization are: (1) Low cost, due to the simplicity of the process design and inexpensive reagents. (2) Chemical stabilization is easily deployed in field applications, which limit the amount of shielding and other protective measures. (3) The process does not add volume and bulk to the treated waste; after treatment the materials may be able to remain on-site, or if transportation and disposal is required the cost will be reduced due to lower volumes. (4) No secondary waste. The simplicity of this process creates a safe environment while treating the residues, and the long-term effectiveness of this type of chemical stabilization lowers the risk of future release of hazardous elements associated with the residues. (author)

Utilization of fly ash for stabilization/solidification of heavy metal contaminated soils

Energy Technology Data Exchange (ETDEWEB)

Dermatas, D.; Meng, X. [Stevens Inst. of Technology, Hoboken, NJ (United States)

1995-12-01

Pozzolanic-based stabilization/solidification (S/S) is an effective, yet economic technological alternative to immobilize heavy metals in contaminated soils and sludges. Fly ash waste materials were used along with quicklime (CaO) to immobilize lead, trivalent and hexavalent chromium present in contaminated clayey sand soils. The degree of heavy metal immobilization was evaluated using the Toxicity Characteristic Leaching Procedure (TCLP) as well as controlled extraction experiments. These leaching test results along with X-ray diffraction (XRD), scanning electron microscope and energy dispersive x-ray (SEM-EDX) analyses were also implemented to elucidate the mechanisms responsible for immobilization of the heavy metals under study. Finally, the reusability of the stabilized waste forms in construction applications was also investigated by performing unconfined compressive strength and swell tests. Results suggest that the controlling mechanism for both lead and hexavalent chromium immobilization is surface adsorption, whereas for trivalent chromium it is hydroxide precipitation. Addition of fly ash to the contaminated soils effectively reduced heavy metal leachability well below the non-hazardous regulatory limits. However, quicklime addition was necessary in order to attain satisfactory immobilization levels. Overall, fly ash addition increases the immobilization pH region for all heavy metals tested, and significantly improves the stress-strain properties of the treated solids, thus allowing their reuse as readily available construction materials. The only potential problem associated with this quicklime/fly ash treatment is the excessive formation of the pozzolanic product ettringite in the presence of sulfates. Ettringite, when brought in contact with water, may cause significant swelling and subsequent deterioration of the stabilized matrix. Addition of minimum amounts of barium hydroxide was shown to effectively eliminate ettringite formation.

Nickel speciation in cement-stabilized/solidified metal treatment filtercakes

Energy Technology Data Exchange (ETDEWEB)

Roy, Amitava, E-mail: reroy@lsu.edu [J. Bennett Johnston, Sr., Center for Advanced Microstructures and Devices, Louisiana State University, Baton Rouge, LA 70806, USA (United States); Stegemann, Julia A., E-mail: j.stegemann@ucl.ac.uk [Centre for Resource Efficiency & the Environment, Department of Civil, Environmental & Geomatic Engineering, University College London, Chadwick Building, Gower Street, London WC1E 6BT, UK (United Kingdom)

2017-01-05

Highlights: • XAS shows the same Ni speciation in untreated and stabilized/solidified filtercake. • Ni solubility is the same for untreated and stabilized/solidified filtercake. • Leaching is controlled by pH and physical encapsulation for all binders. - Abstract: Cement-based stabilization/solidification (S/S) is used to decrease environmental leaching of contaminants from industrial wastes. In this study, two industrial metal treatment filtercakes were characterized by X-ray diffractometry (XRD), thermogravimetric and differential thermogravimetric analysis (TG/DTG) and Fourier transform infrared (FTIR); speciation of nickel was examined by X-ray absorption (XAS) spectroscopy. Although the degree of carbonation and crystallinity of the two untreated filtercakes differed, α-nickel hydroxide was identified as the primary nickel-containing phase by XRD and nickel K edge XAS. XAS showed that the speciation of nickel in the filtercake was unaltered by treatment with any of five different S/S binder systems. Nickel leaching from the untreated filtercakes and all their stabilized/solidified products, as a function of pH in the acid neutralization capacity test, was essentially complete below pH ∼5, but was 3–4 orders of magnitude lower at pH 8–12. S/S does not respeciate nickel from metal treatment filtercakes and any reduction of nickel leaching by S/S is attributable to pH control and physical mechanisms only. pH-dependent leaching of Cr, Cu and Ni is similar for the wastes and s/s products, except that availability of Cr, Cu and Zn at decreased pH is reduced in matrices containing ground granulated blast furnace slag.

Chemical stabilization of metals and arsenic in contaminated soils using oxides – A review

International Nuclear Information System (INIS)

Komárek, Michael; Vaněk, Aleš; Ettler, Vojtěch

2013-01-01

Oxides and their precursors have been extensively studied, either singly or in combination with other amendments promoting sorption, for in situ stabilization of metals and As in contaminated soils. This remediation option aims at reducing the available fraction of metal(loid)s, notably in the root zone, and thus lowering the risks associated with their leaching, ecotoxicity, plant uptake and human exposure. This review summarizes literature data on mechanisms involved in the immobilization process and presents results from laboratory and field experiments, including the subsequent influence on higher plants and aided phytostabilization. Despite the partial successes in the field, recent knowledge highlights the importance of long-term and large-scale field studies evaluating the stability of the oxide-based amendments in the treated soils and their efficiency in the long-term. - In situ stabilization of metals and As in contaminated soils using oxides combined with phytostabilization is a potential alternative to conventional remediation techniques.

Immobilization of metals in contaminated soils using natural polymer-based stabilizers.

Science.gov (United States)

Tao, Xue; Li, Aimin; Yang, Hu

2017-03-01

Three low-cost natural polymer materials, namely, lignin (Ln), carboxymethyl cellulose, and sodium alginate, were used for soil amendment to immobilize lead and cadmium in two contaminated soil samples collected from a mining area in Nanjing, China. The remediation effects of the aforementioned natural polymers were evaluated by toxicity characteristic leaching procedure (TCLP) and sequential extractions. The stabilizers could lower the bioavailability of Pb and Cd in the contaminated soils, and the amount of the exchangeable forms of the aforementioned two metals were reduced evidently. TCLP results showed that the leaching concentrations of Pb and Cd were decreased by 5.46%-71.1% and 4.25%-49.6%, respectively, in the treated soils. The contents of the organic forms of the two metals both increased with the increase in stabilizer dose on the basis of the redistribution of metal forms by sequential extractions. These findings were due to the fact that the abundant oxygen-containing groups on the polymeric amendments were effective in chelating and immobilizing Pb and Cd, which have been further confirmed from the metal adsorptions in aqueous solutions. Moreover, Ln achieved the greatest effect among the three polymers under study because of the former's distinct three-dimensional molecular structure, showing the preferential immobilization of Pb over Cd in soils also. Thus, the above-mentioned natural polymers hold great application potentials for reducing metal ion entry into the food chain at a field scale. Copyright © 2016 Elsevier Ltd. All rights reserved.

Phase stability and electronic structure of transition-metal aluminides

International Nuclear Information System (INIS)

Carlsson, A.E.

1992-01-01

This paper will describe the interplay between die electronic structure and structural energetics in simple, complex, and quasicrystalline Al-transition metal (T) intermetallics. The first example is the Ll 2 -DO 22 competition in Al 3 T compounds. Ab-initio electronic total-energy calculations reveal surprisingly large structural-energy differences, and show that the phase stability of both stoichiometric and ternary-substituted compounds correlates closely with a quasigap in the electronic density of states (DOS). Secondly, ab-initio calculations for the structural stability of the icosahedrally based Al 12 W structure reveal similar quasigap effects, and provide a simple physical explanation for the stability of the complex aluminide structures. Finally, parametrized tight-binding model calculations for the Al-Mn quasicrystal reveal a large spread in the local Mn DOS behavior, and support a two-site model for the quasicrystal's magnetic behavior

Metal (Cu, Cd and Zn) removal and stabilization during multiple soil washing by saponin.

Science.gov (United States)

Gusiatin, Zygmunt Mariusz; Klimiuk, Ewa

2012-01-01

The influence of multiple saponin washing on copper, cadmium and zinc removal and stability in three types of soils (loamy sand, loam, silty clay) was investigated. Distribution of metals and their mobility measured as the ratio of exchangeable form to the sum of all fractions in soils was differential. After single washing the highest efficiency of metal removal was obtained in loamy sand (82-90%) and loam (67-88%), whereas the lowest in silty clay (39-62%). In loamy sand and loam metals had higher mobility factors (44-61% Cu, 60-76% Cd, and 68-84% Zn) compared to silty clay (9% Cu, 28% Cd and 36% Zn). Triplicate washing led to increase both efficiency of metal removal and percentage content of their stable forms. In consequence, fractional patterns for metals before and after treatment changed visibly as a result of their redistribution. Based on the redistribution index, the most stable metal (mainly in residual and organic fractions) after triplicate washing was Cu in loamy sand and loam. For silty clay contaminated with Cd, effective metal removal and its stabilization required a higher number of washings. Copyright © 2011 Elsevier Ltd. All rights reserved.

Performance and stability of a liquid anode high-temperature metal-air battery

Science.gov (United States)

Otaegui, L.; Rodriguez-Martinez, L. M.; Wang, L.; Laresgoiti, A.; Tsukamoto, H.; Han, M. H.; Tsai, C.-L.; Laresgoiti, I.; López, C. M.; Rojo, T.

2014-02-01

A High-Temperature Metal-Air Battery (HTMAB) that operates based on a simple redox reaction between molten metal and atmospheric oxygen at 600-1000 °C is presented. This innovative HTMAB concept combines the technology of conventional metal-air batteries with that of solid oxide fuel cells to provide a high energy density system for many applications. Electrochemical reversibility is demonstrated with 95% coulomb efficiency. Cell sealing has been identified as a key issue in order to determine the end-of-charge voltage, enhance coulomb efficiency and ensure long term stability. In this work, molten Sn is selected as anode material. Low utilization of the stored material due to precipitation of the SnO2 on the electrochemically active area limits the expected capacity, which should theoretically approach 903 mAh g-1. Nevertheless, more than 1000 charge/discharge cycles are performed during more than 1000 h at 800 °C, showing highly promising results of stability, reversibility and cyclability.

Thermodynamic modelling of phase equilibrium in system Ti-B-Si-C, synthesis and phases composition of borides and carbides layers on titanic alloyVT-1 at electron beam treatment in vacuum

Science.gov (United States)

Smirnyagina, N. N.; Khaltanova, V. M.; Lapina, A. E.; Dasheev, D. E.

2017-01-01

Composite layers on the basis of carbides and borides the titan and silicon on titanic alloy VT-1 are generated at diffused saturation in vacuum. Formation in a composite of MAX phase Ti3SiC2 is shown. Thermodynamic research of phase equilibrium in systems Ti-Si-C and Ti-B-C in the conditions of high vacuum is executed. The thermodynamics, formation mechanisms of superfirm layers borides and carbides of the titan and silicon are investigated.

Present understanding of the stability of Li-stuffed garnets with moisture, carbon dioxide, and metallic lithium

Science.gov (United States)

Hofstetter, Kyle; Samson, Alfred Junio; Narayanan, Sumaletha; Thangadurai, Venkataraman

2018-06-01

Fast lithium-ion conducting garnet-type metal oxides are promising membranes for next-generation all-solid-state Li batteries and beyond Li-ion batteries, including Li-air and Li-S batteries, due to their high total Li-ion conductivity and excellent chemical stability against reaction with elemental Li. Several studies have been reported on structure-chemical composition-ionic conductivity property in Li-stuffed garnet-type metal oxides. Here, an overview of the chemical and electrochemical stability of lithium-based garnets against moisture/humidity, aqueous solutions, carbon dioxide, sulfur, and metallic lithium are analyzed. Moisture and aqueous stability studies focus on understanding the crystal structure stability, the proton exchange capacity as a function of Li content in Li-stuffed garnets, and how the protonated species affect the crystal structure and mass transport properties. H+/Li+ exchange was found to be in the range of 2-100%. Stability concerning Li-ion conductivity and morphology under carbon dioxide are discussed. Interfacial chemical stability with lithium metal characterized by electrochemical stability window, Li dendrite formation and area specific resistance (ASR) for the reaction Li ⇌ Li+ +e- are presented. Recent attempts to suppress dendrite formation and to reduce ASR via surface modification are also highlighted. Li and Li-stuffed garnet interface ASR values are shown to be as high as >2000 Ω cm2 and as low as 1 Ω cm2 at room temperature for surface modified Li-stuffed samples. Furthermore, recent studies on Li-S battery utilizing chemically stable Li - garnet electrolyte are also discussed.

The effect of metal-buffer bilayer drain/source electrodes on the operational stability of the organic field effect transistors

International Nuclear Information System (INIS)

Karimi-Alavijeh, H.R.; Ehsani, A.

2015-01-01

In this paper, we have investigated experimentally the effect of different drain/source (D/S) electrodes and charge injection buffer layers on the electrical properties and operational stability of a stilbene organic field effect transistor (OFET). The results show that the organic buffer layer of copper phthalocyanine (CuPc) considerably improves the electrical properties of the transistors, but has a negligible effect on their temporal behavior. On the other hand, inorganic metal-oxide buffer layer of molybdenum oxide (MoO 3 ) drastically changes both the electrical properties and operational stability. The functionalities of this metal-oxide tightly depend on the properties of the D/S metallic electrodes. OFETs with Al/MoO 3 as the bilayer D/S electrodes have the best electrical properties: field effect mobility μ eff = 0.32 cm 2 V −1 s −1 and threshold voltage V TH = − 5 V and the transistors with Ag/MoO 3 have the longest operational stability. It was concluded that the chemical stability of the metal/metal-oxide or metal/organic interfaces of the bilayer D/S electrodes determine the operational stability of the OFETs. - Highlights: • The effect of buffer layers on the performance of the stilbene OFETs has been investigated. • Inorganic buffer layer improved the electrical and temporal behaviors simultaneously. • Organic buffer layer only changes the electrical properties. • Chemical stability of the interfaces determines the operational stability of the transistor

Dynamic Stabilization of Metal Oxide–Water Interfaces

Energy Technology Data Exchange (ETDEWEB)

McBriarty, Martin E.; von Rudorff, Guido Falk; Stubbs, Joanne; Eng, Peter; Blumberger, Jochen; Rosso, Kevin M.

2017-02-08

Metal oxide growth, dissolution, and redox reactivity depend on the structure and dynamics at the interface with aqueous solution. We present the most definitive analysis to date of the hydrated naturally abundant r-cut (11$\\bar{0}$2) termination of the iron oxide hematite (α-Fe₂O₃). In situ synchrotron X-ray scattering analysis reveals a ridged lateral arrangement of adsorbed water molecules hydrogen bonded to terminal aquo groups. Large-scale hybrid-functional density functional theory-based molecular dynamics (DFT-MD) simulations show how this structure is dynamically stabilized by picosecond exchange between aquo groups and adsorbed water, even under nominally dry conditions. Surface pKa prediction based on bond valence analysis suggests that water exchange may influence the proton transfer reactions associated with acid/base reactivity at the interface. Our findings rectify inconsistencies between existing models and may be extended to resolving more complex electrochemical phenomena at metal oxide-water interfaces.

Integrating EDDS-enhanced washing with low-cost stabilization of metal-contaminated soil from an e-waste recycling site.

Science.gov (United States)

Beiyuan, Jingzi; Tsang, Daniel C W; Ok, Yong Sik; Zhang, Weihua; Yang, Xin; Baek, Kitae; Li, Xiang-Dong

2016-09-01

While chelant-enhanced soil washing has been widely studied for metal extraction from contaminated soils, there are concerns about destabilization and leaching of residual metals after remediation. This study integrated 2-h soil washing enhanced by biodegradable ethylenediaminedisuccinic acid (EDDS) and 2-month stabilization using agricultural waste product (soybean stover biochar pyrolyzed at 300 and 700 °C), industrial by-product (coal fly ash (CFA)), and their mixture. After integration with 2-month stabilization, the leachability and mobility of residual metals (Cu, Zn, and Pb) in the field-contaminated soil were significantly reduced, especially for Cu, in comparison with 2-h EDDS washing alone. This suggested that the metals destabilized by EDDS-washing could be immobilized by subsequent stabilization with biochar and CFA. Moreover, when the remediation performance was evaluated for phytoavailability and bioaccessibility, prior EDDS washing helped to achieve a greater reduction in the bioavailable fraction of metals than sole stabilization treatment. This was probably because the weakly-bound metals were first removed by EDDS washing before stabilization. Both individual and combined applications of biochar and CFA showed comparable effectiveness regardless of the difference in material properties, possibly due to the high level of amendments (150 ton ha(-1)). Based on the mobility and bioaccessibility results, the estimated human health risk (primarily resulting from Pb) could be mitigated to an acceptable level in water consumption pathway or reduced by half in soil ingestion pathway. These results suggest that an integration of EDDS washing with soil stabilization can alleviate post-remediation impacts of residual metals in the treated soil. Copyright © 2016 Elsevier Ltd. All rights reserved.

Effect of Metal Additives on the Combustion Characteristics of High-Energy Materials

Directory of Open Access Journals (Sweden)

Korotkikh Alexander

2016-01-01

Full Text Available Thermodynamic calculation of combustion parameters and equilibrium composition of HEMs combustion products showed, that at the increase of aluminum powder dispersity the specific impulse and combustion temperature of solid propellants are reduced due to the decrease of the mass fraction of active aluminum in particles. Partial or complete replacement of aluminum by metal powder (B, Mg, AlB2, Al\\Mg alloy, Fe, Ti and Zr in HEMs composition leads to the reduce of the specific impulse and combustion temperature. Replacement of aluminum powder by boron and magnesium in HEM reduces the mass fraction of condensed products in the combustion chamber of solid rocket motor. So, for compositions HEMs with boron and aluminum boride the mass fraction in chamber is reduced by 24 and 36 %, respectively, with respect to the composition HEMs with Al powder. But the mass fraction of CCPs in the nozzle exit increases by 13 % for HEMs with aluminum boride due to the formation of boron oxide in the condensed combustion products. Partial replacement of 2 wt. % aluminum powder by iron and copper additives in HEM leads to the reduce of CCPs mass fraction in chamber by 4–10 % depending on the aluminum powder dispersity duo to these metals are not formed condensed products at the HEMs combustion in chamber.

Dynamic Stabilization of Metal Oxide–Water Interfaces

Energy Technology Data Exchange (ETDEWEB)

McBriarty, Martin E.; von Rudorff, Guido Falk; Stubbs, Joanne E.; Eng, Peter J.; Blumberger, Jochen; Rosso, Kevin M.

2017-02-08

The interaction of water with metal oxide surfaces plays a crucial role in the catalytic and geochemical behavior of metal oxides. In a vast majority of studies, the interfacial structure is assumed to arise from a relatively static lowest energy configuration of atoms, even at room temperature. Using hematite (α-Fe2O3) as a model oxide, we show through a direct comparison of in situ synchrotron X-ray scattering with density functional theory-based molecular dynamics simulations that the structure of the (1102) termination is dynamically stabilized by picosecond water exchange. Simulations show frequent exchanges between terminal aquo groups and adsorbed water in locations and with partial residence times consistent with experimentally determined atomic sites and fractional occupancies. Frequent water exchange occurs even for an ultrathin adsorbed water film persisting on the surface under a dry atmosphere. The resulting time-averaged interfacial structure consists of a ridged lateral arrangement of adsorbed water molecules hydrogen bonded to terminal aquo groups. Surface pKa prediction based on bond valence analysis suggests that water exchange will influence the proton-transfer reactions underlying the acid/base reactivity at the interface. Our findings provide important new insights for understanding complex interfacial chemical processes at metal oxide–water interfaces.

Predicting the stability constants of metal-ion complexes from first principles

Czech Academy of Sciences Publication Activity Database

Gutten, Ondrej; Rulíšek, Lubomír

2013-01-01

Roč. 52, č. 18 (2013), s. 10347-10355 ISSN 0020-1669 Institutional support: RVO:61388963 Keywords : stability constants * solvation energy * metal-ion complexation * theoretical calculations * DFT methods Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 4.794, year: 2013

Synthesis of molybdenum borides and molybdenum silicides in molten salts and their oxidation behavior in an air-water mixture

NARCIS (Netherlands)

Kuznetsov, S.A.; Kuznetsova, S.V.; Rebrov, E.V.; Mies, M.J.M.; Croon, de M.H.J.M.; Schouten, J.C.

2005-01-01

The formation of various coatings in molybdenum-boron and molybdenum-silicon systems was investigated. Boronizing and siliciding treatments were conducted in molten salts under inert gas atm. in the 850-1050 DegC temp. range for 7 h. The presence of boride (e.g. Mo2B, MoB, Mo2B5) and silicide

Stability of Electrodeposition at Solid-Solid Interfaces and Implications for Metal Anodes

Science.gov (United States)

Ahmad, Zeeshan; Viswanathan, Venkatasubramanian

2017-08-01

We generalize the conditions for stable electrodeposition at isotropic solid-solid interfaces using a kinetic model which incorporates the effects of stresses and surface tension at the interface. We develop a stability diagram that shows two regimes of stability: a previously known pressure-driven mechanism and a new density-driven stability mechanism that is governed by the relative density of metal in the two phases. We show that inorganic solids and solid polymers generally do not lead to stable electrodeposition, and provide design guidelines for achieving stable electrodeposition.

Stabilized Lithium-Metal Surface in a Polysulfide-Rich Environment of Lithium-Sulfur Batteries.

Science.gov (United States)

Zu, Chenxi; Manthiram, Arumugam

2014-08-07

Lithium-metal anode degradation is one of the major challenges of lithium-sulfur (Li-S) batteries, hindering their practical utility as next-generation rechargeable battery chemistry. The polysulfide migration and shuttling associated with Li-S batteries can induce heterogeneities of the lithium-metal surface because it causes passivation by bulk insulating Li2S particles/electrolyte decomposition products on a lithium-metal surface. This promotes lithium dendrite formation and leads to poor lithium cycling efficiency with complicated lithium surface chemistry. Here, we show copper acetate as a surface stabilizer for lithium metal in a polysulfide-rich environment of Li-S batteries. The lithium surface is protected from parasitic reactions with the organic electrolyte and the migrating polysulfides by an in situ chemical formation of a passivation film consisting of mainly Li2S/Li2S2/CuS/Cu2S and electrolyte decomposition products. This passivation film also suppresses lithium dendrite formation by controlling the lithium deposition sites, leading to a stabilized lithium surface characterized by a dendrite-free morphology and improved surface chemistry.

Inducing half-metallicity with enhanced stability in zigzag graphene nanoribbons via fluorine passivation

Energy Technology Data Exchange (ETDEWEB)

Jaiswal, Neeraj K., E-mail: neerajkjaiswal@gmail.com [Discipline of Physics, Indian Institute of Information Technology Design & Manufacturing, Jabalpur 482005 (India); Tyagi, Neha [Department of Applied Physics, Delhi Technological University, Delhi 110042 (India); Kumar, Amit [Discipline of Physics, Indian Institute of Information Technology Design & Manufacturing, Jabalpur 482005 (India); Srivastava, Pankaj [Nanomaterials Research Group, ABV-Indian Institute of Information Technology & Management, Gwalior 474015 (India)

2017-02-28

Highlights: • F passivated zigzag graphene nanoribbon (F-ZGNR) are more favorable than pristine ones. • External electric field induces half metallicity in F-ZGNR. • The observed half metallicity is independent of ribbon widths. • Enhanced stability makes F-ZGNR preferable over pristine ribbon. - Abstract: Half metals are the primary ingredients for the realization of novel spintronic devices. In the present work, by employing density functional theory based first-principles calculation, we predict half metallic behavior in fluorine passivated zigzag graphene nanoribbons (F-ZGNR). Four different structures have been investigated viz. one edge F passivated ZGNR (F-ZGNR-1), both edges F passivated ZGNR (F-ZGNR-2), F passivation on alternate sites in first configuration (alt-1) and F passivation on alternate sites in second configuration (alt-2). Interestingly, it is noticed that F passivation is analogous to H passivation (pristine), however, F-ZGNR are reckoned energetically more stable than pristine ones. An spin induced band gap is noticed for all F-ZGNR irrespective of their widths although its magnitude is slightly less than the pristine counterparts. With an external transverse electric field, ribbons undergo semiconducting to half metallic transformation. The observed half metallic character with enhanced stability present F-ZGNR as a better candidate than pristine ZGNR towards the realization of upcoming spintronic devices.

Nb2OsB2, with a new twofold superstructure of the U3Si2 type: Synthesis, crystal chemistry and chemical bonding

Science.gov (United States)

Mbarki, Mohammed; Touzani, Rachid St.; Fokwa, Boniface P. T.

2013-07-01

The new ternary metal-rich boride, Nb2OsB2, was synthesized by arc-melting the elements in a water-cooled copper crucible under an argon atmosphere. The compound was characterized from single-crystal X-ray data and EDX measurements. It crystallizes as a new superstructure (space group P4/mnc, no. 128) of the tetragonal U3Si2-structure type with lattice parameters a=5.922(1) Å and c=6.879(2) Å. All of the B atoms are involved in B2 dumbbells with B-B distances of 1.89(4) Å. Structure relaxation using VASP (Vienna ab intio Simulation Package) has confirmed the space group and the lattice parameters. According to electronic structure calculations (TB-LMTO-ASA), the homoatomic B-B interactions are optimized and very strong, but relatively strong heteroatomic Os-B, Nb-B and Nb-Os bonds are also found: These interactions, which together build a three-dimensional network, are mainly responsible for the structural stability of this new phase. The density of state at the Fermi level predicts metallic behavior, as expected, from this metal-rich boride.

Stabilization of heavy metals in MSWI fly ash using silica fume

Energy Technology Data Exchange (ETDEWEB)

Li, Xinying; Chen, Quanyuan [School of Environment Science and Engineering, Donghua University, Shanghai 201620 (China); State Environmental Protection Engineering Center for Pollution Treatment and Control in Textile Industry, Donghua University, Shanghai 201620 (China); Zhou, Yasu [School of Environment Science and Engineering, Donghua University, Shanghai 201620 (China); Tyrer, Mark [Mineral Industry Research Organisation, Solihull B37 7HB (United Kingdom); Yu, Yang [School of Environment Science and Engineering, Donghua University, Shanghai 201620 (China)

2014-12-15

Highlights: • The stabilization of heavy metals in MSWI fly ash was investigated. • The addition of silica fume effectively reduced the leaching of Pb and Cd. • The relation of solid phase transformation and leaching behavior of heavy metals was discussed. - Abstract: The objective of this work was to investigate the feasibility and effectiveness of silica fume on stabilizing heavy metals in municipal solid waste incineration (MSWI) fly ash. In addition to compressive strength measurements, hydrated pastes were characterized by X-ray diffraction (XRD), thermal-analyses (DTA/TG), and MAS NMR ({sup 27}Al and {sup 29}Si) techniques. It was found that silica fume additions could effectively reduce the leaching of toxic heavy metals. At the addition of 20% silica fume, leaching concentrations for Cu, Pb and Zn of the hydrated paste cured for 7 days decreased from 0.32 mg/L to 0.05 mg/L, 40.99 mg/L to 4.40 mg/L, and 6.96 mg/L to 0.21 mg/L compared with the MSWI fly ash. After curing for 135 days, Cd and Pb in the leachates were not detected, while Cu and Zn concentrations decreased to 0.02 mg/L and 0.03 mg/L. The speciation of Pb and Cd by the modified version of the European Community Bureau of Reference (BCR) extractions showed that these metals converted into more stable state in hydrated pastes of MSWI fly ash in the presence of silica fume. Although exchangeable and weak-acid soluble fractions of Cu and Zn increased with hydration time, silica fume addition of 10% can satisfy the requirement of detoxification for heavy metals investigated in terms of the identification standard of hazardous waste of China.

Structures and Stability of Metal Amidoboranes (MAB): Density Functional Calculations

International Nuclear Information System (INIS)

Li Cailin; Wu Chaoling; Chen Yungui; Zhou Jingjing; Zheng Xin; Pang Lijuan; Deng Gang

2010-01-01

Molecule geometry structures, frequencies, and energetic stabilities of ammonia borane (AB, NH 3 BH 3 ) and metal amidoboranes (MAB, MNH 2 BH 3 ), formed by substituting H atom in AB with one of main group metal atoms, have been investigated by density-functional theory and optimized at the B3LYP levels with 6-311G++ (3df, 3pd) basic set. Their structural parameters and infrared spectrum characteristic peaks have been predicted, which should be the criterion of a successfully synthesized material. Several parameters such as binding energies, vibrational frequencies, and the energy gaps between the HOMO and the LUMO have been adopted to characterize and evaluate their structure stabilities. It is also found that the binding energies and HOMO-LUMO energy gaps of the MAB obviously change with the substitution of the atoms. MgAB has the lowest binding energy and is easier to decompose than any other substitutional structures under same conditions, while CaAB has the highest chemical activity. (condensed matter: electronic structure, electrical, magnetic, and optical properties)

Correlation between local structure and stability of supercooled liquid state in Zr-based metallic glasses

International Nuclear Information System (INIS)

Saida, Junji; Imafuku, Muneyuki; Sato, Shigeo; Sanada, Takashi; Matsubara, Eiichiro; Inoue, Akihisa

2007-01-01

The correlation between the local structure and stability of supercooled liquid state is investigated in the Zr 70 (Ni, Cu) 30 binary and Zr 70 Al 10 (Ni, Cu) 20 (numbers indicate at.%) ternary metallic glasses. The Zr 70 Ni 30 binary amorphous alloy with a low stability of supercooled liquid state has a tetragonal Zr 2 Ni-like local structure around Ni atom. Meanwhile, the Zr 70 Cu 30 binary metallic glass has a different local structure of tetragonal Zr 2 Cu, where we suggest the icosahedral local structure by the quasicrystallization behavior in addition of a very small amount of noble metals. The effect of Al addition on the local structure in the Zr-Ni alloy is also examined. We have investigated that the dominant local structure changes in the icosahedral-like structure from the tetragonal Zr 2 Ni-like local structure by the Al substitution with Ni accompanying with the significant stabilization of supercooled liquid state. It is concluded that the formation of icosahedral local structure contributes to the enhancement of stability of supercooled liquid state in the Zr-based alloys

[Recent advance in solidification/stabilization technology for the remediation of heavy metals-contaminated soil].

Science.gov (United States)

Hao, Han-zhou; Chen, Tong-bin; Jin, Meng-gui; Lei, Mei; Liu, Cheng-wu; Zu, Wen-pu; Huang, Li-mi

2011-03-01

Remediation of heavy metals-contaminated soil is still a difficulty and a hotspot of international research projects. At present, the technologies commonly adopted for the remediation of contaminated sites mainly include excavation, solidification/stabilization (S/S), soil washing, soil vapor extraction (SVE), thermal treatment, and bioremediation. Based on the S/S technical guidelines of Unite State Environmental Protection Agency (EPA) and United Kingdom Environment Agency (EA) and the domestic and foreign patents, this paper introduced the concepts of S/S and its development status at home and abroad, and discussed its future development directions. Solidification refers to a process that binds contaminated media with a reagent, changing the media's physical properties via increasing its compressive strength, decreasing its permeability, and encapsulating the contaminants to form a solid material. Stabilization refers to the process that involves a chemical reaction which reduces the leachability of a waste, chemically immobilizes the waste and reduces its solubility, making the waste become less harmful or less mobile. S/S technology includes cement solidification, lime pozzolanic solidification, plastic materials stabilization, vitrification, and regent-based stabilization. Stabilization (or immobilization) treatment processes convert contaminants to less mobile forms through chemical or thermal interactions. In stabilization technology, the aim of adding agents is to change the soil physical and chemical properties through pH control technology, redox potential technology, precipitation techniques, adsorption technology, and ion-exchange technology that change the existing forms of heavy metals in soil, and thus, reduce the heavy metals bioavailability and mobility. This review also discussed the S/S evaluation methods, highlighted the need to enhance S/S technology in the molecular bonding, soil polymers, and formulation of China's S/S technical guidelines.

Possible multigap type-I superconductivity in the layered boride RuB2

Science.gov (United States)

Singh, Jaskaran; Jayaraj, Anooja; Srivastava, D.; Gayen, S.; Thamizhavel, A.; Singh, Yogesh

2018-02-01

The structure of the layered transition-metal borides A B2 (A =Os,Ru ) is built up by alternating T and B layers with the B layers forming a puckered honeycomb. Here we report superconducting properties of RuB2 with a Tc≈1.5 K using measurements of the magnetic susceptibility versus temperature T , magnetization M versus magnetic field H , resistivity versus T , and heat capacity versus T at various H . We observe a reduced heat capacity anomaly at Tc given by Δ C /γ Tc≈1.1 suggesting multigap superconductivity. Strong support for this is obtained by the successful fitting of the electronic specific heat data to a two-gap model with gap values Δ1/kBTc≈1.88 and Δ2/kBTc≈1.13 . Additionally, M versus H measurements reveal a behavior consistent with type-I superconductivity. This is confirmed by comparing the experimental critical field ≈122 Oe obtained from extrapolation to T =0 of the H -T phase diagram, with an estimate of the T =0 thermodynamic critical field ≈114 Oe. Additionally, the Ginzburg-Landau parameter was estimated to be κ ≈0.1 -0.66 . These results strongly suggest multigap type-I superconductivity in RuB2. We also calculate the band structure and obtain the Fermi surface for RuB2. The Fermi surface consists of one quasi-two-dimensional sheet and two concentric ellipsoidal sheets very similar to OsB2. An additional small fourth sheet is also found for RuB2. RuB2 could thus be an example of a multigap type-I superconductor.

Metal and anion composition of two biopolymeric chemical stabilizers and toxicity risk implication for the environment.

Science.gov (United States)

Ndibewu, P P; Mgangira, M B; Cingo, N; McCrindle, R I

2010-01-01

The objective of this study was to (1) measure the concentration of four anions (Cl(-), F(-), [image omitted], and [image omitted]) and nine other elements (Al, Ba, Ca, K, Mg, Mn, Fe, Ni, and Si) in two nontraditional biopolymeric chemical stabilizers (EBCS1 and EBCS2), (2) investigate consequent environmental toxicity risk implications, and (3) create awareness regarding environmental health issues associated with metal concentration levels in enzyme-based chemical stabilizers that are now gaining widespread application in road construction and other concrete materials. Potential ecotoxicity impacts were studied on aqueous extracts of EBCS1 and EBCS2 using two thermodynamic properties models: the Pitzer-Mayorga model (calculation of the electrolyte activity coefficients) and the Millero-Pitzer model (calculation of the ionic activity coefficients). Results showed not only high concentrations of a variety of metal ions and inorganic anions, but also a significant variation between two chemical stabilizing mixtures. The mixture (EBCS2) with the lower pH value was richer in all the cationic and anionic species than (EBCS1). Sulfate (SO(2-)(4)) concentrations were found to be higher in EBCS2 than in EBCS1. There was no correlation between electrolyte activity and presence of the ionic species, which may be linked to a possible high ionic environmental activity. The concentrations of trace metals found (Mn, Fe, and Ni) were low compared to those of earth metals (Ba, Ca, K, and Mg). The metal concentrations were higher in EBCS1 than in EBCS2. Data suggest that specific studies are needed to establish "zero" permissible metal ecotoxicity values for elements and anions in any such strong polyelectrolytic enzyme-based chemical stabilizers.

Thermo-emf of cermet films based on rare earth borides

International Nuclear Information System (INIS)

Islamgaliev, R.K.; Zyrin, A.V.; Shulishova, O.I.; Shcherbak, I.A

1987-01-01

Thermo-emf and electric conductivity of granulated films which contain a solid solution of europium and praseodymium borides Eu 0.5 Pr 0.5 B 6 as a conducting phase, and glass-crystal binder on the base of alummomagnesial fluosilicates as a dielectric phase are studied within the temperature range of 100-1100 K. Thermo-emf of films has a negative sign within the temperature range of 100-500 K and does not exceed 5 μkV/K according to the absolute value which is close to the value of the conducting phase thermo-emf. A negative sign and a small value of thermo-emf are indicative of the charge transfer in granulated films by electrons. Contribution of each of the components into the general thermo-emf is different at high temperatures in different temperature ranges and depends on the individual physico-chemical properties of the used materials

Stability and activity of doped transition metal zeolites in the hydrothermal processing

Directory of Open Access Journals (Sweden)

Thomas François Robin

2015-12-01

Full Text Available This study investigates the stability and activity of HZSM-5 doped with metals such as molybdenum, nickel, copper and iron in under hydrothermal conditions used for the direct liquefaction of microalgae. Catalysts have been prepared by ion exchange techniques, and MoZSM-5 was also prepared by wet incipient impregnation for comparison. Hydrothermal liquefaction is considered as a potential route to convert microalgae into a sustainable fuel. One of the drawbacks of this process is that the bio-crude produced contains significant levels of nitrogen and oxygen compounds which have an impact on the physical and chemical propriety of the fuel. Heterogeneous catalysts have been shown to improve the quality of the bio-crude by reducing nitrogen and oxygen contents. Zeolites, such as HZSM-5, are strong candidates due to their low cost compared to noble metal catalysts but their stability and activity under hydrothermal conditions is not well understood. The stability of the catalysts has been determined under hydrothermal conditions at 350 °C. Catalysts have been characterised before and after treatment using XRD, BET physisorption and STEM microscopy. Metal leaching was determined by analysis of the water phase following hydrothermal treatment. The inserted cation following ion-exchange can influence the physical properties of HZSM-5 for example molybdenum improves the crystallinity of the zeolite. In general, metal doped zeolites were relatively stable under subcritical water. Activity of the catalysts for processing lipids, protein and microalgae has been assessed. Four feedstocks were selected: sunflower oil, soya proteins, Chlorella and P. ellipsoidea. The catalysts exhibited greater activity towards converting lipids for example MoZSM-5 enhanced the formation of aromatic compounds. NiZSM-5 and CuZSM-5 were observed to be more efficient for deoxygenation.

Stability and Activity of Doped Transition Metal Zeolites in the Hydrothermal Processing

International Nuclear Information System (INIS)

Robin, Thomas François; Ross, Andrew B.; Lea-Langton, Amanda R.; Jones, Jenny M.

2015-01-01

This study investigates the stability and activity of HZSM-5 doped with metals such as molybdenum, nickel, copper, and iron under hydrothermal conditions used for the direct liquefaction of microalgae. Catalysts have been prepared by ion-exchange techniques, and MoZSM-5 was also prepared by wet incipient impregnation for comparison. Hydrothermal liquefaction is considered a potential route to convert microalgae into a sustainable fuel. One of the drawbacks of this process is that the bio-crude produced contains significant levels of nitrogen and oxygen compounds that have an impact on the physical and chemical properties of the fuel. Heterogeneous catalysts have been shown to improve the quality of the bio-crude by reducing nitrogen and oxygen contents. Zeolites, such as HZSM-5, are strong candidates due to their low cost compared to noble metal catalysts, but their stability and activity under hydrothermal conditions are not well understood. The stability of the catalysts has been determined under hydrothermal conditions at 350°C. Catalysts have been characterized before and after treatment using X-ray diffraction, BET physisorption, and scanning transmission electronic microscopy. Metal leaching was determined by the analysis of the water phase following the hydrothermal treatment. The inserted cation following ion-exchange can influence the physical properties of HZSM-5, for example, molybdenum improves the crystallinity of the zeolite. In general, metal-doped zeolites were relatively stable in subcritical water. The activity of the catalysts for processing lipids, protein, and microalgae has been assessed. Four feedstocks were selected: sunflower oil, soya proteins, Chlorella, and Pseudochoricystis ellipsoidea. The catalysts exhibited greater activity toward converting lipids, for example, MoZSM-5 enhanced the formation of aromatic compounds. NiZSM-5 and CuZSM-5 were observed to be more efficient for deoxygenation.

Stability and Activity of Doped Transition Metal Zeolites in the Hydrothermal Processing

Energy Technology Data Exchange (ETDEWEB)

Robin, Thomas François, E-mail: thomas.cognac@gmail.com; Ross, Andrew B.; Lea-Langton, Amanda R.; Jones, Jenny M. [School of Chemical and Process Engineering, University of Leeds, Leeds (United Kingdom)

2015-12-14

This study investigates the stability and activity of HZSM-5 doped with metals such as molybdenum, nickel, copper, and iron under hydrothermal conditions used for the direct liquefaction of microalgae. Catalysts have been prepared by ion-exchange techniques, and MoZSM-5 was also prepared by wet incipient impregnation for comparison. Hydrothermal liquefaction is considered a potential route to convert microalgae into a sustainable fuel. One of the drawbacks of this process is that the bio-crude produced contains significant levels of nitrogen and oxygen compounds that have an impact on the physical and chemical properties of the fuel. Heterogeneous catalysts have been shown to improve the quality of the bio-crude by reducing nitrogen and oxygen contents. Zeolites, such as HZSM-5, are strong candidates due to their low cost compared to noble metal catalysts, but their stability and activity under hydrothermal conditions are not well understood. The stability of the catalysts has been determined under hydrothermal conditions at 350°C. Catalysts have been characterized before and after treatment using X-ray diffraction, BET physisorption, and scanning transmission electronic microscopy. Metal leaching was determined by the analysis of the water phase following the hydrothermal treatment. The inserted cation following ion-exchange can influence the physical properties of HZSM-5, for example, molybdenum improves the crystallinity of the zeolite. In general, metal-doped zeolites were relatively stable in subcritical water. The activity of the catalysts for processing lipids, protein, and microalgae has been assessed. Four feedstocks were selected: sunflower oil, soya proteins, Chlorella, and Pseudochoricystis ellipsoidea. The catalysts exhibited greater activity toward converting lipids, for example, MoZSM-5 enhanced the formation of aromatic compounds. NiZSM-5 and CuZSM-5 were observed to be more efficient for deoxygenation.

Stabilization of cationic and anionic metal species in contaminated soils using sludge-derived biochar.

Science.gov (United States)

Fang, Shen'en; Tsang, Daniel C W; Zhou, Fengsha; Zhang, Weihua; Qiu, Rongliang

2016-04-01

Currently, sludge pyrolysis has been considered as a promising technology to solve disposal problem of municipal sewage sludge, recover sludge heating value, sequester carbon and replenish nutrients in farmland soils. The resultant sludge-derived biochar (SDBC) is potentially an excellent stabilizing agent for metal species. This study applied the SDBC into four soils that had been contaminated in field with cationic Pb(II) and Cd(II)/Ni(II), and anionic Cr(VI) and As(III), respectively. The performance of metal stabilization under various operational and environmental conditions was evaluated with acid batch extraction and column leaching tests. Results indicated the SDBC could effectively stabilize these metals, which was favored by elevated temperature and longer aging. Periodic temperature decrease from 45 to 4 °C resulted in the release of immobilized Cr(VI) and As(III) but not Pb(II). However, a longer aging time offset such metal remobilization. This was possibly because more Pb was strongly bound and even formed stable precipitates, as shown by XRD and sequential extraction results. With increasing time, Cr(VI) was sorbed and partly reduced to Cr(III), while immobilized As(III) was co-oxidized to As(V) as indicated by XPS spectra. Column tests revealed that adding SDBC as a separate layer was unfavorable because the concentrated Cd(II) and Ni(II) in localized positions increased the peak levels of metal release under continuous acid leaching. In contrast, uniformly mixed SDBC could effectively delay the metal breakthrough and reduce their released amounts. Yet, a long-term monitoring may be required for evaluating the potential leaching risks and bioavailability/toxicity of these immobilized and transformed species in the SDBC-amended soils. Copyright © 2016 Elsevier Ltd. All rights reserved.

Heavy metal stabilization in contaminated soil by treatment with calcined cockle shell.

Science.gov (United States)

Islam, Mohammad Nazrul; Taki, Golam; Nguyen, Xuan Phuc; Jo, Young-Tae; Kim, Jun; Park, Jeong-Hun

2017-03-01

In several previous studies, the efficacy of various liming waste materials on the immobilization of heavy metals has been tested and it was found that soils contaminated with heavy metals can be stabilized using this technique. Since lime (CaO) has been identified as the main phase of calcined cockle shell (CCS), it was hypothesized that CCS could be used as a soil amendment to immobilize heavy metals in soil. However, to date, no studies have been conducted using CCS. In this study, the effectiveness of CCS powder on the immobilization of Cd, Pb, and Zn in mine tailing soil was evaluated. After 28 days of incubation, the treated soil samples were exposed to weathering (four cycles of freezing-thawing and four cycles of wetting-drying) for 8 days before being subjected to a leaching test. The results of this study revealed that the soil pH increased from 7.5 to 12.2 with the addition of 5% CCS. A similar soil pH was obtained when the soil was amended with 5% pure CaO. By leaching with 0.1 M HCl, extracted Cd, Pb, and Zn were reduced by up to 85, 85, and 91%, respectively. Therefore, CCS is suggested as a low-cost lime-based soil amendment for stabilizing heavy metals in abandoned mining sites.

Crystal Growth, Structures, and Properties of the Complex Borides, LaOs ₂ Al ₂ B and La ₂ Os ₂ AlB ₂

Energy Technology Data Exchange (ETDEWEB)

Bugaris, Daniel E.; Han, Fei; Im, Jino; Chung, Duck Young; Freeman, Arthur J.; Kanatzidis, Mercouri G.

2015-08-17

Single crystals of two novel quaternary metal borides, LaOs2Al2B and La2Os2AlB2, have been grown from La/Ni eutectic fluxes. LaOs2Al2B crystallizes in tetragonal space group P4/mmm with the CeCr2Si2C-type structure, and lattice parameters a = 4.2075(6) angstrom and c = 5.634(1) angstrom. La2Os2AlB2 exhibits a new crystal structure in monoclinic space group C2/c with lattice parameters a = 16.629(3) angstrom, b = 6.048(1) angstrom, c = 10.393(2) angstrom, and beta = 113.96(3)degrees. Both structures are three-dimensional frameworks with unusual coordination (for solid-state compounds) of the boron atoms by transition metal atoms. The boron atom is square planar in LaOs2Al2B, whereas it exhibits linear and T-shaped geometries in La2Os2AlB2. Electrical resistivity measurements reveal poor metal behavior (rho(30)0 (K) similar to 900 mu Omega cm) for La2Os2AlB2, consistent with the electronic band structure calculations, which also predict a metallic character for LaOs2Al2B.

On magnetic properties of thorium and uranium borides and Usub(1-x)Thsub(x)Bsub(4) solid solutions

International Nuclear Information System (INIS)

Chachkhiani, Z.B.; Chachkhiani, L.G.; Chechernikov, V.I.; Slovyanskikh, V.K.

1982-01-01

The dependence of magnetic susceptibility on temperature of UB 4 compound and Usub(1-x)Thsub(x)Bsub(4) alloy system in the 140-1300 K temperature range is investigated. It has been found that paramagnetic susceptibility does not obeys the Curie-Weiss law. The interpretation of experimental results is performed on the basis of Stoner model of collectivized electrons which permits also to explain the magnetic properites of other thorium and uranium borides

Temperature stability and corrosion behavior of sintered Nd-Dy-Fe-Co-TM-B magnets, TM:V,Mo (abstract)

International Nuclear Information System (INIS)

Adler, E.; Rodewald, W.; Wall, B.

1991-01-01

By simultaneous additions of Co and V or of Co and Mo the temperature stability of sintered Nd-Fe-Al-B magnets can be improved. 1--3 A partial substitution of Nd by Dy increases the coercivity by 1.4 kA/cm per wt. % Dy in the alloy, which results in strong coercivities at high temperatures. At 150 degree C, for instance, coercivities of about 9 kA/cm can be achieved. The magnetizing behavior is determined by nucleation of reversed domains. A complete magnetization requires a magnetizing field strength of about 25 kA/cm and does not depend on the coercive field strength. Although in Nd-Dy-Fe-Co-Mo-B magnets the Nd-rich Fe eutectic and the Nd 1.1 Fe 4 B 4 boride are replaced by the Nd 3 Co compound and the Mo 2 FeB 2 boride, respectively, the corrosion is similar to sintered Nd-Dy-Fe-B magnets. The corrosion rate at the 85 degree C--85% relative humidity test is much more determined by the surface treatment of the magnets

Plutonium inventories for stabilization and stabilized materials

Energy Technology Data Exchange (ETDEWEB)

Williams, A.K.

1996-05-01

The objective of the breakout session was to identify characteristics of materials containing plutonium, the need to stabilize these materials for storage, and plans to accomplish the stabilization activities. All current stabilization activities are driven by the Defense Nuclear Facilities Safety Board Recommendation 94-1 (May 26, 1994) and by the recently completed Plutonium ES&H Vulnerability Assessment (DOE-EH-0415). The Implementation Plan for accomplishing stabilization of plutonium-bearing residues in response to the Recommendation and the Assessment was published by DOE on February 28, 1995. This Implementation Plan (IP) commits to stabilizing problem materials within 3 years, and stabilizing all other materials within 8 years. The IP identifies approximately 20 metric tons of plutonium requiring stabilization and/or repackaging. A further breakdown shows this material to consist of 8.5 metric tons of plutonium metal and alloys, 5.5 metric tons of plutonium as oxide, and 6 metric tons of plutonium as residues. Stabilization of the metal and oxide categories containing greater than 50 weight percent plutonium is covered by DOE Standard {open_quotes}Criteria for Safe Storage of Plutonium Metals and Oxides{close_quotes} December, 1994 (DOE-STD-3013-94). This standard establishes criteria for safe storage of stabilized plutonium metals and oxides for up to 50 years. Each of the DOE sites and contractors with large plutonium inventories has either started or is preparing to start stabilization activities to meet these criteria.

A Study on the Effect of the Boron Potential on the Mechanical Properties of the Borided Layers Obtained by Boron Diffusion at the Surface of AISI 316L Steel

Directory of Open Access Journals (Sweden)

E. Hernández-Sánchez

2014-01-01

Full Text Available The effect of the boron potential on the thickness and the mechanical properties of borided layers was evaluated. The boron potential was established by means of the available atoms of boron contained in a control volume inside a cylinder. The cylinders were manufactured from AISI 316L steel, and the boriding treatment was performed using the powder pack technique at a temperature of 1273 K over an exposure time of 6 h. Four different internal diameters of the cylinders were evaluated (3.17, 4.76, 6.35, and 7.93 mm. The mechanical properties were evaluated using the Berkovich instrumented indentation technique. The results showed a clear influence of the boron potential on the mechanical properties of the layers. The hardness of the layers was stablished in the range of 16.22 to 21.16 GPa. Young’s modulus values were stablished in the range of 255.96 to 341.37 GPa. Also the fracture toughness and brittleness of the layers reflected the influence of the boron potential supplied during the boriding process. Finally, the influence of the boron potential on the constant of parabolic growth (K was also established as a function of the inner diameter of the cylinders.

Chemical stabilization of metals and arsenic in contaminated soils using oxides--a review.

Science.gov (United States)

Komárek, Michael; Vaněk, Aleš; Ettler, Vojtěch

2013-01-01

Oxides and their precursors have been extensively studied, either singly or in combination with other amendments promoting sorption, for in situ stabilization of metals and As in contaminated soils. This remediation option aims at reducing the available fraction of metal(loid)s, notably in the root zone, and thus lowering the risks associated with their leaching, ecotoxicity, plant uptake and human exposure. This review summarizes literature data on mechanisms involved in the immobilization process and presents results from laboratory and field experiments, including the subsequent influence on higher plants and aided phytostabilization. Despite the partial successes in the field, recent knowledge highlights the importance of long-term and large-scale field studies evaluating the stability of the oxide-based amendments in the treated soils and their efficiency in the long-term. Copyright © 2012 Elsevier Ltd. All rights reserved.

Evaluation of the effect of temperature on the stability of metal soaps ...

African Journals Online (AJOL)

The thermal stability of calcium and zinc dicarboxylates was studied. The kinetics of the decomposition was studied thermogravimetrically at various temperatures. The rates of the first stage decomposition were used to assess the effect of temperature on the susceptibility of the metal soaps of dicarboxylic acids to ...

Thermal stability of hexagonal OsB2

Science.gov (United States)

Xie, Zhilin; Blair, Richard G.; Orlovskaya, Nina; Cullen, David A.; Andrew Payzant, E.

2014-11-01

The synthesis of novel hexagonal ReB2-type OsB2 ceramic powder was performed by high energy ball milling of elemental Os and B powders. Two different sources of B powder have been used for this mechanochemical synthesis. One B powder consisted of a mixture of amorphous and crystalline phases and a mixture of 10B and 11B isotopes with a fine particle size, while another B powder was a purely crystalline (rhombohedral) material consisting of enriched 11B isotope with coarse particle size. The same Os powder was used for the synthesis in both cases. It was established that, in the first case, the hexagonal OsB2 phase was the main product of synthesis with a small quantity of Os2B3 phase present after synthesis as an intermediate product. In the second case, where coarse crystalline 11B powder was used as a raw material, only Os2B3 boride was synthesized mechanochemically. The thermal stability of hexagonal OsB2 powder was studied by heating under argon up to 876 °C and cooling in vacuo down to -225 °C. During the heating, the sacrificial reaction 2OsB2+3O2→2Os+2B2O3 took place due to presence of O2/water vapor molecules in the heating chamber, resulting in the oxidation of B atoms and formation of B2O3 and precipitation of Os metal out of the OsB2 lattice. As a result of such phase changes during heating, the lattice parameters of hexagonal OsB2 changed significantly. The shrinkage of the a lattice parameter was recorded in 276-426 °C temperature range upon heating, which was attributed to the removal of B atoms from the OsB2 lattice due to oxidation followed by the precipitation of Os atoms and formation of Os metal. While significant structural changes occurred upon heating due to presence of O2, the hexagonal OsB2 ceramic demonstrated good phase stability upon cooling in vacuo with linear shrinkage of the lattice parameters and no phase changes detected during cooling.

Stabilization of heavy metals in municipal sewage sludge by freeze-thaw treatment with a blend of diatomite, FeSO4, and Ca(OH)2.

Science.gov (United States)

Wang, Jing; Fu, Rongbing; Xu, Zhen

2017-08-01

In this work, the effects of diatomite with 15% FeSO 4 •7H 2 O and 7.5% Ca(OH) 2 on sludge stabilization were investigated using batch leaching tests. The influence of cell rupture caused by freezing and thawing on stabilization was also evaluated. The results indicated that the optimal diatomite percentage was 2%. Cell rupture by freezing and thawing reduced heavy metal leachability, followed by cell death and decrease of organic groups. The concentration of heavy metals in sludge leachate increased after cell rupture, indicating that the heavy metal leachability was reduced after freezing and thawings. Moreover, the stabilization effects were generally improved after freezing and thawing. As compared with the stabilization of the original sludge, the unstable fractions decreased and the residual fractions of the heavy metals increased in the stabilized sludge after cell rupture. This study developed a method to stabilize heavy metals in municipal sewage sludge. Diatomite combined with FeSO 4 ·7H 2 O and Ca(OH) 2 improved the treatment of sewage sludge contaminated by heavy metals. Cell lysis by freeze-thaw treatment reduced the risk of leaching heavy metals caused by cell death and decreased major organic groups in the sludge.

Effects of Imide–Orthoborate Dual-Salt Mixtures in Organic Carbonate Electrolytes on the Stability of Lithium Metal Batteries

Energy Technology Data Exchange (ETDEWEB)

Li, Xing [Energy and Environment; School of Materials Science and Engineering, Southwest Petroleum University, Chengdu, Sichuan 610500, China; Zheng, Jianming [Energy and Environment; Engelhard, Mark H. [Environmental Molecular; Mei, Donghai [Physical and Computational Sciences Directorate, Pacific Northwest National Laboratory, Richland, Washington 99354, United States; Li, Qiuyan [Energy and Environment; Jiao, Shuhong [Energy and Environment; Liu, Ning [Physical and Computational Sciences Directorate, Pacific Northwest National Laboratory, Richland, Washington 99354, United States; State Key Laboratory of Chemical Resource Engineering, Beijing University of Chemical Technology, Beijing, 100029, China; Zhao, Wengao [Energy and Environment; School of Energy Research, Xiamen University, Xiamen, Fujian 361102, China; Zhang, Ji-Guang [Energy and Environment; Xu, Wu [Energy and Environment

2018-01-09

The effects of lithium imide and lithium orthoborate dual-salt electrolytes of different salt chemistries in carbonate solvents on the cycling stability of Li metal batteries were systematically and comparatively investigated. Two imide salts (LiTFSI and LiFSI) and two orthoborate salts (LiBOB and LiDFOB) were chosen for this study and compared with the conventional LiPF6 salt. The cycling stability of the Li metal cells with the electrolytes follows the order from good to poor as LiTFSI-LiBOB > LiTFSI-LiDFOB > LiPF6 > LiFSI-LiBOB > LiFSI-LiDFOB, indicating that LiTFSI behaves better than LiFSI and LiBOB over LiDFOB in these four dual-salt mixtures. The LiTFSI-LiBOB can effectively protect the Al substrate and form a more robust surface film on Li metal anode, while the LiFSI-LiBOB results in serious corrosion to the stainless steel cell case and a thicker and looser surface film on Li anode. Computational calculations indicate that the chemical and electrochemical stabilities also follow the order of LiTFSI-LiBOB > LiTFSI-LiDFOB > LiFSI-LiBOB > LiFSI-LiDFOB. The key findings of this work emphasize that the salt chemistry is critically important for enhancing the interfacial stability of Li metal anode and should be carefully manipulated in the development of high performance Li metal batteries.

Stabilization of Li Metal Anode in DMSO-Based Electrolytes via Optimization of Salt-Solvent Coordination for Li-O ₂ Batteries

Energy Technology Data Exchange (ETDEWEB)

Liu, Bin [Energy and Environment Directorate, Pacific Northwest National Laboratory, Richland WA 99354 USA; Xu, Wu [Energy and Environment Directorate, Pacific Northwest National Laboratory, Richland WA 99354 USA; Yan, Pengfei [Environmental and Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland WA 99354 USA; Kim, Sun Tai [Energy and Environment Directorate, Pacific Northwest National Laboratory, Richland WA 99354 USA; Department of Energy Engineering, School of Energy and Chemical Engineering, Ulsan National Institute of Science and Technology, Ulsan 689-798 South Korea; Engelhard, Mark H. [Environmental and Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland WA 99354 USA; Sun, Xiuliang [Physical and Computational Sciences Directorate, Pacific Northwest National Laboratory, Richland WA 99354 USA; Mei, Donghai [Physical and Computational Sciences Directorate, Pacific Northwest National Laboratory, Richland WA 99354 USA; Cho, Jaephil [Department of Energy Engineering, School of Energy and Chemical Engineering, Ulsan National Institute of Science and Technology, Ulsan 689-798 South Korea; Wang, Chong-Min [Environmental and Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland WA 99354 USA; Zhang, Ji-Guang [Energy and Environment Directorate, Pacific Northwest National Laboratory, Richland WA 99354 USA

2017-03-08

The conventional DMSO-based electrolyte (1 M lithium bis(trifluoromethanesulfonyl)imide (LiTFSI) in DMSO) is unstable against the Li metal anode and therefore cannot be used directly in practical Li-O2 batteries. Here, we demonstrate that a highly concentrated electrolyte based on LiTFSI in DMSO (with a molar ratio of 1:3) can greatly improve the stability of the Li metal anode against DMSO and significantly improve the cycling stability of Li-O2 batteries. This highly concentrated electrolyte contains no free DMSO solvent molecules, but only complexes of (TFSI–)a-Li+-(DMSO)b (where a + b = 4), and thus enhances their stability with Li metal anodes. In addition, such salt-solvent complexes have higher Gibbs activation energy barriers than the free DMSO solvent molecules, indicating improved stability of the electrolyte against the attack of superoxide radical anions. Therefore, the stability of this highly concentrated electrolyte at both Li metal anodes and carbon-based air electrodes has been greatly enhanced, resulting in improved cyclic stability of Li-O2 batteries. The fundamental stability of the electrolyte with free-solvent against the chemical and electrochemical reactions can also be used to enhance the stability of other electrochemical systems.

The Hydrolytic Stability and Degradation Mechanism of a Hierarchically Porous Metal Alkylphosphonate Framework

Directory of Open Access Journals (Sweden)

Kai Lv

2018-03-01

Full Text Available To aid the design of a hierarchically porous unconventional metal-phosphonate framework (HP-UMPF for practical radioanalytical separation, a systematic investigation of the hydrolytic stability of bulk phase against acidic corrosion has been carried out for an archetypical HP-UMPF. Bulk dissolution results suggest that aqueous acidity has a more paramount effect on incongruent leaching than the temperature, and the kinetic stability reaches equilibrium by way of an accumulation of a partial leached species on the corrosion conduits. A variation of particle morphology, hierarchical porosity and backbone composition upon corrosion reveals that they are hydrolytically resilient without suffering any great degradation of porous texture, although large aggregates crack into sporadic fractures while the nucleophilic attack of inorganic layers cause the leaching of tin and phosphorus. The remaining selectivity of these HP-UMPFs is dictated by a balance between the elimination of free phosphonate and the exposure of confined phosphonates, thus allowing a real-time tailor of radionuclide sequestration. Moreover, a plausible degradation mechanism has been proposed for the triple progressive dissolution of three-level hierarchical porous structures to elucidate resultant reactivity. These HP-UMPFs are compared with benchmark metal-organic frameworks (MOFs to obtain a rough grading of hydrolytic stability and two feasible approaches are suggested for enhancing their hydrolytic stability that are intended for real-life separation protocols.

Nitride stabilized core/shell nanoparticles

Science.gov (United States)

Kuttiyiel, Kurian Abraham; Sasaki, Kotaro; Adzic, Radoslav R.

2018-01-30

Nitride stabilized metal nanoparticles and methods for their manufacture are disclosed. In one embodiment the metal nanoparticles have a continuous and nonporous noble metal shell with a nitride-stabilized non-noble metal core. The nitride-stabilized core provides a stabilizing effect under high oxidizing conditions suppressing the noble metal dissolution during potential cycling. The nitride stabilized nanoparticles may be fabricated by a process in which a core is coated with a shell layer that encapsulates the entire core. Introduction of nitrogen into the core by annealing produces metal nitride(s) that are less susceptible to dissolution during potential cycling under high oxidizing conditions.

Comparative leaching of six toxic metals from raw and chemically stabilized MSWI fly ash using citric acid.

Science.gov (United States)

Wang, Huawei; Fan, Xinxiu; Wang, Ya-Nan; Li, Weihua; Sun, Yingjie; Zhan, Meili; Wu, Guizhi

2018-02-15

The leaching behavior of six typical toxic metals (Pb, Zn, Cr, Cd, Cu and Ni) from raw and chemically stabilized (phosphate and chelating agent) municipal solid waste incineration (MSWI) fly ash were investigated using citric acid. Leaching tests indicated that phosphate stabilization can effectively decrease the leaching of Zn, Cd and Cr; whereas chelating agent stabilization shows a strong ability to lower the release of Pb, Cd and Cu, but instead increases the solubility of Zn and Cr at low pH conditions. Sequential extraction results suggested that the leaching of Pb, Zn and Cd in both the stabilized MSWI fly ash samples led to the decrease in Fe/Mn oxide fraction and the increase in exchangeable and carbonate fractions. The leaching of Cr was due to the decrease in exchangeable, carbonate and Fe/Mn oxide fractions in phosphate-stabilized and chelating agent-stabilized MSWI fly ash. The leaching of Cu in both stabilized MSWI fly ash was greatly ascribed to the decrease in Fe/Mn oxide and oxidisable fractions. Moreover, predicted curves by geochemical model indicated that both stabilized MSWI fly ash have the risk of releasing toxic metals under strong acid environment. Copyright © 2017 Elsevier Ltd. All rights reserved.

Magnetic interactions as a stabilizing factor of semiquinone species of lawsone by metal complexation

International Nuclear Information System (INIS)

Valle-Bourrouet, Grettel; Ugalde-Saldivar, Victor M.; Gomez, Martin; Ortiz-Frade, Luis A.; Gonzalez, Ignacio; Frontana, Carlos

2010-01-01

Changes in electrochemical reactivity for lawsone anions (lawsone, 2-hydroxy-1,4-naphthoquinone, HLw) being coordinated to a series of metallic ions in dimethylsulfoxide solution were evaluated. Upon performing cyclic voltammetry experiments for metal complexes of this quinone with pyridine (Py) - structural formula M(II)(Lw - ) 2 (Py) 2 ; M: Co(II), Ni(II), Zn(II) - it was found that the reduction of coordinated Lw - units occurs during the first and second electron uptake in the analyzed compounds. The stability of the electrogenerated intermediates for each complex depends on the d electron configuration in each metal center and is determined by magnetic interactions with the available spins considering an octahedral conformation for all the compounds. This was evidenced by in situ spectroelectrochemical-ESR measurements in the Zn(II) complex in which due to the lack of magnetic interaction owing to its electron configuration, the structure of the coordinated anion radical species was determined. Successive reduction of the associated Lw - units leads to partial dissociation of the complex, determined by the identification of free radical dianion structures in solution. These results show some insights on how metal-lawsone complexation can modify the solution reactivity and stability of the electrogenerated radical species.

Magnetic interactions as a stabilizing factor of semiquinone species of lawsone by metal complexation

Energy Technology Data Exchange (ETDEWEB)

Valle-Bourrouet, Grettel [Universidad de Costa Rica, Escuela de Quimica, San Jose (Costa Rica); Ugalde-Saldivar, Victor M. [Facultad de Quimica, Universidad Nacional Autonoma de Mexico, Ciudad Universitaria, C.P. 04510, Mexico, D.F. (Mexico); Gomez, Martin [Departamento de Sistemas Biologicos, Universidad Autonoma Metropolitana-Xochimilco, C.P. 04960, Mexico, D.F. (Mexico); Ortiz-Frade, Luis A. [Centro de Investigacion y Desarrollo Tecnologico en Electroquimica, Parque Tecnologico Queretaro, Sanfandila, 76703, Pedro Escobedo, Queretaro (Mexico); Gonzalez, Ignacio [Universidad Autonoma Metropolitana - Iztapalapa, Departamento de Quimica, Area de Electroquimica, Apartado postal 55-534, 09340, Mexico, D.F. (Mexico); Frontana, Carlos, E-mail: ultrabuho@yahoo.com.m [Departamento de Quimica, Centro de Investigacion y Estudios Avanzados, Av. Instituto Politecnico Nacional No. 2508 Col. San Pedro Zacatenco, C.P. 07360, Mexico, D.F. (Mexico)

2010-12-01

Changes in electrochemical reactivity for lawsone anions (lawsone, 2-hydroxy-1,4-naphthoquinone, HLw) being coordinated to a series of metallic ions in dimethylsulfoxide solution were evaluated. Upon performing cyclic voltammetry experiments for metal complexes of this quinone with pyridine (Py) - structural formula M(II)(Lw{sup -}){sub 2}(Py){sub 2}; M: Co(II), Ni(II), Zn(II) - it was found that the reduction of coordinated Lw{sup -} units occurs during the first and second electron uptake in the analyzed compounds. The stability of the electrogenerated intermediates for each complex depends on the d electron configuration in each metal center and is determined by magnetic interactions with the available spins considering an octahedral conformation for all the compounds. This was evidenced by in situ spectroelectrochemical-ESR measurements in the Zn(II) complex in which due to the lack of magnetic interaction owing to its electron configuration, the structure of the coordinated anion radical species was determined. Successive reduction of the associated Lw{sup -} units leads to partial dissociation of the complex, determined by the identification of free radical dianion structures in solution. These results show some insights on how metal-lawsone complexation can modify the solution reactivity and stability of the electrogenerated radical species.

Dense cermets containing fine grained ceramics and their manufacture

International Nuclear Information System (INIS)

King, H.L.

1986-01-01

This patent describes a method of producing a ceramic-metal composite (cermet) containing boride-oxide ceramic having components of a first metal boride and a second metal oxide, which ceramic is in mixture in the cermet with elemental metal of the second metal, wherein the cermet is produced by sintering a reaction mixture of the first metal oxide, boron oxide and the elemental second metal. The improvement consists of: combining for the reaction mixture; A. (a) first metal oxide; (b) boron oxide; (c) ceramic component in very finely divided form; and (d) elemental second metal in very finely divided form and in an amount of at least a 100 percent molar excess beyond that amount stoichiometrically required to produce the second metal oxide during sintering; and B. sintering the reaction mixture in inert gas atmosphere

A superconducting battery material: Lithium gold boride (LiAu3B)

Science.gov (United States)

Aydin, Sezgin; Şimşek, Mehmet

2018-04-01

The superconducting and potential cathode material properties of ternary boride of LiAu3B have been investigated by density functional first principles. The Li-concentration effects on the actual electronic and structural properties, namely the properties of LixAu9B3 (x = 0, 1, 2) sub-systems are studied. It is remarkably shown that the existence of Li-atoms has no considerable effect on the structural properties of Au-B skeleton in LiAu3B. Then, it can be offered as a potential cathode material for Li-ion batteries with the very small volume deviation of 0.42%, and the suitable average open circuit voltage of ∼1.30 V. Furthermore, the vibrational and superconducting properties such as electron-phonon coupling constant (λ) and critical temperature (Tc) of LiAu3B are studied. The calculated results suggest that LiAu3B should be a superconductor with Tc ∼5.8 K, also.

Formation and stability of aluminum-based metallic glasses in Al-Fe-Gd alloys

International Nuclear Information System (INIS)

He, Y.; Poon, S.J.; Shiflet, G.J.

1988-01-01

Metallic glasses, a class of amorphous alloys made by rapid solidification, have been studied quite extensively for almost thirty years. It has been recognized for a long time that metallic glasses are usually very strong and ductile, and exhibit high corrosion resistance relative to crystalline alloys with the same compositions. Recently, metallic glasses containing as much as 90 atomic percent aluminum have been discovered independently by two groups. This discovery has both scientific and technological implications. The formability of these new glasses have been found to be unusual. Studies of mechanical properties in these new metallic glasses show that many of them have tensile strengths over 800MPa, greatly exceeding the strongest commercial aluminum alloys. The high strengths of aluminum-rich metallic glasses can be of significant importance in obtaining high strength low density materials. Therefore, from both scientific and technological standpoints, it is important to understand the formation and thermal stability of these metallic glasses. Al-Fe-Gd alloys were chosen for a more detailed study since they exhibit high tensile strengths

Enhanced biological stabilization of heavy metals in sediment using immobilized sulfate reducing bacteria beads with inner cohesive nutrient

Energy Technology Data Exchange (ETDEWEB)

Li, Xin, E-mail: hgxlixin@hnu.edu.cn [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environmental Biology and Pollution Control (Hunan University), Ministry of Education, Changsha 410082 (China); Dai, Lihua; Zhang, Chang; Zeng, Guangming; Liu, Yunguo [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environmental Biology and Pollution Control (Hunan University), Ministry of Education, Changsha 410082 (China); Zhou, Chen [Swette Center for Environmental Biotechnology, Biodesign Institute, Arizona State University (United States); Xu, Weihua; Wu, Youe; Tang, Xinquan; Liu, Wei; Lan, Shiming [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environmental Biology and Pollution Control (Hunan University), Ministry of Education, Changsha 410082 (China)

2017-02-15

Highlights: • Nutrient beads of immobilized SRB were more effective in transforming heavy metals into the more stable bound phases. • Inner cohesive nutrient effectively promoted the stabilization process of heavy metals. • The excellent removal efficiencies of Cu, Zn, Pb and Cd were 76.3%, 95.6%, 100% and 91.2%, respectively. • Easy to recycle and avoid secondary pollution. - Abstract: A series of experiments were conducted for treating heavy metals contaminated sediments sampled from Xiangjiang River, which combined polyvinyl alcohol (PVA) and immobilized sulfate reducing bacteria (SRB) into beads. The sodium lactate was served as the inner cohesive nutrient. Coupling the activity of the SRB with PVA, along with the porous structure and huge specific surface area, provided a convenient channel for the transmission of matter and protected the cells against the toxicity of metals. This paper systematically investigated the stability of Cu, Zn, Pb and Cd and its mechanisms. The results revealed the performance of leaching toxicity was lower and the removal efficiencies of Cu, Zn, Pb and Cd were 76.3%, 95.6%, 100% and 91.2%, respectively. Recycling experiments showed the beads could be reused 5 times with superbly efficiency. These results were also confirmed by continuous extraction at the optimal conditions. Furthermore, X-ray diffraction (XRD) and energy-dispersive spectra (EDS) analysis indicated the heavy metals could be transformed into stable crystal texture. The stabilization of heavy metals was attributed to the carbonyl and acyl amino groups. Results presented that immobilized bacteria with inner nutrient were potentially and practically applied to multi-heavy-metal-contamination sediment.

Thermal conductivity of layered borides: The effect of building defects on the thermal conductivity of TmAlB4 and the anisotropic thermal conductivity of AlB2

Directory of Open Access Journals (Sweden)

X. J. Wang

2014-04-01

Full Text Available Rare earth metal borides have attracted great interest due to their unusual properties, such as superconductivity and f-electron magnetism. A recent discovery attributes the tunability of magnetism in rare earth aluminoborides to the effect of so-called “building defects.” In this paper, we report data for the effect of building defects on the thermal conductivities of α-TmAlB4 single crystals. Building defects reduce the thermal conductivity of α-TmAlB4 by ≈30%. At room temperature, the thermal conductivity of AlB2 is nearly a factor of 5 higher than that of α-TmAlB4. AlB2 single crystals are thermally anisotropic with the c-axis thermal conductivity nearly twice the thermal conductivity of the a-b plane. Temperature dependence of the thermal conductivity near and above room temperature reveals that both electrons and phonons contribute substantially to thermal transport in AlB2 with electrons being the dominant heat carriers.

Implantation and Stability of Metallic Fiducials Within Pulmonary Lesions

International Nuclear Information System (INIS)

Kupelian, Patrick A.; Forbes, Alan; Willoughby, Twyla R. M.S.; Wallace, Karen; Manon, Rafael R.; Meeks, Sanford L.; Herrera, Luis; Johnston, Alan; Herran, Juan J.

2007-01-01

Purpose: To report and describe implantation techniques and stability of metallic fiducials in lung lesions to be treated with external beam radiotherapy. Methods and Materials: Patients undergoing radiation therapy for small early-stage lung cancer underwent implantation with small metallic markers. Implantation was either transcutaneous under computed tomographic (CT) or fluoroscopic guidance or transbronchial with the superDimension/Bronchus system (radiofrequency signal-based bronchoscopy guidance related to CT images). Results: Implantation was performed transcutaneously in 15 patients and transbronchially in 8 patients. Pneumothorax occurred with eight of the 15 transcutaneous implants, six of which required chest tube placement. None of the patients who underwent transbronchial implantation developed pneumothorax. Successfully inserted markers were all usable during gated image-guided radiotherapy. Marker stability was determined by observing the variation in gross target volume (GTV) centroid relative to the marker on repeated CT scans. Average three-dimensional variation in the GTV center relative to the marker was 2.6 ± 1.3 (SD) mm, and the largest variation along any anatomic axis for any patient was <5 mm. Average GTV volume decrease during the observation period was 34% ± 23%. Gross tumor volumes do not appear to shrink uniformly about the center of the tumor, but rather the tumor shapes deform substantially throughout treatment. Conclusions: Transbronchial marker placement is less invasive than transcutaneous placement, which is associated with high pneumothorax rates. Although marker geometry can be affected by tumor shrinkage, implanted markers are stable within tumors throughout the treatment duration regardless of implantation method

[Effect of sodium carbonate assisted hydrothermal process on heavy metals stabilization in medical waste incinerator fly ash].

Science.gov (United States)

Jin, Jian; Li, Xiao-dong; Chi, Yong; Yan, Jian-hua

2010-04-01

A sodium carbonate assisted hydrothermal process was induced to stabilize the fly ash from medical waste incinerator. The results showed that sodium carbonate assisted hydrothermal process reduced the heavy metals leachability of fly ash, and the heavy metal waste water from the process would not be a secondary pollution. The leachability of heavy metals studied in this paper were Cd 1.97 mg/L, Cr 1.56 mg/L, Cu 2.56 mg/L, Mn 17.30 mg/L, Ni 1.65 mg/L, Pb 1.56 mg/L and Zn 189.00 mg/L, and after hydrothermal process with the optimal experimental condition (Na2CO3/fly ash dosage = 5/20, reaction time = 8 h, L/S ratio = 10/1) the leachability reduced to < 0.02 mg/L for Cd, Cr, Cu, Mn, Ni, Pb, and 0.05 mg/L for Zn, according to GB 5085.3-2007. Meanwhile, the concentrations of heavy metals in effluent after hydrothermal process were less than 0.8 mg/L. The heavy metals leachability and concentration in effluent reduced with prolonged reaction time. Prolonged aging can affect the leachability of metals as solids become more crystalline, and heavy metals transferred inside of crystalline. The mechanism of heavy metal stabilization can be concluded to the co precipitation and adsorption effect of aluminosilicates formation, crystallization and aging process.

Stabilization of heavy metals in soil using two organo-bentonites.

Science.gov (United States)

Yu, Kai; Xu, Jian; Jiang, Xiaohong; Liu, Cun; McCall, Wesley; Lu, Jinlong

2017-10-01

Stabilization of Cu, Zn, Cd, Hg, Cr and As in soil using tetramethylammonium (TMA) and dodecyltrimethylammonium (DTMA) modified bentonites (T-Bents and D-Bents) as amendments was investigated. Toxicity characteristic leaching procedure (TCLP) was used to quantify the metal mobility after soil treatment. The structural parameters of modified bentonites, including the BET surface area, basal spacing and zeta potential were obtained as a function of the TMA and DTMA loading at 40, 80, 120, 160 and 200% of the bentonite's cation exchange capacity, respectively. The results indicated that the characteristics of the organo-bentonites fundamentally varied depending on the species and concentration of modifiers loaded on bentonite. T-Bents and D-Bents manifested distinct immobilization effectiveness towards various metals. In association with the organo-bentonite characteristics, the main interactive mechanisms for Cu, Zn and Cd proceeded via cation exchange, Hg proceeded via physical adsorption and partitioning, Cr and As proceeded via specific adsorption and electrostatic attraction, respectively. This study provided operational and mechanistic basis for optimizing the organic clay synthesis and selecting as the appropriate amendment for remediation of heavy metal contaminated soils. Copyright © 2017 Elsevier Ltd. All rights reserved.

Metal fluoride complexes of Na,K-ATPase: characterization of fluoride-stabilized phosphoenzyme analogues and their interaction with cardiotonic steroids.

Science.gov (United States)

Cornelius, Flemming; Mahmmoud, Yasser A; Toyoshima, Chikashi

2011-08-26

The Na,K-ATPase belongs to the P-type ATPase family of primary active cation pumps. Metal fluorides like magnesium-, beryllium-, and aluminum fluoride act as phosphate analogues and inhibit P-type ATPases by interacting with the phosphorylation site, stabilizing conformations that are analogous to specific phosphoenzyme intermediates. Cardiotonic steroids like ouabain used in the treatment of congestive heart failure and arrhythmias specifically inhibit the Na,K-ATPase, and the detailed structure of the highly conserved binding site has recently been described by the crystal structure of the shark Na,K-ATPase in a state analogous to E2·2K(+)·P(i) with ouabain bound with apparently low affinity (1). In the present work inhibition, and subsequent reactivation by high Na(+), after treatment of shark Na,K-ATPase with various metal fluorides are characterized. Half-maximal inhibition of Na,K-ATPase activity by metal fluorides is in the micromolar range. The binding of cardiotonic steroids to the metal fluoride-stabilized enzyme forms was investigated using the fluorescent ouabain derivative 9-anthroyl ouabain and compared with binding to phosphorylated enzyme. The fastest binding was to the Be-fluoride stabilized enzyme suggesting a preformed ouabain binding cavity, in accord with results for Ca-ATPase where Be-fluoride stabilizes the E2-P ground state with an open luminal ion access pathway, which in Na,K-ATPase could be a passage for ouabain. The Be-fluoride stabilized enzyme conformation closely resembles the E2-P ground state according to proteinase K cleavage. Ouabain, but not its aglycone ouabagenin, prevented reactivation of this metal fluoride form by high Na(+) demonstrating the pivotal role of the sugar moiety in closing the extracellular cation pathway.

Graphene-metal interaction and its effect on the interface stability under ambient conditions

Energy Technology Data Exchange (ETDEWEB)

Dong, Aiyi; Fu, Qiang, E-mail: qfu@dicp.ac.cn; Wei, Mingming; Bao, Xinhe

2017-08-01

Highlights: • Graphene (Gr)/transition metal (TM: Fe, Co, Pt, and Au) interfaces form through TM intercalation at Gr/Ru(0001) surface. • Graphene-metal interaction strength follows the order of Ru ≈ Fe ≈ Co > Pt > Au. • Oxygen intercalation occurs at Gr/Fe, Gr/Co, Gr/Pt, and Gr/Ru interfaces but not at Gr/Au interface in air around 100 °C. - Abstract: Interaction between graphene (Gr) and metal plays an important role in physics and chemistry of graphene/metal interfaces. In this work, well-defined interfaces between graphene and transition metals (TMs) including Fe, Co, Pt, and Au were prepared through TM intercalation on Gr/Ru(0001) surface. The Gr-metal interaction was investigated using X-ray photoelectron spectroscopy and ultraviolet photoelectron spectroscopy. We found that graphene interacts most strongly with Ru, Fe and Co and most weakly with Au, following the order of Ru ≈ Fe ≈ Co > Pt > Au. The Gr/Fe, Gr/Co, Gr/Pt, and Gr/Ru interfaces can be readily intercalated by oxygen when exposed to air and illuminated by an infrared lamp. In contrast, oxygen intercalation does not happen at the Gr/Au interface under the same condition. It is suggested that both Gr-metal interaction and oxygen adsorption on the underlying metal surface are critical in the oxygen intercalation and the Gr/metal interface stability.

Evaluation of liquid fragility and thermal stability of Al-based metallic glasses by equivalent structure parameter

International Nuclear Information System (INIS)

Li Xuelian; Bian Xiufang; Hu Lina

2010-01-01

Based on extended Ideal-Atomic-Packing model, we propose an equivalent structure parameter '6x+11y' to evaluate fragility and thermal stability of Al-TM-RE metallic glasses, where x and y are composition concentrations of transition metal (TM) and rare earth (RE), respectively. Experimental results show that glass forming compositions with '6x+11y' near 100 have the smallest fragility parameter and best structure stability. In addition, '6x+11y' parameter has a positive relationship with onset-crystallization temperature, T x . Al-TM-RE glassy alloys with (6x+11y)≤100 undergo primary crystallization of fcc-Al nanocrystals, while alloys with (6x+11y)>100 exhibit nanoglassy or glassy crystallization behavior.

MINE WASTE TECHNOLOGY PROGRAM; PHOSPHATE STABILIZATION OF HEAVY METALS CONTAMINATED MINE WASTE YARD SOILS, JOPLIN, MISSOURI NPL SITE

Science.gov (United States)

This document summarizes the results of Mine Waste Technology Project 22-Phosphate Stabilization of Heavy Metals-Contaminated Mine Waste Yard Soils. Mining, milling, and smelting of ores near Joplin, Missouri, have resulted in heavy metal contamination of the area. The Joplin s...

Formation and stabilization of anionic metal complexes in concentrated aqueous quaternary ammonium salt solutions

International Nuclear Information System (INIS)

Aronson, F.L.; Hwang, L.L.Y.; Ronca, N.; Solomon, N.A.; Steigman, J.

1985-01-01

Anionic complexes of transition metals were stabilized in aqueous solutions containing high concentrations of various short-chain quaternary ammonium salts. Compounds with longer paraffin chains were effective in much less concentrated solution. Complex ions were detected spectrophotometrically. FeCl 4 - , which is usually formed in concentrated HCl, was the predominant Fe(III) complex in 30 m choline chloride containing only 0.12 M HCl. A yellow transitory Tc(VII) chloro-addition intermediate, formed in the reduction of TcO 4 - by concentrated HCl, was stabilized when the solution also contained 25 m choline chloride. Its spectrum, as well as the isolation of an already known Tc(VII) bipyridyl complex, is reported. Concentrated organic electrolytes also stabilized Tc(V) oxide halides against disproportionation and Tc(IV) hexahalides against hydrolysis. Halochromates of Cr(VI) were formed and stabilized in dilute acid containing quaternary ammonium salts. Their UV spectra showed the well-resolved vibronic fine structure associated with the symmetric chromium-to-oxygen charge-transfer band. It is known that these progressions are resolved in aprotic solvents, but not in aqueous acidic solution alone, and that the loss of fine structure in aqueous media is due to hydrogen bonding. The stabilization of anionic metal complexes and the resolution of vibronic structure in halochromates are probably consequences of water-structure-enforced ion paring. The present work suggests that the water molecules in immediate contact with the complex anions are more strongly hydrogen bonded to each other than to the complex. 21 references, 4 figures

A Metal Matrix CNTS Modified Electrode Fabricated Using Micromachining-Based Implantation Method for Improving Sensitivity and Stability

Directory of Open Access Journals (Sweden)

Yan Wang

2013-01-01

Full Text Available The metal matrix carbon nanotubes modified electrode (MCME has been fabricated by a novel process involving preparation of carbon nanotubes (CNTs/polyimide (PI composite film, wet, etching, sputtering, electroplating, and wet-etch releasing. Pretreated CNTs are dispersed in PI by mechanical ball milling and then CNTs solution is spin-coated on the substrate. The CNTs/PI composite film is etched away a layer of PI to expose tips of CNTs using buffering solution. These exposed tips of CNTs are covered by metal particles in sputtering process as metal seed layer, followed by metal supporting film formed by electroplating. The MCME is obtained after releasing PI film from the metal supporting film. The MCME shows well morphology of uniform distributional protruding tips of CNTs and increased electron transfer efficiency with strong bonding connection between CNTs and metal matrix, which greatly improves sensitivity and stability of the MCME. The oxidation peak of the MCME in cyclic voltammeter (CV test is 1.7 times more than that of CNTs suspension spin-coated metal electrode (SCME. The decline of peak current of the MCME after fifty cycles is only 1.8% much less than 67% of the SCME. Better sensitivity and stability may be helpful for CNTs modified electrodes wide application for trace test of many special materials.

Stability and electronic structure of Zr-based ternary metallic glasses and relevant compounds

International Nuclear Information System (INIS)

Hasegawa, M.; Soda, K.; Sato, H.; Suzuki, T.; Taketomi, T.; Takeuchi, T.; Kato, H.; Mizutani, U.

2007-01-01

The electronic structure of the Zr-based metallic glasses has been investigated by theoretical and experimental approaches. One approach is band calculations of the Zr 2 Ni (Zr 66.7 Ni 33.3 ) compound to investigate the electronic structure of the Zr 66.7 Ni 33.3 metallic glass (ΔT x = 0 K) of which the local atomic structure is similar to that of the Zr 2 Ni compound. The other is photoemission spectroscopy of the Zr 50 Cu 35 Al 15 bulk metallic glass (BMG) (ΔT x = 69 K). Here ΔT x = T x - T g where T x and T g are crystallization and glass transition temperature, respectively. Both results and previous ones on the Zr 55 Cu 30 Ni 5 Al 10 BMG indicate that there is a pseudogap at the Fermi level in the electronic structure of these Zr-based metallic glasses, independent of the value of the ΔT x . This implies that the pseudogap at the Fermi level is one of the factors that stabilize the glass phase of Zr-based metallic glasses

Analysis of the stability of native oxide films at liquid lead/metal interfaces

International Nuclear Information System (INIS)

Lesueur, C.; Chatain, D.; Gas, P.; Bergman, C.; Baque, F.

2002-01-01

The interface between liquid lead and different metallic solids (pure metals: Al, Fe and Ni, and T91 steel) was investigated below 400 deg C under ultrahigh vacuum (UHV) by wetting experiments. The aim was to check the physical stability of native oxide films grown at the surface of the substrates, along a contact with liquid lead. Two types of metallic substrates were used: i) conventional bulk polycrystals, and ii) nanocrystalline films obtained by e-beam evaporation under UHV. The actual contact between liquid lead and the solid substrates was achieved by preparing lead drops in-situ. Wetting experiments were performed using sessile drop and/or liquid bridge methods. Fresh solid surfaces and former liquid/solid interfaces can be explored by squeezing and stretching a liquid lead bridge formed between two parallel and horizontal substrates. It is shown that the contact with liquid lead produces the detachment of the native oxide films grown on the metallic solids. It is concluded that if oxide coatings are needed to protect a metallic solid from attack by liquid lead, they should be self-renewable. (authors)

Interfacial transport phenomena and stability in liquid-metal/water systems: scaling considerations

International Nuclear Information System (INIS)

Abdulla, S.; Liu, X.; Anderson, M.; Bonazza, R.; Corradini, M.; Cho, D.

2001-01-01

One concept being considered for steam generation in innovative nuclear reactor applications, involves water coming into direct contact with a circulating molten metal. The vigorous agitation of the two fluids, the direct liquid-liquid contact and the consequent large interfacial area give rise to very high heat transfer coefficients and rapid steam generation. For an optimum design of such direct contact heat exchange and vaporization systems, detailed knowledge is necessary of the various flow regimes, interfacial transport phenomena, heat transfer and operational stability. In this paper we describe current results from the first year of this research that studies the transport phenomena involved with the injection of water into molten metals (e.g., lead alloys). In particular, this work discusses scaling considerations related to direct contact heat exchange, our experimental plans for investigation and a test plan for the important experimental parameters; i.e., the water and liquid metal mass flow rates, the liquid metal pool temperature and the ambient pressure of the direct contact heat exchanger. Past experimental work and initial scaling results suggest that our experiments can directly represent the proper liquid metal pool temperature and the water subcooling. The experimental variation in water and liquid metal flow rates and system pressure (1-10 bar), although smaller than the current conceptual system designs, is sufficient to verify the expected scale effects to demonstrate the phenomena. (authors)

Materials for high-temperature hydrogen fluorine environments. Final report, June 1976-December 1978

International Nuclear Information System (INIS)

Holcombe, C.E. Jr.; Kovach, L.

1981-03-01

A determination has been made of the stability of 35 materials under high-temperature, fluorine rich, hydrogen fluoride torch testing. Refractory materials tested included 4 borides, 3 carbides, 3 nitrides, 12 oxides, 1 oxynitride, 1 sulfide, 10 metals, and carbon (10 types). Three materials distinctly performed better than nickel: lanthanum hexaboride, calcium hexaboride, and lanthanum silicon oxynitride. Of these, lanthanum hexaboride is the best candidate tested since it has an estimated upper use temperature > 1726 K, which is above the melting point and more than 300 K above the upper use temperature of nickel

Materials for high-temperature hydrogen fluorine environments. Final report, June 1976-December 1978

Energy Technology Data Exchange (ETDEWEB)

Holcombe, C.E. Jr.; Kovach, L.

1981-03-01

A determination has been made of the stability of 35 materials under high-temperature, fluorine rich, hydrogen fluoride torch testing. Refractory materials tested included 4 borides, 3 carbides, 3 nitrides, 12 oxides, 1 oxynitride, 1 sulfide, 10 metals, and carbon (10 types). Three materials distinctly performed better than nickel: lanthanum hexaboride, calcium hexaboride, and lanthanum silicon oxynitride. Of these, lanthanum hexaboride is the best candidate tested since it has an estimated upper use temperature > 1726 K, which is above the melting point and more than 300 K above the upper use temperature of nickel.

Stability of metal organic frameworks and interaction of small gas molecules in these materials

Science.gov (United States)

Tan, Kui

The work in this dissertation combines spectroscopy ( in-situ infrared absorption and Raman), powder X-ray diffraction and DFT calculations to study the stability of metal organic frameworks materials (MOFs) in the presence of water vapor and other corrosive gases (e.g., SO 2, NO2 NO), and the interaction and competitive co-adsorption of several gases within MOFs by considering two types of prototypical MOFs: 1) a MOF with saturated metal centers based on paddlewheel secondary building units: M(bdc)(ted)0.5 [M=Cu, Zn, Ni, Co, bdc = 1,4-benzenedicarboxylate, ted = triethylenediamine], and 2) a MOF with unsaturated metal centers: M2(dobdc) [M=Mg2+, Zn2+, Ni2+, Co2+ and dobdc = 2,5-dihydroxybenzenedicarboxylate]. We find that the stability of MOFs to water vapor critically depends on their structure and the specific metal cation in the building units. For M(bdc)(ted)0.5, the metal-bdc bond is the most vulnerable for Cu(bdc)(ted)0.5, while the metal-ted bond is first attacked for the Zn and Co analogs. In contrast, Ni(bdc)(ted)0.5 remains stable under the same conditions. For M2(dobdc), or MOF-74, the weak link is the dobdc-metal bond. The water molecule is dissociatively adsorbed at the metal-oxygen group with OH adsorption directly on the metal center and H adsorption on the bridging O of the phenolate group in the dobdc linker. Other technologically important molecules besides water, such as NO, NO2, SO2, tend to poison M2(dobdc) through dissociative or molecular adsorption onto the open metal sites. A high uptake SO2 capacity was measured in M(bdc)(ted)0.5, attributed to multipoint interactions between the guest SO2 molecule and the MOF host. In the case of competitive co-adsorption between CO2 and other small molecules, we find that binding energy alone is not a good indicator of molecular site occupation within the MOF (i.e., it cannot successfully predict and evaluate the displacement of CO2 by other molecules). Instead, we show that the kinetic barrier for the

Remote stabilization of copper paddlewheel based molecular building blocks in metal-organic frameworks

KAUST Repository

Gao, Wenyang

2015-03-24

Copper paddlewheel based molecular building blocks (MBBs) are ubiquitous and have been widely employed for the construction of highly porous metal-organic frameworks (MOFs). However, most copper paddlewheel based MOFs fail to retain their structural integrity in the presence of water. This instability is directly correlated to the plausible displacement of coordinating carboxylates in the copper paddlewheel MBB, [Cu2(O2C-)4], by the strongly coordinating water molecules. In this comprehensive study, we illustrate the chemical stability control in the rht-MOF platform via strengthening the coordinating bonds within the triangular inorganic MBB, [Cu3O(N4-x(CH)xC-)3] (x = 0, 1, or 2). Remotely, the chemical stabilization propagated into the paddlewheel MBB to afford isoreticular rht-MOFs with remarkably enhanced water/chemical stabilities compared to the prototypal rht-MOF-1. © 2015 American Chemical Society.

Remote stabilization of copper paddlewheel based molecular building blocks in metal-organic frameworks

KAUST Repository

Gao, Wenyang; Cai, Rong; Pham, Tony T.; Forrest, Katherine A.; Hogan, Adam; Nugent, Patrick S.; Williams, Kia R.; Wojtas, Łukasz; Luebke, Ryan; Weselinski, Lukasz Jan; Zaworotko, Michael J.; Space, Brian; Chen, Yusheng; Eddaoudi, Mohamed; Shi, Xiaodong; Ma, Shengqian

2015-01-01

Copper paddlewheel based molecular building blocks (MBBs) are ubiquitous and have been widely employed for the construction of highly porous metal-organic frameworks (MOFs). However, most copper paddlewheel based MOFs fail to retain their structural integrity in the presence of water. This instability is directly correlated to the plausible displacement of coordinating carboxylates in the copper paddlewheel MBB, [Cu2(O2C-)4], by the strongly coordinating water molecules. In this comprehensive study, we illustrate the chemical stability control in the rht-MOF platform via strengthening the coordinating bonds within the triangular inorganic MBB, [Cu3O(N4-x(CH)xC-)3] (x = 0, 1, or 2). Remotely, the chemical stabilization propagated into the paddlewheel MBB to afford isoreticular rht-MOFs with remarkably enhanced water/chemical stabilities compared to the prototypal rht-MOF-1. © 2015 American Chemical Society.

Potential of Cassia alata L. Coupled with Biochar for Heavy Metal Stabilization in Multi-Metal Mine Tailings.

Science.gov (United States)

Huang, Lige; Li, Yuanyuan; Zhao, Man; Chao, Yuanqing; Qiu, Rongliang; Yang, Yanhua; Wang, Shizhong

2018-03-12

To explore the effect of different biochars on Cassia alata L. growth and heavy metal immobilization in multi-metal mine tailings, a 100-day pot experiment was conducted. Three biochars derived from Hibiscus cannabinus core (HB), sewage sludge (SB) and chicken manure (MB), were added to mine tailings at rates of 0.4%, 1% and 3% ( w / w ). The results showed that the root biomass, shoot biomass, plant height and root length were 1.2-2.8, 1.7-3.2, 1-1.5 and 1.6-3.3 times of those in the control group, respectively. Pb, Zn, Cu, Cd and As contents in the shoot decreased by 63.9-89.5%, 46.9-66.0%, 32.7-62.4%, 40.4-76.4% and 54.9-77.5%, respectively. The biochar significantly increased the pH and decreased the mild acid-soluble Pb and Cu concentrations in the mine tailings. Specifically, SB immobilized Pb and Cu better than MB and HB did, although it did not immobilize As, Zn or Cd. Meanwhile, more attention should be paid to the potential As release as the biochar application rate increases. In conclusion, Cassia alata L. coupled with 3% of SB could be an effective measure for restoring multi-metal mine tailings. This study herein provided a promising ecological restoration technique for future practice of heavy metal stabilization in mine tailings.

Crucible-Free Synthesis of Silicides and Borides; Synthese de siliciures et de borures sans creuset; Bestigel'nyj sintez silitsidov i boridov; Sintesis de siliciuros y boruros sin crisol

Energy Technology Data Exchange (ETDEWEB)

Ban, Z.; Sikirica, M. [Rudjer Boskovic Institute, Zagreb, Yugoslavia (Croatia)

1963-11-15

The laboratory method for preparing pure silicides and borides, reducing the corresponding oxides of metals, has been developed. Synthesis of silicides was carried out in the floating zone of molten silicon. The floating zone was obtained by means of electron bombardment. Synthesis of borides is similar but reactions are generally of the solid-solid type. Initial heating of the reaction mixture was also obtained by means of the electron beam but further heating was produced by the ionized gaseous products of the reaction. (author) [French] On a mis au point une methode pour la preparation en laboratoire de siliciures et de borures purs, par reduction des oxydes des metaux correspondants. La synthese des siliciures a pu etre faite dans la ''zone flottante'' du silicium fondu. Cette zone flottante a ete obtenue par bombardement electronique. La synthese des borures est analogue, mais les reactions ont lieu generalement a Tetat solide. Le chauffage initial du melange reactionnel a egalement ete obtenu pai bombardement electronique, mais le chauffage ulterieur etait assure par les electrons diffuses des produits ionises gazeux de la reaction. (author) [Spanish] Los autores idearon un metodo de laboratorio para preparar siliciuros y boruros puros por reduccion de los respectivos oxidos metalicos. La sintesis de los siliciuros se llevo a cabo en la zona flotante del silicio fundido. Esa zona se obtuvo por bombardeo electronico. La sintesis de los boruros se llevo a cabo de manera similar, pero generalmente las reacciones son del tipo solido-solido. El calentamiento inicial de la mezcla se efectuo tambien mediante un haz electronico, pero el calentamiento ulterior es producido por la dispersion electronica en los productos de reaccion ionizados en estado gaseoso. (author) [Russian] Razrabotan laboratornyj metod prigotovleniya chistykh silitsidov i boridov putem vosstanovleniya sootvetstvennykh okislov metalla. Sintez, silitsidov provodili v plavayushchej zone

Stabilized chitosan/Fe(0)-nanoparticle beads to remove heavy metals from polluted sediments.

Science.gov (United States)

Liu, T; Sun, Y; Wang, Z L

2016-01-01

Sediment contamination by heavy metals has become a widespread problem that can affect the normal behaviors of rivers and lakes. After chitosan/Fe(0)-nanoparticles (CS-NZVI) beads were cross-linked with glutaraldehyde (GLA), their mechanical strength, stability and separation efficiency from the sediment were obviously improved. Moreover, the average aperture size of GLA-CS-NZVI beads was 20.6 μm and NZVI particles were nearly spherical in shape with a mean diameter of 40.2 nm. In addition, the pH showed an insignificant effect on the removal rates from the sediment. Due to the dissolution of metals species into aqueous solutions as an introduction of the salt, the removal rates of all heavy metals from the sediment were increased with an increase of the salinity. The competitive adsorption of heavy metals between the sediment particles and GLA-CS-NZVI beads became stronger as the sediment particles became smaller, leading to decreased removal rates. Therefore, the removal efficiency could be enhanced by optimizing experimental conditions and choosing appropriate materials for the target contaminants.

UV stabilization of wood by nano metal oxides dispersed in propylene glycol.

Science.gov (United States)

Nair, Sreeja; Nagarajappa, Giridhar B; Pandey, Krishna K

2018-06-01

Nanoparticles of some of the metal oxides are known to have high UV protective efficiency. The UV filtering efficiency of nanoparticles invariably depends on their size and stability in the dispersion. In the present work, a stable dispersion of nanoparticles of three metal oxides, zinc oxide (ZnO), cerium oxide (CeO 2 ) and titanium dioxide (TiO 2 ), was prepared in propylene glycol (PG) using ultrasonication. The method is easy and useful as no additional surfactant or dispersant is needed. The particle size and its distribution was confirmed by Scanning Electron Microscopy and Dynamic Light Scattering. The stability of dispersion was assessed by UV-visible absorption spectroscopy. The UV stability of wood surfaces of Wrightia tinctoria coated with nanodispersions of ZnO, CeO 2 and TiO 2 was evaluated under laboratory conditions in an accelerated weathering tester. Changes in the colour and FTIR spectra of exposed specimens were measured periodically. Rapid colour darkening (yellowing) was observed in uncoated and PG coated specimens. In contrast, nanodispersion coated specimens prevented photo-yellowing considerably with significant reduction in colour changes examined by CIE L*, a*, b* and ΔE*. Increase in concentration of nanoparticles in the dispersion imparted higher resistance to UV induced degradation. However, increased concentration of nanoparticles reduced the transparency of the coating. FTIR analysis indicated rapid degradation of lignin in uncoated and PG coated specimens due to UV exposure. Coating of wood surfaces with nanodispersions restricted lignin degradation. The study also demonstrates the potential of propylene glycol as a dispersant for developing stable and efficient UV protective nanodispersions for wood coating. Copyright © 2018 Elsevier B.V. All rights reserved.

Rubber effect and stabilization of martensites in noble metal based alloys

International Nuclear Information System (INIS)

Marukawa, K.; Takezawa, K.; Hoshi, H.

1999-01-01

In a previous paper, it has been pointed out that the rubber effect and stabilization of the martensite phase are caused by short range reordering during aging [K. Marukawa, K. Tsuchiya, Scripta Metall. Mater. 32 (1995) 77]. This view was further examined by experimental and theoretical studies. It has been found that the change in electrical resistivity produced by aging is well correlated with magnitudes of these effects. The relation between the short range order parameters and the representative quantities of these effects was formulated on the basis of thermodynamics. Quantitative evaluation was performed by numerical calculations utilizing the Monte Carlo method. It was found that the rubber effect is prominent when the aging temperature is in the vicinity of the order-disorder transition temperature. It was also shown that in most cases disordering or lowering in the long range order causes the stabilization. (orig.)

Testing Single and Combinations of Amendments for Stabilization of Metals in Contrasting Extremely Contaminated Soils

Directory of Open Access Journals (Sweden)

Siebielec G.

2013-04-01

Full Text Available Metals can be stabilized by soil amendments that increase metals adsorption or alter their chemical forms. Such treatments may limit the risk related to the contamination through reduction of metal transfer to the food chain (reduction of metal uptake by plants and its availability to soil organisms and metals migration within the environment. There is a need for experiments comparing various soil amendments available at reasonable amounts under similar environmental conditions. The other question is whether all components of soil environment or soil functions are similarly protected after remediation treatment. We conducted a series of pot studies to test some traditional and novel amendments and their combinations. The treatments were tested for several highly Zn/Cd/Pb contaminated soils. Among traditional amendments composts were the most effective – they ensured plant growth, increased soil microbial activity, reduced Cd in earthworms, reduced Pb bioaccessibility and increased share of unavailable forms of Cd and Pb.

In situ stabilization of heavy metals in multiple-metal contaminated paddy soil using different steel slag-based silicon fertilizer.

Science.gov (United States)

Ning, Dongfeng; Liang, Yongchao; Song, Alin; Duan, Aiwang; Liu, Zhandong

2016-12-01

Steel slag has been widely used as amendment and silicon fertilizer to alleviate the mobility and bioavailability of heavy metals in soil. The objective of this study was to evaluate the influence of particle size, composition, and application rate of slag on metal immobilization in acidic soil, metals uptake by rice and rice growth. The results indicated that application of slag increased soil pH, plant-available silicon concentrations in soil, and decreased the bioavailability of metals compared with control treatment, whereas pulverous slag (S1) was more effective than granular slag (S2 and S3). The acid-extractable fraction of Cd in the spiked soil was significantly decreased with application of S1 at rates of 1 and 3 %, acid-extractable fractions of Cu and Zn were decreased when treated at 3 %. Use of S1 at both rates resulted in significantly lower Cd, Cu, and Zn concentrations in rice tissues than in controls by 82.6-92.9, 88.4-95.6, and 67.4-81.4 %, respectively. However, use of pulverous slag at 1 % significantly promotes rice growth, restricted rice growth when treated at 3 %. Thus, the results explained that reduced particle size and suitable application rate of slag could be beneficial to rice growth and metals stabilization.

Surface half-metallicity and stability of zinc-blende sodium monoselenide

International Nuclear Information System (INIS)

Tabatabaeifar, A.; Davatolhagh, S.; Moradi, M.

2017-01-01

Highlights: • Density functional study reveals. • Robust half-metallicity of zinc-blende NaSe (001) surfaces. • Stable against phase separation as indicated by negative formation energy. • Magnetically stable at room temperature because of high Curie temperature. • Surfaces are stable as indicated by low surface energies. • Therefore, zinc-blende NaSe promising candidate as spin injection material. - Abstract: The electronic structure and magnetic properties of relaxed (001) surfaces of the sp-electron half-metallic ferromagnet NaSe in the zinc-blende phase, are calculated on the basis of first principle density functional theory within the framework of self-consistent field plane wave pseudo-potential method, using the generalized gradient approximation for the exchange-correlation functional. The results of this study reveal that both Na- and Se-terminated surfaces retain the robust bulk half-metallic property. The negative value found for the bulk formation energy indicates that this material is stable against phase separation. We also obtain the surface energies and discuss their stability via the calculated bulk formation energy. The Curie temperature is estimated to be 920 K within mean field approximation, which is well above the room temperature. In the light of the above, zinc-blende NaSe appears to be a good candidate for spintronic applications as spin injection material.

Potential of Cassia alata L. Coupled with Biochar for Heavy Metal Stabilization in Multi-Metal Mine Tailings

Directory of Open Access Journals (Sweden)

Lige Huang

2018-03-01

Full Text Available To explore the effect of different biochars on Cassia alata L. growth and heavy metal immobilization in multi-metal mine tailings, a 100-day pot experiment was conducted. Three biochars derived from Hibiscus cannabinus core (HB, sewage sludge (SB and chicken manure (MB, were added to mine tailings at rates of 0.4%, 1% and 3% (w/w. The results showed that the root biomass, shoot biomass, plant height and root length were 1.2–2.8, 1.7–3.2, 1–1.5 and 1.6–3.3 times of those in the control group, respectively. Pb, Zn, Cu, Cd and As contents in the shoot decreased by 63.9–89.5%, 46.9–66.0%, 32.7–62.4%, 40.4–76.4% and 54.9–77.5%, respectively. The biochar significantly increased the pH and decreased the mild acid-soluble Pb and Cu concentrations in the mine tailings. Specifically, SB immobilized Pb and Cu better than MB and HB did, although it did not immobilize As, Zn or Cd. Meanwhile, more attention should be paid to the potential As release as the biochar application rate increases. In conclusion, Cassia alata L. coupled with 3% of SB could be an effective measure for restoring multi-metal mine tailings. This study herein provided a promising ecological restoration technique for future practice of heavy metal stabilization in mine tailings.

Potential of Cassia alata L. Coupled with Biochar for Heavy Metal Stabilization in Multi-Metal Mine Tailings

Science.gov (United States)

Huang, Lige; Li, Yuanyuan; Zhao, Man; Chao, Yuanqing; Qiu, Rongliang; Yang, Yanhua

2018-01-01

To explore the effect of different biochars on Cassia alata L. growth and heavy metal immobilization in multi-metal mine tailings, a 100-day pot experiment was conducted. Three biochars derived from Hibiscus cannabinus core (HB), sewage sludge (SB) and chicken manure (MB), were added to mine tailings at rates of 0.4%, 1% and 3% (w/w). The results showed that the root biomass, shoot biomass, plant height and root length were 1.2–2.8, 1.7–3.2, 1–1.5 and 1.6–3.3 times of those in the control group, respectively. Pb, Zn, Cu, Cd and As contents in the shoot decreased by 63.9–89.5%, 46.9–66.0%, 32.7–62.4%, 40.4–76.4% and 54.9–77.5%, respectively. The biochar significantly increased the pH and decreased the mild acid-soluble Pb and Cu concentrations in the mine tailings. Specifically, SB immobilized Pb and Cu better than MB and HB did, although it did not immobilize As, Zn or Cd. Meanwhile, more attention should be paid to the potential As release as the biochar application rate increases. In conclusion, Cassia alata L. coupled with 3% of SB could be an effective measure for restoring multi-metal mine tailings. This study herein provided a promising ecological restoration technique for future practice of heavy metal stabilization in mine tailings. PMID:29534505

Experiments on the stability of metal diapirs

Science.gov (United States)

Wacheul, J. S.; Le Bars, M.; Aurnou, J. M.; Monteux, J.

2013-12-01

In the late stages of their accretions, telluric planets had most likely had a magma ocean because of numerous heat sources such as the important decay of radioactive elements and giant impacts. These giant impacts involved asteroid nearly as big as the moon, which were certainly differentiated. The core of these planetary embryos ultimately merged with the planets, but the amount of heat and chemicals they exchanged with the mantle during its passing through remains a widely open question. The question of the stability of an immiscible iron diapir falling through a magma ocean is essential for our understanding of these events. Thus, we have conducted the first experiments on an analogue system that involves liquid metal; we used liquid gallium as the melted iron and glycerol as the magma ocean. This set up allowed us to reach Reynolds numbers closer to the geophysical problem than other previous studies and accurate viscosity ratios. Using video analysis, we reconstruct the spectra of droplet sizes and velocities, from which we calculate a typical length of equilibration as a function of the diapir's radius. Our preliminary results are in agreement with the scenario of the iron rain concerning the droplet sizes, with a significant influence of the viscosity ratio on the maximal size of the droplets. However, the speed of these droplets seems to be controlled by the inertia of the whole flow in a sense that the relevant concept for the mixing between metal and silicate is turbulent mixing between miscible fluids. The influence of coalescence between droplets on this mixing, involving a significant part of the flow according to our experiment, is still to be quantified.

Approximate entropy—a new statistic to quantify arc and welding process stability in short-circuiting gas metal arc welding

International Nuclear Information System (INIS)

Cao Biao; Xiang Yuanpeng; Lü Xiaoqing; Zeng Min; Huang Shisheng

2008-01-01

Based on the phase state reconstruction of welding current in short-circuiting gas metal arc welding using carbon dioxide as shielding gas, the approximate entropy of welding current as well as its standard deviation has been calculated and analysed to investigate their relation with the stability of electric arc and welding process. The extensive experimental and calculated results show that the approximate entropy of welding current is significantly and positively correlated with arc and welding process stability, whereas its standard deviation is correlated with them negatively. A larger approximate entropy and a smaller standard deviation imply a more stable arc and welding process, and vice versa. As a result, the approximate entropy of welding current promises well in assessing and quantifying the stability of electric arc and welding process in short-circuiting gas metal arc welding

HIGHLY REFRACTORY CRUCIBLES OF STABILIZED ZIRCONIA FOR INDUCTION MELTING OF THE PLATINUM GROUP METALS, FABRICATED BY VIBROCASTING

OpenAIRE

V. V. Primachenko; V. V. Martynenko; I. G. Szulik; I. A. Kushchenko

2012-01-01

As the result of the studies at PJSC « UKRNIIO them. A.S.Berezhnogo» the technology and commercial production of crucibles from stabilized zirconia for the smelting of platinum group metals are develop

Thermal stability of hexagonal OsB2

International Nuclear Information System (INIS)

Xie, Zhilin; Blair, Richard G.; Orlovskaya, Nina; Cullen, David A.; Andrew Payzant, E.

2014-01-01

The synthesis of novel hexagonal ReB 2 -type OsB 2 ceramic powder was performed by high energy ball milling of elemental Os and B powders. Two different sources of B powder have been used for this mechanochemical synthesis. One B powder consisted of a mixture of amorphous and crystalline phases and a mixture of 10 B and 11 B isotopes with a fine particle size, while another B powder was a purely crystalline (rhombohedral) material consisting of enriched 11 B isotope with coarse particle size. The same Os powder was used for the synthesis in both cases. It was established that, in the first case, the hexagonal OsB 2 phase was the main product of synthesis with a small quantity of Os 2 B 3 phase present after synthesis as an intermediate product. In the second case, where coarse crystalline 11 B powder was used as a raw material, only Os 2 B 3 boride was synthesized mechanochemically. The thermal stability of hexagonal OsB 2 powder was studied by heating under argon up to 876 °C and cooling in vacuo down to −225 °C. During the heating, the sacrificial reaction 2OsB 2 +3O 2 →2Os+2B 2 O 3 took place due to presence of O 2 /water vapor molecules in the heating chamber, resulting in the oxidation of B atoms and formation of B 2 O 3 and precipitation of Os metal out of the OsB 2 lattice. As a result of such phase changes during heating, the lattice parameters of hexagonal OsB 2 changed significantly. The shrinkage of the a lattice parameter was recorded in 276–426 °C temperature range upon heating, which was attributed to the removal of B atoms from the OsB 2 lattice due to oxidation followed by the precipitation of Os atoms and formation of Os metal. While significant structural changes occurred upon heating due to presence of O 2 , the hexagonal OsB 2 ceramic demonstrated good phase stability upon cooling in vacuo with linear shrinkage of the lattice parameters and no phase changes detected during cooling. - Graphical abstract: The in situ high temperature XRD

The use of indigenous plant species and calcium phosphate for the stabilization of highly metal-polluted sites in southern Poland

NARCIS (Netherlands)

Kucharski, R.; Sas-Nowosielska, A.; Malkowski, E.; Japenga, J.; Kuperberg, J.M.; Pogrzeba, M.; Krzyzak, J.

2005-01-01

Highly metal-polluted (Pb, Cd, Zn) soil from a non-ferrous mine and smelter site in southern Poland, further referred to as Waryski soil, was used to test indigenous plant species for stabilization effectiveness of heavy metals in soils. Results of pilot investigations with commercially available

Co-Immobilization of Enzymes and Magnetic Nanoparticles by Metal-Nucleotide Hydrogelnanofibers for Improving Stability and Recycling

Directory of Open Access Journals (Sweden)

Chunfang Li

2017-01-01

Full Text Available In this paper we report a facile method for preparing co-immobilized enzyme and magnetic nanoparticles (MNPs using metal coordinated hydrogel nanofibers. Candida rugosa lipase (CRL was selected as guest protein. For good aqueous dispersity, low price and other unique properties, citric acid-modified magnetic iron oxide nanoparticles (CA-Fe3O4 NPs have been widely used for immobilizing enzymes. As a result, the relative activity of CA-Fe3O4@Zn/AMP nanofiber-immobilized CRL increased by 8-fold at pH 10.0 and nearly 1-fold in a 50 °C water bath after 30 min, compared to free CRL. Moreover, the immobilized CRL had excellent long-term storage stability (nearly 80% releative activity after storage for 13 days. This work indicated that metal-nucleotide nanofibers could efficiently co-immobilize enzymes and MNPs simultaneously, and improve the stability of biocatalysts.

Fabrication of BN/Al(-Mg) metal matrix composite (MMC) by pressureless infiltration technique

Energy Technology Data Exchange (ETDEWEB)

Jung, W.G.; Kwon, H. [School of Advanced Materials Eng., Kookmin Univ., Seoul (Korea)

2004-07-01

BN/Al(-Mg) metal matrix composite (MMC) was fabricated by the pressureless infiltration technique. The phase characterizations of the composites were analyzed using the SEM, TEM, EDS and EPMA on reaction products after the electrochemical dissolution of the matrix. It is confirmed that aluminum nitride (AlN) was formed by the reaction of Mg{sub 3}N{sub 2} and Al alloy melt. Plate type AlN and polyhedral type Mg(-Al) boride were formed by the reaction between Mg{sub 3}N{sub 2}, BN and molten Al in the composite. The reaction mechanism in the fabrication of BN/Al(-Mg) MMC was derived from the phase analysis results and the thermodynamic investigation. (orig.)

A Plasma-Assisted Route to the Rapid Preparation of Transition-Metal Phosphides for Energy Conversion and Storage

KAUST Repository

Liang, Hanfeng

2017-06-06

Transition-metal phosphides (TMPs) are important materials that have been widely used in catalysis, supercapacitors, batteries, sensors, light-emitting diodes, and magnets. The physical and chemical structure of a metal phosphide varies with the method of preparation as the electronic, catalytic, and magnetic properties of the metal phosphides strongly depend on their synthesis routes. Commonly practiced processes such as solid-state synthesis and ball milling have proven to be reliable routes to prepare TMPs but they generally require high temperature and long reaction time. Here, a recently developed plasma-assisted conversion route for the preparation of TMPs is reviewed, along with their applications in energy conversion and storage, including water oxidation electrocatalysis, sodium-ion batteries, and supercapacitors. The plasma-assisted synthetic route should open up a new avenue to prepare TMPs with tailored structure and morphology for various applications. In fact, the process may be further extended to the synthesis of a wide range of transition-metal compounds such as borides and fluorides at low temperature and in a rapid manner.

HIGHLY REFRACTORY CRUCIBLES OF STABILIZED ZIRCONIA FOR INDUCTION MELTING OF THE PLATINUM GROUP METALS, FABRICATED BY VIBROCASTING

Directory of Open Access Journals (Sweden)

V. V. Primachenko

2012-01-01

Full Text Available As the result of the studies at PJSC « UKRNIIO them. A.S.Berezhnogo» the technology and commercial production of crucibles from stabilized zirconia for the smelting of platinum group metals are develop

A New Ni-Based Metallic Glass with High Thermal Stability and Hardness

Directory of Open Access Journals (Sweden)

Aytekin Hitit

2015-02-01

Full Text Available Glass forming ability (GFA, thermal stability and microhardness of Ni51−xCuxW31.6B17.4 (x = 0, 5 metallic glasses have been investigated. For each alloy, thin sheets of samples having thickness of 20 µm and 100 µm were synthesized by piston and anvil method in a vacuum arc furnace. Also, 400 µm thick samples of the alloys were synthesized by suction casting method. The samples were investigated by X-ray diffractometry (XRD and differential scanning calorimetry (DSC. Crystallization temperature of the base alloy, Ni51W31.6B17.4, is found to be 996 K and 5 at.% copper substitution for nickel increases the crystallization temperature to 1063 K, which is the highest value reported for Ni-based metallic glasses up to the present. In addition, critical casting thickness of alloy Ni51W31.6B17.4 is 100 µm and copper substitution does not have any effect on critical casting thickness of the alloys. Also, microhardness of the alloys are found to be around 1200 Hv, which is one of the highest microhardness values reported for a Ni-based metallic glass until now.

Assessing fly ash treatment: remediation and stabilization of heavy metals.

Science.gov (United States)

Lima, A T; Ottosen, Lisbeth M; Ribeiro, Alexandra B

2012-03-01

Fly ashes from Municipal Solid Waste (MSW), straw (ST) and co-combustion of wood (CW) are here analyzed with the intent of reusing them. Two techniques are assessed, a remediation technique and a solidification/stabilization one. The removal of heavy metals from fly ashes through the electrodialytic process (EDR) has been tried out before. The goal of removing heavy metals has always been the reuse of fly ash, for instance in agricultural fields (BEK). The best removal rates are here summarized and some new results have been added. MSW fly ashes are still too hazardous after treatment to even consider application to the soil. ST ash is the only residue that gets concentrations low enough to be reused, but its fertilizing value might be questioned. An alternative reuse for the three ashes is here preliminary tested, the combination of fly ash with mortar. Fly ashes have been substituted by cement fraction or aggregate fraction. Surprisingly, better compressive strengths were obtained by replacing the aggregate fraction. CW ashes presented promising results for the substitution of aggregate in mortar and possibly in concrete. Copyright © 2010 Elsevier Ltd. All rights reserved.

Assessing fly ash treatment: Remediation and stabilization of heavy metals

KAUST Repository

Lima, A.T.

2010-12-17

Fly ashes from Municipal Solid Waste (MSW), straw (ST) and co-combustion of wood (CW) are here analyzed with the intent of reusing them. Two techniques are assessed, a remediation technique and a solidification/stabilization one. The removal of heavy metals from fly ashes through the electrodialytic process (EDR) has been tried out before. The goal of removing heavy metals has always been the reuse of fly ash, for instance in agricultural fields (BEK). The best removal rates are here summarized and some new results have been added. MSW fly ashes are still too hazardous after treatment to even consider application to the soil. ST ash is the only residue that gets concentrations low enough to be reused, but its fertilizing value might be questioned. An alternative reuse for the three ashes is here preliminary tested, the combination of fly ash with mortar. Fly ashes have been substituted by cement fraction or aggregate fraction. Surprisingly, better compressive strengths were obtained by replacing the aggregate fraction. CW ashes presented promising results for the substitution of aggregate in mortar and possibly in concrete. © 2010 Elsevier Ltd.

Assessing fly ash treatment: Remediation and stabilization of heavy metals

KAUST Repository

Lima, A.T.; Ottosen, Lisbeth M.; Ribeiro, Alexandra B.

2010-01-01

Fly ashes from Municipal Solid Waste (MSW), straw (ST) and co-combustion of wood (CW) are here analyzed with the intent of reusing them. Two techniques are assessed, a remediation technique and a solidification/stabilization one. The removal of heavy metals from fly ashes through the electrodialytic process (EDR) has been tried out before. The goal of removing heavy metals has always been the reuse of fly ash, for instance in agricultural fields (BEK). The best removal rates are here summarized and some new results have been added. MSW fly ashes are still too hazardous after treatment to even consider application to the soil. ST ash is the only residue that gets concentrations low enough to be reused, but its fertilizing value might be questioned. An alternative reuse for the three ashes is here preliminary tested, the combination of fly ash with mortar. Fly ashes have been substituted by cement fraction or aggregate fraction. Surprisingly, better compressive strengths were obtained by replacing the aggregate fraction. CW ashes presented promising results for the substitution of aggregate in mortar and possibly in concrete. © 2010 Elsevier Ltd.

Nb2OsB2, with a new twofold superstructure of the U3Si2 type: Synthesis, crystal chemistry and chemical bonding

International Nuclear Information System (INIS)

Mbarki, Mohammed; Touzani, Rachid St.; Fokwa, Boniface P.T.

2013-01-01

The new ternary metal-rich boride, Nb 2 OsB 2 , was synthesized by arc-melting the elements in a water-cooled copper crucible under an argon atmosphere. The compound was characterized from single-crystal X-ray data and EDX measurements. It crystallizes as a new superstructure (space group P4/mnc, no. 128) of the tetragonal U 3 Si 2 -structure type with lattice parameters a=5.922(1) Å and c=6.879(2) Å. All of the B atoms are involved in B 2 dumbbells with B–B distances of 1.89(4) Å. Structure relaxation using VASP (Vienna ab intio Simulation Package) has confirmed the space group and the lattice parameters. According to electronic structure calculations (TB–LMTO–ASA), the homoatomic B–B interactions are optimized and very strong, but relatively strong heteroatomic Os–B, Nb–B and Nb–Os bonds are also found: These interactions, which together build a three-dimensional network, are mainly responsible for the structural stability of this new phase. The density of state at the Fermi level predicts metallic behavior, as expected, from this metal-rich boride. - Graphical abstract: Nb 2 OsB 2 is, to the best of our knowledge, the first fully characterized phase in the ternary Nb–Os–B system. It crystallizes (space group P4/mnc, 128) with a new twofold superstructure of the U 3 Si 2 structure type (space group P4/mbm, 127), and is therefore the first boride in this structure family crystallizing with a superstructure of the U 3 Si 2 structure type. We show that the distortions leading to this superstructure occurs mainly in the Nb-layer, which tries to accommodate the large osmium atoms. The consequence of this puckering is the building osmium dumbbells instead of chains along [001]. - Highlights: • First compound in the Nb–Os–B system. • New twofold superstructure of U 3 Si 2 structure type. • Puckering of Nb-layer responsible for superstructure occurrence. • Chemical bonding studied by density functional theory

Co3O4 nanoneedle@electroactive nickel boride membrane core/shell arrays: A novel hybrid for enhanced capacity

International Nuclear Information System (INIS)

Li, Tingting; Zhu, Congxu; Yang, Xiaogang; Gao, Yuanhao; He, Weiwei; Yue, Hongwei; Zhao, Hongxiao

2017-01-01

Graphical abstract: Active nickel boride membrane anchored Co 3 O 4 nanoneedle arrays hybrid is synthesized via rapid interface reaction. The optimized core/shell nanostructure demonstrates greatly enhanced electrochemical properties. Display Omitted -- Highlights: •Active nickel boride membrane anchored Co 3 O 4 nanoneedle arrays core-shell hybrid architectures was fabricated via rapid interface reaction. •Specific capacity was improved by synergy between highly active components and optimized electron transfer microstructure. •The assembled asymmetric supercapacitor device exhibited excellent electrochemical performance. -- Abstract: Exploring novel hybrid materials with efficient microstructure using facile approaches is highly urgent in designing supercapacitor electrodes. Here, the Ni-B membrane was used for coating the porous Co 3 O 4 nanoneedle arrays which supported on the nickel foam (NF) frameworks through a rapid chemical reduction process (denoted as NF/Co 3 O 4 @NiB). The Ni-B membrane both provided sufficient active sites for redox reactions and inhibited the aggregation of formed hybrid architectures. Benefiting from the unique structural design and strongly coupled effects between porous Co 3 O 4 arrays and Ni-B membrane, the resulted NF/Co 3 O 4 @NiB electrode exhibited high areal capacitance of 3.47 F cm −2 (0.48 mAh cm −2 ) at a current density of 2.5 mA cm −2 , an excellent rate capability while maintaining 95.5% capacity retention after 2000 cycles. The asymmetric supercapacitor constructed with the NF/Co 3 O 4 @NiB as positive electrode and hierarchical porous carbon (HPC) as negative electrode also showed ideal capacitive behavior, and simultaneously delivered high energy and power densities. The easily decoration of Ni-B membrane on various active nanoarrays may arouse more novel design about hybrid architectures for large-scale applications.

Thermochemical Properties of Group IVB and VB Transition Metal Alloys with Platinum Group Metals: Acid - Stabilization.

Science.gov (United States)

Cima, Michael John

Solid-state galvanic cell measurements and oxide equilibration experiments are used to derive thermochemical quantities for a variety of acid-base stabilized alloys such as Nb-Pd, Nb-Rh, Ti-Pd, and Ti-Rh. The experiments have effectively resulted in the titration of palladium by niobium metal. The excess partial molar Gibbs energy of niobium at infinite dilution was determined to be -62 kcal/mole at 1000^circ C and the Gibbs energy of formation of {rm NbPd}_{3.55} is -42 kcal/mole. These results and those for the other systems are used to assess the importance of crystal field effects in the context of the generalized Lewis acid-base theory.

Boride Formation Induced by pcBN Tool Wear in Friction-Stir-Welded Stainless Steels

Science.gov (United States)

Park, Seung Hwan C.; Sato, Yutaka S.; Kokawa, Hiroyuki; Okamoto, Kazutaka; Hirano, Satoshi; Inagaki, Masahisa

2009-03-01

The wear of polycrystalline cubic boron nitride (pcBN) tool and its effect on second phase formation were investigated in stainless steel friction-stir (FS) welds. The nitrogen content and the flow stress were analyzed in these welds to examine pcBN tool wear. The nitrogen content in stir zone (SZ) was found to be higher in the austenitic stainless steel FS welds than in the ferritic and duplex stainless steel welds. The flow stress of austenitic stainless steels was almost 1.5 times larger than that of ferritic and duplex stainless steels. These results suggest that the higher flow stress causes the severe tool wear in austenitic stainless steels, which results in greater nitrogen pickup in austenitic stainless steel FS welds. From the microstructural observation, a possibility was suggested that Cr-rich borides with a crystallographic structure of Cr2B and Cr5B3 formed through the reaction between the increased boron and nitrogen and the matrix during FS welding (FSW).

Balancing the Hydrogen Evolution Reaction, Surface Energetics, and Stability of Metallic MoS2 Nanosheets via Covalent Functionalization.

Science.gov (United States)

Benson, Eric E; Zhang, Hanyu; Schuman, Samuel A; Nanayakkara, Sanjini U; Bronstein, Noah D; Ferrere, Suzanne; Blackburn, Jeffrey L; Miller, Elisa M

2018-01-10

We modify the fundamental electronic properties of metallic (1T phase) nanosheets of molybdenum disulfide (MoS 2 ) through covalent chemical functionalization, and thereby directly influence the kinetics of the hydrogen evolution reaction (HER), surface energetics, and stability. Chemically exfoliated, metallic MoS 2 nanosheets are functionalized with organic phenyl rings containing electron donating or withdrawing groups. We find that MoS 2 functionalized with the most electron donating functional group (p-(CH 3 CH 2 ) 2 NPh-MoS 2 ) is the most efficient catalyst for HER in this series, with initial activity that is slightly worse compared to the pristine metallic phase of MoS 2 . The p-(CH 3 CH 2 ) 2 NPh-MoS 2 is more stable than unfunctionalized metallic MoS 2 and outperforms unfunctionalized metallic MoS 2 for continuous H 2 evolution within 10 min under the same conditions. With regards to the entire studied series, the overpotential and Tafel slope for catalytic HER are both directly correlated with the electron donating strength of the functional group. The results are consistent with a mechanism involving ground-state electron donation or withdrawal to/from the MoS 2 nanosheets, which modifies the electron transfer kinetics and catalytic activity of the MoS 2 nanosheet. The functional groups preserve the metallic nature of the MoS 2 nanosheets, inhibiting conversion to the thermodynamically stable semiconducting state (2H) when mildly annealed in a nitrogen atmosphere. We propose that the electron density and, therefore, reactivity of the MoS 2 nanosheets are controlled by the attached functional groups. Functionalizing nanosheets of MoS 2 and other transition metal dichalcogenides provides a synthetic chemical route for controlling the electronic properties and stability within the traditionally thermally unstable metallic state.

The low-lying quartet electronic states of group 14 diatomic borides XB (X = C, Si, Ge, Sn, Pb)

Science.gov (United States)

Pontes, Marcelo A. P.; de Oliveira, Marcos H.; Fernandes, Gabriel F. S.; Da Motta Neto, Joaquim D.; Ferrão, Luiz F. A.; Machado, Francisco B. C.

2018-04-01

The present work focuses in the characterization of the low-lying quartet electronic and spin-orbit states of diatomic borides XB, in which X is an element of group 14 (C, Si, Ge, Sn, PB). The wavefunction was obtained at the CASSCF/MRCI level with a quintuple-ζ quality basis set. Scalar relativistic effects were also taken into account. A systematic and comparative analysis of the spectroscopic properties for the title molecular series was carried out, showing that the (1)4Π→X4Σ- transition band is expected to be measurable by emission spectroscopy to the GeB, SnB and PbB molecules, as already observed for the lighter CB and SiB species.

Electrolyte Chemistry for Simultaneous Stabilization of Potassium Metal and Superoxide in K-O₂ Batteries.

Science.gov (United States)

Xiao, Neng; Gourdin, Gerald; Wu, Yiying

2018-05-22

In the superoxide batteries based on O2/O2- redox chemistry, identifying an electrolyte to stabilize both alkali metal and superoxide remains challenging due to their reactivity towards electrolyte components. Bis(fluorosulfonyl)imide (FSI-) has been recognized as a "magical anion" for passivating alkali metals. Herein, we illustrate the chemical reactions between FSI- and superoxide, and the resultant dilemma when considering an anode-compatible electrolyte vs. a cathode-compatible one in K-O2 batteries. On one side, the KFSI-dimethoxyethane (DME) electrolyte passivates the potassium metal anode via the cleavage of S-F bond and formation of a KF-rich solid electrolyte interface (SEI). Nevertheless, the KFSI salt is chemically unstable due to the nucleophilic attack by superoxide and/or hydroxide species. On the other hand, potassium bis(trifluorosulfonyl)imide (KTFSI) is stable for KO2, but results in mossy deposition and irreversible plating and stripping. In order to circumvent this dilemma, we develop an artificial SEI for K metal anode to achieve long cycle-life K-O2 batteries. This work contributes to the understanding of electrolyte chemistry and guides the development of stable electrolytes and artificial SEI in metal-O2 batteries. © 2018 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Probing the superconducting ground state of the rare-earth ternary boride superconductors R RuB2 (R = Lu,Y) using muon-spin rotation and relaxation

Science.gov (United States)

Barker, J. A. T.; Singh, R. P.; Hillier, A. D.; Paul, D. McK.

2018-03-01

The superconductivity in the rare-earth transition-metal ternary borides R RuB2 (where R =Lu and Y) has been investigated using muon-spin rotation and relaxation. Measurements made in zero field suggest that time-reversal symmetry is preserved upon entering the superconducting state in both materials; a small difference in depolarization is observed above and below the superconducting transition in both compounds, however, this has been attributed to quasistatic magnetic fluctuations. Transverse-field measurements of the flux-line lattice indicate that the superconductivity in both materials is fully gapped, with a conventional s -wave pairing symmetry and BCS-like magnitudes for the zero-temperature gap energies. The electronic properties of the charge carriers in the superconducting state have been calculated, with effective masses m*/me=9.8 ±0.1 and 15.0 ±0.1 in the Lu and Y compounds, respectively, with superconducting carrier densities ns=(2.73 ±0.04 ) ×1028m-3 and (2.17 ±0.02 ) ×1028m-3 . The materials have been classified according to the Uemura scheme for superconductivity, with values for Tc/TF of 1 /(414 ±6 ) and 1 /(304 ±3 ) , implying that the superconductivity may not be entirely conventional in nature.

Feasibility of biochar manufactured from organic wastes on the stabilization of heavy metals in a metal smelter contaminated soil.

Science.gov (United States)

Abdelhafez, Ahmed A; Li, Jianhua; Abbas, Mohamed H H

2014-12-01

The main objectives of the current study were to evaluate the potential effects of biochar derived from sugar cane bagasse (SC-BC) and orange peel (OP-BC) on improving the physicochemical properties of a metal smelter contaminated soil, and determining its potentiality for stabilizing Pb and As in soil. To achieve these goals, biochar was produced in a small-scale biochar producing plant, and an incubation experiment was conducted using a silt loam metal-contaminated soil treated with different application rates of biochar (0-10% w/w). The obtained results showed that, the addition of SC-BC and OP-BC increased significantly the soil aggregate stability, water-holding capacity, cation exchange capacity, organic matter and N-status in soil. SC-BC considerably decreased the solubility of Pb to values lower than the toxic regulatory level of the toxicity characteristics leaching procedure extraction (5 mg L(-1)). The rise in soil pH caused by biochar application, and the increase of soil organic matter transformed the labile Pb into less available fractions i.e. "Fe-Mn oxides" and "organic" bound fractions. On the other hand, As was desorbed from Fe-Mn oxides, which resulted in greater mobility of As in the treated soil. We concluded that SC-BC and OP-BC could be used successfully for remediating soils highly contaminated with Pb. However, considerable attention should be paid when using it in soil contaminated with As. Copyright © 2014 Elsevier Ltd. All rights reserved.

Cesium adsorption ability and stability of metal hexacyanoferrate irradiated with gamma-rays

International Nuclear Information System (INIS)

Arisaka, Makoto; Watanabe, Masayuki; Ishizaki, Manabu; Kurihara, Masato; Chen, Rongzhi; Tanaka, Hisashi

2013-01-01

The influence of irradiation with gamma-rays to metal hexacyanoferrate (MHCF: M = Fe, Cu or Ni), which is known as an adsorbent for selective adsorption of cesium (Cs) ion in solution, on Cs adsorption ability and stability was investigated in HNO 3 solutions. Under the adsorbed dose conditions (50 - 300 kGy), it was found that the MHCF is fully stable although the radiolytic decomposition of MHCF was slightly observed with an increase of the total adsorbed dose, which was confirmed by an increment of Fe, Cu or Ni concentration in HNO 3 solution after the irradiation. The weight percent of the metal in the solution to initial weight of MHCF was less than unity. Moreover, no change in composition of carbon, hydrogen and nitrogen in MHCF was observed. On the other hand, the distribution coefficients of Cs to the irradiated MHCF were independent of the total adsorbed dose. This indicates that the Cs adsorption ability was maintained under gamma-ray irradiation. (author)

Stabilization of molten salt materials using metal chlorides for solar thermal storage.

Science.gov (United States)

Dunlop, T O; Jarvis, D J; Voice, W E; Sullivan, J H

2018-05-29

The effect of a variety of metal-chlorides additions on the melting behavior and thermal stability of commercially available salts was investigated. Ternary salts comprised of KNO 3, NaNO 2, and NaNO 3 were produced with additions of a variety of chlorides (KCl, LiCl, CaCl 2 , ZnCl 2 , NaCl and MgCl 2 ). Thermogravimetric analysis and weight loss experiments showed that the quaternary salt containing a 5 wt% addition of LiCl and KCl led to an increase in short term thermal stability compared to the ternary control salts. These additions allowed the salts to remain stable up to a temperature of 630 °C. Long term weight loss experiments showed an upper stability increase of 50 °C. A 5 wt% LiCl addition resulted in a weight loss of only 25% after 30 hours in comparison to a 61% loss for control ternary salts. Calorimetry showed that LiCl additions allow partial melting at 80 °C, in comparison to the 142 °C of ternary salts. This drop in melting point, combined with increased stability, provided a molten working range increase of almost 100 °C in total, in comparison to the control ternary salts. XRD analysis showed the oxidation effect of decomposing salts and the additional phase created with LiCl additions to allow melting point changes to occur.

STABILITY OF BETACYANIN PIGMENTS FROM RED PURPLE PITAYA FRUIT (Hylocereus polyrhizus : INFLUENCE OF PH, TEMPERATURE, METAL IONS AND ASCORBIC ACID

Directory of Open Access Journals (Sweden)

Tang, C.S Tang, C.S

2010-06-01

Full Text Available Betacyanin pigments from red-purple pitaya fruit (Hylocereus polyrhizus could be an attractive source of red colourant for food application. This paper presents results on the extraction of betacyanin pigments from pitaya fruits grown locally in Malaysia. Both the flesh of the fruit and its mesocarp were investigated and it was found that the flesh had higher pigment contents compared to its peel component. The concentration of betacyanins expressed as betanin equivalents per 100 g of flesh and peel were 10.1 ± 0.6 mg and 6.7 ± 0.2 mg, respectively when 80% methanol was used.  The stability of betacyanin pigments were investigated at different pH, temperature and in presence of different concentrations of metal ions (Cu2+ and Fe2+ and ascorbic acid. The results showed that the pigment was most stable at pH range between 5 and 6. However, it forfeited its stability to the heat induced at elevated temperatures. Metal ions (Cu2+ and Fe2+ proved to be capable of accelerating betacyanin degradation, with Cu2+ exhibiting the greatest effect. By contrast, supplementation with ascorbic acid could enhance the pigment stability against the detrimental effects caused by pH, temperature and metal ions. Nevertheless, if the concentration of ascorbic acid exceeds 0.7 %, it may change its role from pigment stabilizer to become a pro-oxidant.    Keywords: Betacyanin, pigments, pitaya fruit, Hylocereus polyrhizus, ascorbic acid

Stabilization of metals in acidic mine spoil with amendments and red fescue (Festuca rubra L.) growth.

Science.gov (United States)

Simon, László

2005-12-01

Stabilization of metals with amendments and red fescue (Festuca rubra, cv. Keszthelyi 2) growth was studied on an acidic and phytotoxic mine spoil (pH(KCl) 3.20-3.26; Cd 7.1 mg kg(-1), Cu 120 mg kg(-1), Pb 2154 mg kg(-1) and Zn 605 mg kg(-1)) from Gyöngyösoroszi, Hungary in a pot experiment. Raising the pH above 5.0 by lime (CaCO(3)), and supplementing with 40 mg kg(-1)nitrogen (NH(4)NO(3)) made this material suitable for plant growth. All cultures were limed with 0.5% (m/m) CaCO(3) (treatment 1), which was combined with 5% (m/m) municipal sewage sludge compost (treatment 2), 5% (m/m) peat (treatment 3), 7.5% (m/m) natural zeolite (clinoptilolite) (treatment 4), and 0.5 (m/m) KH(2)PO(4) (treatment 5). Treatments 1-5 were combined with each other (treatment 6). After 60 days of red fescue growth, pH of the limed mine spoil decreased in all cultures units. Application of peat caused the highest pH decrease (1.15), while decrease of pH was less than 0.23 in treatments 2, 5 or 6. Application of lime significantly reduced concentrations of metals in the 'plant available' fraction of mine spoil compared to non-limed mine spoil. Amendments added to limed mine spoil changed variously the ratio of Cd, Cu, Pb and Zn in exchangeable or 'plant available' fractions, differently influencing the phytoavailability of these metals. Most of the metals were captured in the roots of test plants. Treatment 2 caused the appearance of less Cd in shoots (spoil, however the application of 0.5 phosphate was less favourable. Liming, application of amendments and growth of red fescue can stabilize metals in acidic and phytotoxic mine spoil, and by phytostabilization they can reduce the risk of metal contamination of the food chain.

Stabilization and reuse of heavy metal contaminated soils by means of quicklime sulfate salt treatment. Final report, September 1992--February 1995

International Nuclear Information System (INIS)

Dermatas, D.

1995-08-01

Capillary and hydraulic flows of water in porous media contaminated by heavy metal species often result in severe aquifer contamination. In the present study a chemical admixture stabilization approach is proposed, where heavy metal stabilization/immobilization is achieved by means of quicklime-based treatment. Both in-situ treatment by injection and on-site stabilization by excavation, mixing, and compaction will be investigated. In addition, the potential to reuse the resulting stabilized material as readily available construction material will also be investigated. The heavy metals under study include: arsenic, chromium, lead, and mercury. The proposed technical approach consists of three separate phases. During phase A, both artificial and naturally occurring contaminated soil mixes were treated, and then tested for stress-strain properties, leachability, micromorphology, mineralogical composition, permeability, setting time, and durability. In such a way, the effectiveness of the proposed remediation technology was verified, the treatment approach was optimized, and the underlying mechanisms responsible for stabilization were established. During phase B, the proposed technology will be tested for two DOE-site subscale systems, involving naturally occurring contaminated soil, using the same testing methodology as the one outlined for phase A. Provided that the proposed technology is proven effective for the subscale systems, a field application will be demonstrated. Again process quality monitoring will be performed by testing undisturbed samples collected from the treated sites, in the same fashion as for the previous phases. Following completion of the proposed study, a set of comprehensive guidelines for field applications will be developed. 42 refs., 196 figs., 26 tabs

Experimental and computational study on the phase stability of Al-containing cubic transition metal nitrides

International Nuclear Information System (INIS)

Rovere, Florian; Mayrhofer, Paul H; Music, Denis; Ershov, Sergey; Baben, Moritz to; Schneider, Jochen M; Fuss, Hans-Gerd

2010-01-01

The phase stability of Al-containing cubic transition metal (TM) nitrides, where Al substitutes for TM (i.e. TM 1-x Al x N), is studied as a function of the TM valence electron concentration (VEC). X-ray diffraction and thermal analyses data of magnetron sputtered Ti 1-x Al x N, V 1-x Al x N and Cr 1-x Al x N films indicate increasing phase stability of cubic TM 1-x Al x N at larger Al contents and higher temperatures with increasing TM VEC. These experimental findings can be understood based on first principle investigations of ternary cubic TM 1-x Al x N with TM = Sc, Ti, V, Cr, Y, Zr and Nb where the TM VEC and the lattice strain are systematically varied. However, our experimental data indicate that, in addition to the decomposition energetics (cubic TM 1-x Al x N → cubic TMN + hexagonal AlN), future stability models have to include nitrogen release as one of the mechanisms that critically determine the overall phase stability of TM 1-x Al x N.

Role of an anatomically contoured plate and metal block for balanced stability between the implant and lateral hinge in open-wedge high-tibial osteotomy.

Science.gov (United States)

Jang, Young Woong; Lim, DoHyung; Seo, Hansol; Lee, Myung Chul; Lee, O-Sung; Lee, Yong Seuk

2018-07-01

Open-wedge high tibial osteotomy (OWHTO) is a well-established surgical option for medial compartment osteoarthritis of the varus knee. The initial strength of the fixation plate is critical for successful correction maintenance and healing of the osteotomy site. This study was conducted to verify if a newly designed anatomical plate (LCfit) improves the stability of both the medial implant and lateral hinge area, as well as to evaluate how the metal block contributes to both medial and lateral stability. A finite element (FE) tibial model was combined with TomoFix plate, a LCfit plate with and without a metal block. Data analysis was conducted to evaluate the balanced stability, which refers to the enforced lateral stability resulting from redistribution of overall stress. We assessed the balanced stability of the medial implant and lateral hinge area in three cases using the same Sawbones and loads using the tibia FE model. The LCfit plate reduced stress by 23.1% at the lateral hinge compared to the TomoFix plate (TomoFix vs. LCfit: 34.2 ± 23.3 MPa vs. 26.3 ± 17.5 MPa). The LCfit plate with a metal block reduced stress by 40.1% at the medial plate (210.1 ± 64.2 MPa vs. 125.8 ± 65.7 MPa) and by 31.2% (26.3 ± 17.5 MPa vs. 18.1 ± 12.1 MPa) at the lateral hinge area compared to the reduction using the LCfit plate without a metal block. The newly designed fixation system for OWHTO balanced the overall stress distribution and reduced stress at the lateral hinge area compared to that using a conventional fixation system. The addition of the metal block showed additional benefits for balanced stability between the medial implant and lateral hinge area. However, this conclusion could only be drawn using the FE model in this study. Therefore, further clinical studies are necessary to reveal the clinical effect of reduced lateral stress on the occurrence of the lateral hinge fracture and the biologic effect of the metal block on the

Mononuclear Clusterfullerene Single-Molecule Magnet Containing Strained Fused-Pentagons Stabilized by a Nearly Linear Metal Cyanide Cluster

DEFF Research Database (Denmark)

Liu, Fupin; Wang, Song; Gao, Cong Li

2017-01-01

Fused-pentagons results in an increase of local steric strain according to the isolated pentagon rule (IPR), and for all reported non-IPR clusterfullerenes multiple (two or three) metals are required to stabilize the strained fused-pentagons, making it difficult to access the single-atom properti...... (SMM)....

Effects of Grain Boundary Microconstituents on Heat-Affected Zone Cracks in a Mar-M004 Weldment

Directory of Open Access Journals (Sweden)

Tai-Cheng Chen

2018-03-01

Full Text Available Repair-welding of a cast Mar-M004 superalloy by gas tungsten arc welding was performed. Liquation cracks of the heat-affected zone (HAZ in a Mar-M004 weldment were closely related to the presence of low-melting constituents along the solidified boundaries in the weld. The metal carbides (MC, M3B2 and M5B3 borides, Ni7(Hf,Zr2 intermetallic compounds, and γ-γ′colonies were found at the interdendritic boundaries. Fine boride precipitates mixed with intermetallic compounds in lamellar form were more likely to liquate during repair-welding. The melting of borides and intermetallic compounds in 1180 °C/4 h treated samples confirmed the poor weldability of the Mar-M004 superalloy due to enhanced liquation cracking. In addition to boride formation, fractographs of liquation cracks revealed strong segregation of B element in carbides and intermetallics, which might further lower the solidus temperature of the repair weld.

Thermal stability and magnetocaloric properties of GdDyAlCo bulk metallic glasses

Energy Technology Data Exchange (ETDEWEB)

Liang, L. [State Key Laboratory for Advanced Metals and Materials, University of Science and Technology Beijing, Beijing 100083 (China); Hui, X. [State Key Laboratory for Advanced Metals and Materials, University of Science and Technology Beijing, Beijing 100083 (China)], E-mail: huixd01@hotmail.com; Chen, G.L. [State Key Laboratory for Advanced Metals and Materials, University of Science and Technology Beijing, Beijing 100083 (China)

2008-01-25

Gd{sub 56-x}Dy{sub x}Al{sub 24}Co{sub 20} (x = 16, 20 and 22) bulk metallic glasses (BMGs) alloys with a diameter of 2, 3 and 3 mm, respectively, were prepared by using copper mold casting. These alloys exhibit higher values of the glass transition temperature, crystallization temperature, and activation energy of the glass transition and crystallization, compared with those of other known rare-earth-based BMGs. A maximum magnetic entropy changes of 15.78 J/(kg K) is obtained in Gd{sub 40}Dy{sub 16}Al{sub 24}Co{sub 20}, which is the maximal among all the bulk metallic glasses, and is much larger than those of the known crystalline magnetic refrigerant compound Gd{sub 5}Si{sub 2}Ge{sub 1.9}Fe{sub 0.1} and pure Gd metal. All the three BMG alloys have a broader temperature range of the entropy change peak, resulting in larger refrigerate capacities (RC) than those of conventional crystalline materials. The excellent magnetocaloric properties combining with high thermal stability make them an attractive candidate for magnetic refrigerants in the temperature range of 20-100 K.

Formation and stability of Pb-, Zn- and Cu-PO4 phases at low temperatures: Implications for heavy metal fixation in polar environments

International Nuclear Information System (INIS)

White, Duanne A.; Hafsteinsdóttir, Erla G.; Gore, Damian B.; Thorogood, Gordon; Stark, Scott C.

2012-01-01

Low temperatures and frequent soil freeze–thaw in polar environments present challenges for the immobilisation of metals. To address these challenges we investigated the chemical forms of Pb, Zn and Cu in an Antarctic landfill, examined in vitro reaction kinetics of these metals and orthophosphate at 2 and 22 °C for up to 185 days, and subjected the products to freeze–thaw. Reaction products at both temperatures were similar, but the rate of production varied, with Cu-PO 4 phases forming faster, and the Zn- and Pb-PO 4 phases slower at 2 °C. All metal-orthophosphate phases produced were stable during a 2.5 h freeze–thaw cycle to −30 °C. Metal immobilisation using orthophosphate can be successful in polar regions, but treatments will need to consider differing mineral stabilities and reaction rates at low temperatures. - Highlights: ► We identify Cu, Pb and Zn species in an Antarctic Landfill. ► We identify the products and rates of reactions between metals and PO 4 3− at 2 and 22 °C. ► We test the stability of metal-orthophosphate species during freeze–thaw. ► We conclude that orthophosphate may immobilize metals in freezing ground. - Pb, Cu and Zn react with PO 4 3− at low temperatures (2 °C) to form low solubility metal-PO 4 phases at rates that may enable the in-situ remediation of metal contaminated soils in polar areas.

State equations and stability of shock wave fronts in homogeneous and heterogeneous metallic medium

International Nuclear Information System (INIS)

Romain, Jean-Pierre

1977-01-01

This research thesis in physical sciences reports a theoretical and experimental study of some mechanical and thermodynamic aspects related to a shock wave propagation in homogeneous and heterogeneous metallic media: state equations, stability and instability of shock wave fronts. In the first part, the author reports the study of the Grueneisen coefficient for some metallic elements with known static and dynamic compression properties. The second part reports the experimental investigation of dynamic compressibility of some materials (lamellar Al-Cu compounds). The front shock wave propagation has been visualised, and experimental Hugoniot curves are compared with those deduced from a developed numeric model and other models. The bismuth Hugoniot curve is also determined, and the author compares the existence and nature of phase transitions obtained by static and dynamic compression

Effects of Tungsten Addition on the Microstructure and Corrosion Resistance of Fe-3.5B Alloy in Liquid Zinc

Directory of Open Access Journals (Sweden)

Xin Liu

2017-04-01

Full Text Available The effects of tungsten addition on the microstructure and corrosion resistance of Fe-3.5B alloys in a liquid zinc bath at 520 °C were investigated by means of scanning electron microscopy, X-ray diffraction and electron probe micro-analysis. The microstructure evolution in different alloys is analyzed and discussed using an extrapolated Fe-B-W ternary phase diagram. Experimental results show that there are three kinds of borides, the reticular (Fe, W2B, the rod-like (Fe, W3B and flower-like FeWB. The addition of tungsten can refine the microstructure and improve the stability of the reticular borides. Besides, it is beneficial to the formation of the metastable (Fe, W3B phase. The resultant Fe-3.5B-11W (wt % alloy possesses excellent corrosion resistance to liquid zinc. When tungsten content exceeds 11 wt %, the formed flower-like FeWB phase destroys the integrity of the reticular borides and results in the deterioration of the corrosion resistance. Also, the corrosion failure resulting from the spalling of borides due to the initiation of micro-cracks in the grain boundary of borides is discussed in this paper.

Metallic and insulating 3d transition-element monoxides and their stability

International Nuclear Information System (INIS)

Johansson, H.B.

1977-01-01

The binding properties of the 3d monoxides are studied in detail, and it is shown that the metallic character of TiO and VO is directly reflected in their heat of formation. The same holds true for NbO. From a stability analysis of the 3d monoxides versus decomposition, it is found that TiO, VO, and FeO are close to an instability. Further, it can be concluded that both ScO and CrO must be very near existence. The general occurrence of transition-metal monoxides is shown to be directly correlated with ionic properties of the transition elements. An investigation of the absorption edge in the 3d monoxides is also undertaken. The importance of the crystal-field splitting is noticed, and it is shown that the heat of formation of the monoxides can be used to derive the crystal-field parameter Δ. The change from a delocalized to a localized behavior of the d electrons in the 3d monoxides is compared with a similar change of the f electrons in the actinides. Some similarities between these two series of materials are pointed out

A Simple Approach to Enhance the Water Stability of a Metal-Organic Framework.

Science.gov (United States)

Shih, Yung-Han; Kuo, Yu-Ching; Lirio, Stephen; Wang, Kun-Yun; Lin, Chia-Her; Huang, Hsi-Ya

2017-01-01

A facile method to improve the feasibility of water-unstable metal-organic frameworks in an aqueous environment has been developed that involves imbedding in a polymer monolith. The effect of compartment type during polymerization plays a significant role in maintaining the crystalline structure and thermal stability of the MOFs, which was confirmed by powder X-ray diffraction (PXRD) and thermogravimetric analysis (TGA), respectively. The MOF-polymer composite prepared in a narrow compartment (column, ID 0.8 mm) has better thermal and chemical stability than that prepared in a broad compartment (vial, ID 7 mm). The developed MOF-polymer composite was applied as an adsorbent in solid-phase microextraction of nine non-steroidal anti-inflammatory drugs (NSAIDs) and could be used for extraction more than 30 times, demonstrating that the proposed approach has potential for industrial applications. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Metal–Organic Frameworks Stabilize Mono(phosphine)–Metal Complexes for Broad-Scope Catalytic Reactions

Energy Technology Data Exchange (ETDEWEB)

Sawano, Takahiro; Lin, Zekai; Boures, Dean; An, Bing; Wang, Cheng; Lin, Wenbin (UC); (Xiamen)

2016-08-10

Mono(phosphine)–M (M–PR3; M = Rh and Ir) complexes selectively prepared by postsynthetic metalation of a porous triarylphosphine-based metal–organic framework (MOF) exhibited excellent activity in the hydrosilylation of ketones and alkenes, the hydrogenation of alkenes, and the C–H borylation of arenes. The recyclable and reusable MOF catalysts significantly outperformed their homogeneous counterparts, presumably via stabilizing M–PR3 intermediates by preventing deleterious disproportionation reactions/ligand exchanges in the catalytic cycles.

Thermal Shock Resistance of Stabilized Zirconia/Metal Coat on Polymer Matrix Composites by Thermal Spraying Process

Science.gov (United States)

Zhu, Ling; Huang, Wenzhi; Cheng, Haifeng; Cao, Xueqiang

2014-12-01

Stabilized zirconia/metal coating systems were deposited on the polymer matrix composites by a combined thermal spray process. Effects of the thicknesses of metal layers and ceramic layer on thermal shock resistance of the coating systems were investigated. According to the results of thermal shock lifetime, the coating system consisting of 20 μm Zn and 125 μm 8YSZ exhibited the best thermal shock resistance. Based on microstructure evolution, failure modes and failure mechanism of the coating systems were proposed. The main failure modes were the formation of vertical cracks and delamination in the outlayer of substrate, and the appearance of coating spallation. The residual stress, thermal stress and oxidation of substrate near the substrate/metal layer interface were responsible for coating failure, while the oxidation of substrate near the substrate/coating interface was the dominant one.

Improved description of metal oxide stability

DEFF Research Database (Denmark)

Jauho, Thomas Stenbæk; Olsen, Thomas; Bligaard, Thomas

2015-01-01

The renormalized adiabatic PBE (rAPBE) method has recently been shown to comprise a significant improvement over the random phase approximation (RPA) for total energy calculations of simple solids and molecules. Here we consider the formation energies of 19 group I and II metal oxides and a few...... transition-metal oxides. The mean absolute error relative to experiments is 0.21 eV and 0.38 eV per oxygen atom for rAPBE and RPA, respectively, and thus the rAPBE method greatly improves the description of metal-oxygen bonds across a wide range of oxides. The failure of the RPA can be partly attributed...... to the lack of error cancellation between the correlation energy of the oxide on the one hand and the bulk metal and oxygen molecule on the other hand, which are all separately predicted much too negative by the RPA. We ascribe the improved performance of the rAPBE to its significantly better description...

Stabilization/solidification of battery debris ampersand lead impacted material at Schuylkill Metals, Plant City, Florida

International Nuclear Information System (INIS)

Anguiano, T.; Floyd, D.

1997-01-01

The Schuylkill Metals facility in Plant City Florida (SMPCI) operated as a battery recycling facility for approximately 13 years. During its operation, the facility disposed of battery components in surrounding wetland areas. In March of 1991 the U.S. EPA and SMPCI entered into a Consent Decree for the remediation of the SMPCI site using stabilization/solidification and on-site disposal. In November of 1994, ENTACT began remediation at the facility and to date has successfully stabilized/solidified over 228,000 tons of lead impacted battery components and lead impacted material. The ENTACT process reduces the size of the material to be treated to ensure that complete mixing of the phosphate/cement additive is achieved thereby promoting the chemical reactions of stabilization and solidification. ENTACT has met the following performance criteria for treated material at the SMPCI site: (1) Hydraulic Conductivity less than 1x10 -6 cm/s, (2) Unconfined Compressive Strength greater than 50 psi, (3) Lead, Cadmium, Arsenic, Chromium TCLP Leachability below hazardous levels

Wettability of hot-pressed samples of boron-containing aluminium compounds by liquid metals and alloys

International Nuclear Information System (INIS)

Kharlamov, A.I.; Nizhenko, V.I.; Kirillova, N.V.; Floka, L.I.

2000-01-01

Highly dispersed powders of aluminium borides and borocarbides were sintered by hot pressing method. Temperature dependence of wettability of hot-pressed boride samples (α-AlB 12 and AlB 18 ) and aluminium borocarbides (Al 3 B 48 C 2 , Al 8 B 4 C 2 and AlB 24 C) by liquid aluminium, copper, germanium, silicon and melts Al + 25 wt.%Si and Cu + (3-6) wt.%Ti was studied. Dependence of a compound wettability on the ratio of components in it was analyzed [ru

Tunable field emission characteristics of ZnO nanowires coated with varied thickness of lanthanum boride thin films

International Nuclear Information System (INIS)

Zhao, C.X.; Li, Y.F.; Chen, Jun; Deng, S.Z.; Xu, N.S.

2013-01-01

Lanthanum boride (LaB x ) thin films with various thicknesses were deposited on ZnO nanowire arrays by electron beam evaporation. Field emission characteristics of ZnO nanowires show close dependence on LaB x coating thickness. The turn-on field increases with increasing LaB x coating thickness from 10 nm to 50 nm. The observed phenomena were explained by a model that the tunneling at ZnO/LaB x interface dominates the emission process. - Highlights: ► Coating thickness dependence of field emission characteristics of ZnO nanowires was observed from LaB x coated ZnO nanowires. ► More stable field emission was observed from ZnO nanowires with LaB x coating. ► A model was proposed that the tunneling at ZnO/LaB x interface dominates the emission process

Photovoltaic cell

Science.gov (United States)

Gordon, Roy G.; Kurtz, Sarah

1984-11-27

In a photovoltaic cell structure containing a visibly transparent, electrically conductive first layer of metal oxide, and a light-absorbing semiconductive photovoltaic second layer, the improvement comprising a thin layer of transition metal nitride, carbide or boride interposed between said first and second layers.

Introduction of Molecular Building Blocks to Improve the Stability of Metal-Organic Frameworks for Efficient Mercury Removal.

Science.gov (United States)

Jiang, Shu-Yi; He, Wen-Wen; Li, Shun-Li; Su, Zhong-Min; Lan, Ya-Qian

2018-05-08

With expanding human needs, many heavy metals were mined, smelted, processed, and manufactured for commercialization, which caused serious environmental pollutions. Currently, many adsorption materials are applied in the field of adsorption of heavy metals. Among them, the principle of many mercury adsorbents is based on the interaction between mercury and sulfur. Here, a S-containing metal-organic framework NENU-400 was synthesized for effective mercury extraction. Unfortunately, the skeleton of NENU-400 collapsed easily when exposed to the mercury liquid solution. To improve the stability, a synthetic strategy installing molecular building blocks (MBBs) into the channels was used. Modified by the MBBs, a more stable nanoporous framework was synthesized, which not only exhibits a high capacity of saturation mercury uptake but also shows high selectivity and efficient recyclability.

Stability of the composites: NiAl - cellular high-melting point metal

International Nuclear Information System (INIS)

Belomyttsev, M.Yu.; Kozlov, D.A.

2006-01-01

For sintered composite materials (CM) NiAl-W and NiAl-W-Mo the structure and mechanical properties are studied. A comparative analysis of the effect of hot deformation by compression at 1000-1300 Deg C on the integrity of microsamples themselves and tungsten shells of NiAl granules in CM with a cellular structure is accomplished. Local chemical composition of a NiAl/refractory metal interface in CM with cellular structure and free of it is determined. A CM structural state effect on compression yield strength at 1000 Deg C is estimated. The treatment is proposed which permits approaching cellular structured CM oxidation resistance at 1000-1100 Deg C to the level of heat stability of unalloyed NiAl or its alloy with Hf [ru

Crystallization behaviour and thermal stability of two aluminium-based metallic glass powder materials

Energy Technology Data Exchange (ETDEWEB)

Li, X.P.; Yan, M. [University of Queensland, School of Mechanical and Mining Engineering, ARC Centre of Excellence for Design in Light Metals, Brisbane, QLD 4072 (Australia); Yang, B.J. [Shenyang National Laboratory for Materials Science, Institute of Metal Research, Chinese Academy of Sciences, Shenyang 110016 (China); Wang, J.Q., E-mail: jqwang@imr.ac.cn [Shenyang National Laboratory for Materials Science, Institute of Metal Research, Chinese Academy of Sciences, Shenyang 110016 (China); Schaffer, G.B. [University of Queensland, School of Mechanical and Mining Engineering, ARC Centre of Excellence for Design in Light Metals, Brisbane, QLD 4072 (Australia); Qian, M., E-mail: ma.qian@uq.edu.au [University of Queensland, School of Mechanical and Mining Engineering, ARC Centre of Excellence for Design in Light Metals, Brisbane, QLD 4072 (Australia)

2011-12-15

Highlights: Black-Right-Pointing-Pointer The crystallization paths and products of Al{sub 86}Ni{sub 7}Y{sub 4.5}Co{sub 1}La{sub 1.5} powder have been identified. Black-Right-Pointing-Pointer The thermal stability of Al{sub 86}Ni{sub 7}Y{sub 4.5}Co{sub 1}La{sub 1.5} powder has been assessed. Black-Right-Pointing-Pointer The Al{sub 86}Ni{sub 7}Y{sub 4.5}Co{sub 1}La{sub 1.5} powder shows a wide processing window of 75 K. Black-Right-Pointing-Pointer The powder has the potential to be consolidated into thick BMG components based on the findings. Black-Right-Pointing-Pointer The Al{sub 85}Ni{sub 5}Y{sub 6}Co{sub 2}Fe{sub 2} powder shows similar characteristics but inferior thermal stability. - Abstract: The crystallization behaviour and thermal stability of two Al-based metallic glass powder materials, Al{sub 85}Ni{sub 5}Y{sub 6}Co{sub 2}Fe{sub 2} and Al{sub 86}Ni{sub 6}Y{sub 4.5}Co{sub 2}La{sub 1.5}, have been investigated using differential scanning calorimetry (DSC), X-ray diffraction (XRD) and electron microscopy. Both alloy powders show a distinct three-stage crystallization process with a similar gap of {approx}75 K between the onset crystallization temperature (T{sub x}) and the second crystallization temperature. Crystallization occurs by the precipitation and growth of fcc-Al, without intermetallic formation. The apparent activation energy for each stage of crystallization was determined from DSC analyses and the phases resulting from each crystallization stage were identified by XRD and electron microscopy. The critical cooling rate for each alloy powder was calculated from the DSC data. These results are necessary to inform the consolidation of amorphous powder particles of Al{sub 85}Ni{sub 5}Y{sub 6}Co{sub 2}Fe{sub 2} or Al{sub 86}Ni{sub 6}Y{sub 4.5}Co{sub 2}La{sub 1.5} into thick (>1 mm) metallic glass components.

Wetting and interface interactions in the B4C/Al-Me (Me=Cu, Sn) systems

International Nuclear Information System (INIS)

Aizenshtein, M.; Froumin, N.; Dariel, M.P.; Frage, N.

2008-01-01

The wettability of B 4 C in contact with non-carbide and non-boride forming liquid metals (such as Cu or Sn) has been the subject of several studies. These metals do not wet boron carbide unless a reactive element is added to the melt. The present study is concerned with the addition of Al which completes the series of reactive elements added to the non-wetting metals. While Si represents the elements that form stable carbides and Ti represents the elements that form stable borides, Al belongs to the group of elements that form ternary borocarbides. The wetting experiments in the B 4 C/(Me-Al, Me=Cu, Sn) systems have shown that a ternary product, namely Al 8 B 4 C 7 was formed at the interface and that wetting is governed by the thermodynamic properties of the binary liquid system

Acquisition of Co metal from spent lithium-ion battery using emulsion liquid membrane technology and emulsion stability test

Science.gov (United States)

Yuliusman; Wulandari, P. T.; Amiliana, R. A.; Huda, M.; Kusumadewi, F. A.

2018-03-01

Lithium-ion batteries are the most common type to be used as energy source in mobile phone. The amount of lithium-ion battery wastes is approximated by 200 – 500 ton/year. In one lithium-ion battery, there are 5 – 20% of cobalt metal, depend on the manufacturer. One of the way to recover a valuable metal from waste is leaching process then continued with extraction, which is the aim of this study. Spent lithium-ion batteries will be characterized with EDX and AAS, the result will show the amount of cobalt metal with form of LiCoO2 in the cathode. Hydrochloric acid concentration used is 4 M, temperature 80°C, and reaction time 1 hour. This study will discuss the emulsion stability test on emulsion liquid membrane. The purpose of emulsion stability test in this study was to determine optimum concentration of surfactant and extractant to produce a stable emulsion. Surfactant and extractant used were SPAN 80 and Cyanex 272 respectively with both concentrations varied. Membrane and feed phase ratios used in this experiment was 1 : 2. The optimum results of this study were SPAN 80 concentrations of 10% w/v and Cyanex 272 0.7 M.

Thermal stability of hexagonal OsB{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Xie, Zhilin [Department of Mechanical and Aerospace Engineering, University of Central Florida, Orlando, FL 32816 (United States); Blair, Richard G. [Department of Mechanical and Aerospace Engineering, University of Central Florida, Orlando, FL 32816 (United States); Department of Physics, University of Central Florida, Orlando, FL 32816 (United States); Orlovskaya, Nina, E-mail: Nina.Orlovskaya@ucf.edu [Department of Mechanical and Aerospace Engineering, University of Central Florida, Orlando, FL 32816 (United States); Cullen, David A. [Materials Science and Technology Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831 (United States); Andrew Payzant, E. [Center for Nanophase Materials Sciences, Oak Ridge National Laboratory, Oak Ridge, TN 37831 (United States)

2014-11-15

The synthesis of novel hexagonal ReB{sub 2}-type OsB{sub 2} ceramic powder was performed by high energy ball milling of elemental Os and B powders. Two different sources of B powder have been used for this mechanochemical synthesis. One B powder consisted of a mixture of amorphous and crystalline phases and a mixture of {sup 10}B and {sup 11}B isotopes with a fine particle size, while another B powder was a purely crystalline (rhombohedral) material consisting of enriched {sup 11}B isotope with coarse particle size. The same Os powder was used for the synthesis in both cases. It was established that, in the first case, the hexagonal OsB{sub 2} phase was the main product of synthesis with a small quantity of Os{sub 2}B{sub 3} phase present after synthesis as an intermediate product. In the second case, where coarse crystalline {sup 11}B powder was used as a raw material, only Os{sub 2}B{sub 3} boride was synthesized mechanochemically. The thermal stability of hexagonal OsB{sub 2} powder was studied by heating under argon up to 876 °C and cooling in vacuo down to −225 °C. During the heating, the sacrificial reaction 2OsB{sub 2}+3O{sub 2}→2Os+2B{sub 2}O{sub 3} took place due to presence of O{sub 2}/water vapor molecules in the heating chamber, resulting in the oxidation of B atoms and formation of B{sub 2}O{sub 3} and precipitation of Os metal out of the OsB{sub 2} lattice. As a result of such phase changes during heating, the lattice parameters of hexagonal OsB{sub 2} changed significantly. The shrinkage of the a lattice parameter was recorded in 276–426 °C temperature range upon heating, which was attributed to the removal of B atoms from the OsB{sub 2} lattice due to oxidation followed by the precipitation of Os atoms and formation of Os metal. While significant structural changes occurred upon heating due to presence of O{sub 2}, the hexagonal OsB{sub 2} ceramic demonstrated good phase stability upon cooling in vacuo with linear shrinkage of the lattice

Isothermal sections of phase equilibria diagrams for systems (terbium, dysprosium, holmium)-molybdenum-boron at 1273 K

International Nuclear Information System (INIS)

Kuz'ma, Yu.B.; Zakharchuk, N.P.; Maksimova, L.T.

1988-01-01

The methods of X-ray analysis are used to study the R-Mo-B (R-Tb, Dy, Ho) systems and isothermal sections of phase equilibria diagrams at 1273 K are plotted. A formation of RMoB 4 (structure of the YCrB 4 type) is confirmed and borides R 3 MoB 7 (structure of the Er 3 CrB 7 type) and ∼ RMo 4 B 8 (of the unknown structure) are obtained for the first time. Borides DyMoB 3 and HoMoB 3 are of the ErMoB 3 structure. Lattice periods of new compounds are indicated. Diffractogrammes of borides Dy 3 MoB 7 and DyMoB 3 are calculated. A peculiarity of components interaction in the systems rare-earth metal-molybdenum-boron is considered

Trace Metals in Groundwater and the Vadose Zone Calcite: In Situ Containment and Stabilization of Strontium-90 and Other Divalent Metals and Radionuclides at Arid West DOE

International Nuclear Information System (INIS)

Smith, Robert W.

2004-01-01

Radionuclide and metal contaminants such as strontium-90 are present beneath U.S. Department of Energy (DOE) lands in both the groundwater (e.g., 100-N area at Hanford, WA) and vadose zone (e.g., Idaho Nuclear Technology and Engineering Center at the Idaho National Engineering and Environmental Laboratory). In situ containment and stabilization of these contaminants is a cost-effective treatment strategy. However, implementing in situ containment and stabilization approaches requires definition of the mechanisms that control contaminant sequestration. We are investigating the in situ immobilization of radionuclides or contaminant metals (e.g., strontium-90) by their facilitated co-precipitation with calcium carbonate in groundwater and vadose zone systems. Our facilitated approach, shown schematically in Figure 1, relies upon the hydrolysis of introduced urea to cause the acceleration of calcium carbonate precipitation (and trace metal co-precipitation) by increasing pH and alkalinity. Subsurface urea hydrolysis is catalyzed by the urease enzyme, which may be either introduced with the urea or produced in situ by ubiquitous subsurface urea hydrolyzing microorganisms. Because the precipitation process tends to be irreversible and many western aquifers are saturated with respect to calcite, the co-precipitated metals and radionuclides will be effectively removed from the aqueous phase over the long-term. Another advantage of the ureolysis approach is that the ammonium ions produced by the reaction can exchange with radionuclides sorbed to subsurface minerals, thereby enhancing the availability of the radionuclides for re-capture in a more stable solid phase (co-precipitation rather than adsorption)

Structural Stability and Performance of Noble Metal-Free SnO2-Based Gas Sensors

Directory of Open Access Journals (Sweden)

Antonio Tricoli

2012-05-01

Full Text Available The structural stability of pure SnO2 nanoparticles and highly sensitive SnO2-SiO2 nanocomposites (0–15 SiO2 wt% has been investigated for conditions relevant to their utilization as chemoresistive gas sensors. Thermal stabilization by SiO2 co-synthesis has been investigated at up to 600 °C determining regimes of crystal size stability as a function of SiO2-content. For operation up to 400 °C, thermally stable crystal sizes of ca. 24 and 11 nm were identified for SnO2 nanoparticles and 1.4 wt% SnO2-SiO2 nanocomposites, respectively. The effect of crystal growth during operation (TO = 320 °C on the sensor response to ethanol has been reported, revealing possible long-term destabilization mechanisms. In particular, crystal growth and sintering-neck formation were discussed with respect to their potential to change the sensor response and calibration. Furthermore, the effect of SiO2 cosynthesis on the cross-sensitivity to humidity of these noble metal-free SnO2-based gas sensors was assessed.

Metal immobilization and phosphorus leaching after stabilization of pyrite ash contaminated soil by phosphate amendments.

Science.gov (United States)

Zupančič, Marija; Lavrič, Simona; Bukovec, Peter

2012-02-01

In this study we would like to show the importance of a holistic approach to evaluation of chemical stabilization using phosphate amendments. An extensive evaluation of metal stabilization in contaminated soil and an evaluation of the leaching of phosphorus induced after treatment were performed. The soil was highly contaminated with Cu (2894 mg kg(-1)), Zn (3884 mg kg(-1)), As (247 mg kg(-1)), Cd (12.6 mg kg(-1)) and Pb (3154 mg kg(-1)). To immobilize the metals, mixtures of soil with phosphate (from H(3)PO(4) and hydroxyapatite (HA) with varying ratios) were prepared with a constant Pb : P molar ratio of 1: 10. The acetic acid extractable concentration of Pb in the mixture with the highest amount of added phosphoric acid (n(H(3)PO(4)) : n(HA) = 3 : 1) was reduced to 1.9% (0.62 mg L(-1)) of the extractable Pb concentration in the untreated soil, but the content of water extractable phosphorus in the samples increased from 0.04 mg L(-1) in the untreated soil sample up to 14.3 mg L(-1) in the same n(H(3)PO(4)) : n(HA) = 3 : 1 mixture. The high increase in arsenic mobility was also observed after phosphate addition. The PBET test showed phosphate induced reduction in Pb bioavailability. In attempting to stabilize Pb in the soil with the minimum treatment-induced leaching of phosphorus, it was found that a mixture of soil with phosphate addition in the molar ratio of H(3)PO(4) : HA of 0.75 : 1 showed the most promising results, with an acetic acid extractable Pb concentration of 1.35 mg L(-1) and a water extractable phosphorus concentration of 1.76 mg L(-1). The time-dependent leaching characteristics of metals and phosphorus for this mixture were evaluated by a column experiment, where irrigation of the soil mixture with the average annual amount of precipitation in Slovenia (1000 mm) was simulated. The phosphorus concentration in the leachates decreased from 2.60 mg L(-1) at the beginning of irrigation to 1.00 mg L(-1) at the end.

Stabilization and solidification of a heavy metal contaminated site soil using a hydroxyapatite based binder

OpenAIRE

Xia, Wei-Yi; Feng, Ya-Song; Jin, Fei; Zhang, Li-Ming; Du, Yan-Jun

2017-01-01

Synthetic hydroxyapatite (HA) is an efficient and environment-friendly material for the remediation of heavy metal contaminated soils. However, the application of conventional HA powder in stabilizing contaminated soils is limited, due to high cost of final products, difficulties in synthesizing purified HA crystals. A new binder named SPC, which composes of single superphosphate (SSP) and calcium oxide (CaO), is presented as an alternative in this study. HA can form in the soil matrix by an ...

Stability and mobility of defect clusters and dislocation loops in metals

DEFF Research Database (Denmark)

Osetsky, Y.N.; Bacon, D.J.; Serra, A.

2000-01-01

has been observed in the computer simulation of small vacancy loops in alpha-Fe. In the present paper we summarise results obtained by molecular dynamics simulations of defect clusters and small dislocation loops in alpha-Fe(bcc) and Cu(fcc). The structure and stability of vacancy and interstitial......According to the production bias model, glissile defect clusters and small dislocation loops play an important role in the microstructural evolution during irradiation under cascade damage conditions. The atomic scale computer simulations carried out in recent years have clarified many questions...... loops are reviewed, and the dynamics of glissile clusters assessed. The relevance and importance of these results in establishing a better understanding of the observed differences in the damage accumulation behaviour between bcc and fee metals irradiated under cascade damage conditions are pointed out...

Nb{sub 2}OsB{sub 2}, with a new twofold superstructure of the U{sub 3}Si{sub 2} type: Synthesis, crystal chemistry and chemical bonding

Energy Technology Data Exchange (ETDEWEB)

Mbarki, Mohammed; Touzani, Rachid St.; Fokwa, Boniface P.T., E-mail: boniface.fokwa@ac.rwth-aachen.de

2013-07-15

The new ternary metal-rich boride, Nb{sub 2}OsB{sub 2}, was synthesized by arc-melting the elements in a water-cooled copper crucible under an argon atmosphere. The compound was characterized from single-crystal X-ray data and EDX measurements. It crystallizes as a new superstructure (space group P4/mnc, no. 128) of the tetragonal U{sub 3}Si{sub 2}-structure type with lattice parameters a=5.922(1) Å and c=6.879(2) Å. All of the B atoms are involved in B{sub 2} dumbbells with B–B distances of 1.89(4) Å. Structure relaxation using VASP (Vienna ab intio Simulation Package) has confirmed the space group and the lattice parameters. According to electronic structure calculations (TB–LMTO–ASA), the homoatomic B–B interactions are optimized and very strong, but relatively strong heteroatomic Os–B, Nb–B and Nb–Os bonds are also found: These interactions, which together build a three-dimensional network, are mainly responsible for the structural stability of this new phase. The density of state at the Fermi level predicts metallic behavior, as expected, from this metal-rich boride. - Graphical abstract: Nb{sub 2}OsB{sub 2} is, to the best of our knowledge, the first fully characterized phase in the ternary Nb–Os–B system. It crystallizes (space group P4/mnc, 128) with a new twofold superstructure of the U{sub 3}Si{sub 2} structure type (space group P4/mbm, 127), and is therefore the first boride in this structure family crystallizing with a superstructure of the U{sub 3}Si{sub 2} structure type. We show that the distortions leading to this superstructure occurs mainly in the Nb-layer, which tries to accommodate the large osmium atoms. The consequence of this puckering is the building osmium dumbbells instead of chains along [001]. - Highlights: • First compound in the Nb–Os–B system. • New twofold superstructure of U{sub 3}Si{sub 2} structure type. • Puckering of Nb-layer responsible for superstructure occurrence. • Chemical bonding studied

Pyrosequencing Based Microbial Community Analysis of Stabilized Mine Soils

Science.gov (United States)

Park, J. E.; Lee, B. T.; Son, A.

2015-12-01

Heavy metals leached from exhausted mines have been causing severe environmental problems in nearby soils and groundwater. Environmental mitigation was performed based on the heavy metal stabilization using Calcite and steel slag in Korea. Since the soil stabilization only temporarily immobilizes the contaminants to soil matrix, the potential risk of re-leaching heavy metal still exists. Therefore the follow-up management of stabilized soils and the corresponding evaluation methods are required to avoid the consequent contamination from the stabilized soils. In this study, microbial community analysis using pyrosequencing was performed for assessing the potential leaching of the stabilized soils. As a result of rarefaction curve and Chao1 and Shannon indices, the stabilized soil has shown lower richness and diversity as compared to non-contaminated negative control. At the phyla level, as the degree of contamination increases, most of phyla decreased with only exception of increased proteobacteria. Among proteobacteria, gamma-proteobacteria increased against the heavy metal contamination. At the species level, Methylobacter tundripaludum of gamma-proteobacteria showed the highest relative portion of microbial community, indicating that methanotrophs may play an important role in either solubilization or immobilization of heavy metals in stabilized soils.

Comparison of Thermodynamic Predictions and Experimental Observations on B Additions in Powder-Processed Ni-Based Superalloys Containing Elevated Concentrations of Nb

Science.gov (United States)

Antonov, Stoichko; Huo, Jiajie; Feng, Qiang; Isheim, Dieter; Seidman, David N.; Sun, Eugene; Tin, Sammy

2018-03-01

Boron additions to Ni-based superalloys are considered to be beneficial to the creep properties of the alloy, as boron has often been reported to increase grain boundary cohesion, increase ductility, and promote the formation of stable boride phases. Despite the importance, it is not well understood whether these improvements are associated with the presence of elemental boron or stable borides along the grain boundaries. In this investigation, two experimental powder-processed Ni-based superalloys containing elevated levels of Nb were found to exhibit increased solubility for B in the γ matrix when compared to similar commercial Ni-based superalloys. This resulted in an overall lower B concentration at grain boundaries that suppressed boride formation. As the predictive capability of CALPHAD database models for Ni-based superalloys have improved over the years, some discrepancies may still persist around compositionally heterogeneous features such as grain boundaries. Improved quantification of the characteristic partitioning of B as a function of the bulk alloy composition is required for understanding and predicting the stability of borides.

Comportamiento parabólico del crecimiento de capas boradas en los aceros Y8A y X12M // Parabolic behavior of boriding layers growth in Y8A and X12M steels

Directory of Open Access Journals (Sweden)

C. Figueroa Hernández

1999-01-01

Full Text Available Se determina la influencia que tienen los principales parámetros tecnológicos del borado en el crecimiento de las capas y secorrobora el cumplimiento de la ley parabólica para predecir este comportamiento en los aceros Y8A y X12M.El proceso de borado se aplica en una mezcla de carburo de silicio y bórax (70 y 30 % a la temperatura de 850, 900 y 950 oCdurante un tiempo de 2, 4 y 6 horas. Como variable dependiente se seleccionó la profundidad del recubrimiento, a partir de lacual se obtuvieron los coeficientes del crecimiento parabólico y la energía de activación en función de la temperatura, el tiempodel proceso y el tipo de acero.La caracterización metalográfica reveló la presencia de la fase Fe2BPalabras claves: Borado, recubrimiento superf icial , t ecnología de recubrimiento.__________________________________________________________________________AbstractIt was determined the influence of the main technological parameters of the boriding process, and a mathematical model thatallows to predict this conduct on the steels Y8A and X12M steels was obtained.The boriding process is applied in a mixture of silicon carbide and borax (70 and 30% at 850, 900 and 950 oC temperatureduring a period of time 2, 4 and 6 hours. As an independent variable the depth of the coat was selected.It was obtained the parabolic growth coefficients, and the activation energy according to temperature, time and the chemicalcomposition of steel.Metallografic analysis reveals the presence of Fe2B phase.Key words: Boriding process, superf icial coat , coat technology.

Effect of nanoparticle metal composition: mono- and bimetallic gold/copper dendrimer stabilized nanoparticles as solvent-free styrene oxidation catalysts

Science.gov (United States)

Blanckenberg, A.; Kotze, G.; Swarts, A. J.; Malgas-Enus, R.

2018-02-01

A range of mono- and bimetallic AumCun nanoparticles (NPs), with varying metal compositions, was prepared by using a third-generation diaminobutane poly(propylene imine) (G3 DAB-PPI) dendrimer, modified with alkyl chains, as a stabilizer. It was found that the length of the peripheral alkyl chain, ( M1 (C15), M2 (C11), and M3 (C5)), had a direct influence on the average nanoparticle size obtained, confirming the importance of the nanoparticle stabilizer during synthesis. The Au NPs showed the highest degree of agglomeration and polydispersity, whereas the Cu NPs were the smallest and most monodisperse of the NPs. The bimetallic NPs sizes were found to vary between those of the monometallic NPs, depending on the metal composition. Interestingly, the bimetallic NPs were found to be the most stable, showing very little variation in size over time, even up to 9 months. The DSNs were evaluated in the catalytic oxidation of styrene, using either H2O2 or TBHP as oxidant. Here, we show that the bimetallic DSNs are indeed the superior catalysts when compared to their monometallic analogues, under the same reaction conditions, since a good compromise between stability and activity can be achieved where the Au provides catalytic activity and the Cu serves as a stabilizer. These AumCun bimetallic DSNs present a less expensive and more stable catalyst with negligible loss of activity, opening the door to green catalysis.

Fabrication of Metallic Hollow Nanoparticles

Science.gov (United States)

Kim, Jae-Woo (Inventor); Choi, Sr., Sang H. (Inventor); Lillehei, Peter T. (Inventor); Chu, Sang-Hyon (Inventor); Park, Yeonjoon (Inventor); King, Glen C. (Inventor); Elliott, James R. (Inventor)

2016-01-01

Metal and semiconductor nanoshells, particularly transition metal nanoshells, are fabricated using dendrimer molecules. Metallic colloids, metallic ions or semiconductors are attached to amine groups on the dendrimer surface in stabilized solution for the surface seeding method and the surface seedless method, respectively. Subsequently, the process is repeated with additional metallic ions or semiconductor, a stabilizer, and NaBH.sub.4 to increase the wall thickness of the metallic or semiconductor lining on the dendrimer surface. Metallic or semiconductor ions are automatically reduced on the metallic or semiconductor nanoparticles causing the formation of hollow metallic or semiconductor nanoparticles. The void size of the formed hollow nanoparticles depends on the dendrimer generation. The thickness of the metallic or semiconductor thin film around the dendrimer depends on the repetition times and the size of initial metallic or semiconductor seeds.

A theoretical study of the structure and stability of borohydride on 3d transition metals

Science.gov (United States)

Arevalo, Ryan Lacdao; Escaño, Mary Clare Sison; Gyenge, Elod; Kasai, Hideaki

2012-12-01

The adsorption of borohydride on 3d transition metals (Cr, Mn, Fe, Co, Ni and Cu) was studied using first principles calculations within spin-polarized density functional theory. Magnetic effect on the stability of borohydride is noted. Molecular adsorption is favorable on Co, Ni and Cu, which is characterized by the strong s-dzz hybridization of the adsorbate-substrate states. Dissociated adsorption structure yielding one or two H adatom fragments on the surface is observed for Cr, Mn and Fe.

Industrial uses of boron compounds

Energy Technology Data Exchange (ETDEWEB)

Pastor, H [Eurotungstene; Thevenot, F

1978-06-01

A review includes a section on the use in the chemical industry of some transition-metal borides as heterogeneous catalysts in the hydrogenation and dehydrogenation of organic compounds and in fuel cells.

The stability boundary of group-III transition metal diboride ScB 2 (0 0 0 1) surfaces

Science.gov (United States)

Zhao, Hui; Qin, Na

2012-01-01

Experimental observations and theoretical investigations exhibit that a group-IV(V) transition metal diboride (0 0 0 1) surface is terminated with a 1 × 1 TM(B) layer. As to a group-III transition metal diboride, we have investigated the stability boundary of ScB2 (0 0 0 1) surfaces using first principles total energy plane-wave pseudopotential method based on density functional theory. The Mulliken charge population analysis shows that Sc atoms in the second layer cannot provide B atoms in the first layer with sufficient electrons to form a complete graphene-like boron layer. We also found that the charge transfer between the first and the second layer for the B-terminated surface is more than that for Sc-terminated surface. It elucidates the reason that the outermost interlayer spacing contract more strongly in the B-terminated surface than in the Sc-terminated surface. The surface energies of both terminated ScB2 (0 0 0 1) surfaces as a function of the chemical potential of B are also calculated to check the relative stability of the two surface structures.

Experimental formation enthalpies for intermetallic phases and other inorganic compounds

Science.gov (United States)

Kim, George; Meschel, S. V.; Nash, Philip; Chen, Wei

2017-01-01

The standard enthalpy of formation of a compound is the energy associated with the reaction to form the compound from its component elements. The standard enthalpy of formation is a fundamental thermodynamic property that determines its phase stability, which can be coupled with other thermodynamic data to calculate phase diagrams. Calorimetry provides the only direct method by which the standard enthalpy of formation is experimentally measured. However, the measurement is often a time and energy intensive process. We present a dataset of enthalpies of formation measured by high-temperature calorimetry. The phases measured in this dataset include intermetallic compounds with transition metal and rare-earth elements, metal borides, metal carbides, and metallic silicides. These measurements were collected from over 50 years of calorimetric experiments. The dataset contains 1,276 entries on experimental enthalpy of formation values and structural information. Most of the entries are for binary compounds but ternary and quaternary compounds are being added as they become available. The dataset also contains predictions of enthalpy of formation from first-principles calculations for comparison. PMID:29064466

SPECIATION AND STABILITY OF METHYLENE BLUE-METAL ...

African Journals Online (AJOL)

a

With thiocyanate, zinc(II), cobalt(II) and copper(II) ions form stable anion, ... For a typical determination of metal ion, a suitable aliquot of the metal ion .... As the various reviews imply, a number of kinetic based analytical methods for photometric.

Etude des mecanismes de formation des microstructures lors du brasage isotherme de superalliages a base de nickel

Science.gov (United States)

Ruiz-Vargas, Jose

This thesis reports theoretical and experimental investigations carried out to understand the mechanisms of microstructure formation during isothermal brazing, produced by brazing Inconel 625 and MC2 nickel-based superalloys with filler metal BNi-2. Firstly, studies were made on pure Ni to interpret microstructure's formation with simplified alloy chemistry. Microstructure formation have been studied when varying time at constant temperature (isothermal kinetics), but also when varying temperature for constant hold time (isochronal kinetics). The chemical composition and crystallography of the present phases have been identified, with the following results : (i) the fraction of dissolved base metal has been found proportional to the initial thickness of the brazing alloy, so that the composition of the liquid remains homogeneous with a precise initial equilibrium composition during the whole brazing process, (ii) the melting of the joint occurs in two steps : at lower temperature, it involves only partially melting, and boron diffusion in pure Ni leads to the precipitation of fine Ni3B borides at the interface ; in a second stage, at higher temperature, melting is complete and thermodynamic equilibrium requires significant dissolution of nickel, which also involves the dissolution of part of borides already formed. Secondly, nickel plating technique was used on Inconel 625 nickel-based superalloy. A thin layer of Ni with varying thickness, has been electrodeposited to observe the gradual dissolution of Inconel and microstructural features formation due to the presence of superalloy alloying elements. It has been observed that the nickel coating does not prevent precipitation in the base metal as boron diffuse rapidly through the coating width. In the intermediate nickel plating width, fragile precipitates of nickel borides have been observed, because the contribution of Inconel alloying elements to the melt was very limited. In absence of nickel plating on the

Metal Hydride Nanoparticles with Ultrahigh Structural Stability and Hydrogen Storage Activity Derived from Microencapsulated Nanoconfinement.

Science.gov (United States)

Zhang, Jiguang; Zhu, Yunfeng; Lin, Huaijun; Liu, Yana; Zhang, Yao; Li, Shenyang; Ma, Zhongliang; Li, Liquan

2017-06-01

Metal hydrides (MHs) have recently been designed for hydrogen sensors, switchable mirrors, rechargeable batteries, and other energy-storage and conversion-related applications. The demands of MHs, particular fast hydrogen absorption/desorption kinetics, have brought their sizes to nanoscale. However, the nanostructured MHs generally suffer from surface passivation and low aggregation-resisting structural stability upon absorption/desorption. This study reports a novel strategy named microencapsulated nanoconfinement to realize local synthesis of nano-MHs, which possess ultrahigh structural stability and superior desorption kinetics. Monodispersed Mg 2 NiH 4 single crystal nanoparticles (NPs) are in situ encapsulated on the surface of graphene sheets (GS) through facile gas-solid reactions. This well-defined MgO coating layer with a thickness of ≈3 nm efficiently separates the NPs from each other to prevent aggregation during hydrogen absorption/desorption cycles, leading to excellent thermal and mechanical stability. More interestingly, the MgO layer shows superior gas-selective permeability to prevent further oxidation of Mg 2 NiH 4 meanwhile accessible for hydrogen absorption/desorption. As a result, an extremely low activation energy (31.2 kJ mol -1 ) for the dehydrogenation reaction is achieved. This study provides alternative insights into designing nanosized MHs with both excellent hydrogen storage activity and thermal/mechanical stability exempting surface modification by agents. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Mass spectrometric production of heterogeneous metal clusters using Knudsen cell

Directory of Open Access Journals (Sweden)

Veljković Filip M.

2016-01-01

Full Text Available Knudsen effusion mass spectrometry or high-temperature method of mass spectrometry for decades gives new information about saturated vapor of hardly volatile compounds and it is an important method in the discovery of many new molecules, radicals, ions and clusters present in the gas phase. Since pioneering works until now, this method has been successfully applied to a large number of systems (ores, oxides, ceramics, glass materials, borides, carbides, sulfides, nitrates, metals, fullerenes, etc which led to the establishment of various research branches such as chemistry of clusters. This paper describes the basic principles of Knudsen cell use for both identification of chemical species created in the process of evaporation and determination of their ionization energies. Depending on detected ions intensities and the partial pressure of each gaseous component, as well as on changes in partial pressure with temperature, Knudsen cell mass spectrometry enables the determination of thermodynamic parameters of the tested system. A special attention is paid to its application in the field of small heterogeneous and homogeneous clusters of alkali metals. Furthermore, experimental results for thermodynamic parameters of some clusters, as well as capabilities of non-standard ways of using Knudsen cells in the process of synthesis of new clusters are presented herein. [Projekat Ministarstva nauke Republike Srbije, br. 172019

Stabilization of heavy metals in fired clay brick incorporated with wastewater treatment plant sludge: Leaching analysis

Science.gov (United States)

Kadir, A. A.; Hassan, M. I. H.; Salim, N. S. A.; Sarani, N. A.; Ahmad, S.; Rahmat, N. A. I.

2018-04-01

Wastewater treatment sludge or known as sewage sludge is regarded as the residue and produced by the sedimentation of the suspended solid during treatment at the wastewater treatment plant. As such, this sludge was gained from the separation process of the liquids and solids. This sludge wastes has becomes national issues in recent years due to the increasing amount caused by population and industrialization growth in Malaysia. This research was conducted to fully utilize the sludge that rich in dangerous heavy metals and at the same time act as low cost alternative materials in brick manufacturing. The investigation includes determination of heavy metal concentration and chemical composition of the sludge, physical and mechanical properties. Wastewater treatment sludge samples were collected from wastewater treatment plant located in Johor, Malaysia. X-Ray Fluorescence was conducted to determine the heavy metals concentration of wastewater treatment sludge. Different percentage of sludges which are 0%, 1%, 5%, 10%, and 20%, has been incorporated into fired clay brick. The leachability of heavy metals in fired clay brick that incorporated with sludge were determined by using Toxicity Characteristic Leaching Procedure (TCLP) and Synthetic Precipitation Leachability Procedure (SPLP) that has been analyzed by using Inductively Coupled Plasma Mass Spectrometry (ICP-MS). The results show a possibility to stabilize the heavy metals in fired clay brick incorporated with wastewater treatment sludge. 20% of the sludge incorporated into the brick is the most suitable for building materials as it leached less heavy metals concentration and complying with USEPA standard.

Thermal Stabilization FY 1999 blend plan

Energy Technology Data Exchange (ETDEWEB)

RISENMAY, H.R.

1999-02-23

This Blend Plan documents the alternate feed material items for the thermal stabilization process that will be used in place of the metal items that were originally planned to be processed. Problems with resolution of the safety basis for the metal items resulted in the decision to run material that already had an established safety basis. Various in process and scrap recovery items stored in gloveboxes, plutonium oxide and plutonium oxide mixed with uranium oxide stored in 2736-Z vaults will be processed through the stabilization furnaces until the safety basis for the metal items has been resolved. The purpose of thermal stabilization is to heat the material to 1000 degrees Celsius to drive off all volatile materials and leave the plutonium and/or uranium as oxides. The stabilized material will be sampled to determine the Loss On Ignition (LOI). The stabilized material must meet LOI of less than 0.5% to be acceptable for storage under DOE-STD-3013-94 specifications. Out of specification material will be recycled through the furnaces until the LOI limits are met.

Thermal Stabilization FY 1999 blend plan

International Nuclear Information System (INIS)

RISENMAY, H.R.

1999-01-01

This Blend Plan documents the alternate feed material items for the thermal stabilization process that will be used in place of the metal items that were originally planned to be processed. Problems with resolution of the safety basis for the metal items resulted in the decision to run material that already had an established safety basis. Various in process and scrap recovery items stored in gloveboxes, plutonium oxide and plutonium oxide mixed with uranium oxide stored in 2736-Z vaults will be processed through the stabilization furnaces until the safety basis for the metal items has been resolved. The purpose of thermal stabilization is to heat the material to 1000 degrees Celsius to drive off all volatile materials and leave the plutonium and/or uranium as oxides. The stabilized material will be sampled to determine the Loss On Ignition (LOI). The stabilized material must meet LOI of less than 0.5% to be acceptable for storage under DOE-STD-3013-94 specifications. Out of specification material will be recycled through the furnaces until the LOI limits are met

Thermal stabilization FY 1999 blend plan

International Nuclear Information System (INIS)

RISENMAY, H.R.

1999-01-01

This Blend Plan documents the alternate feed material items for the thermal stabilization process that will be used in place of the metal items that were originally planned to be processed. Problems with resolution of the safety basis for the metal items resulted in the decision to run material that already had an established safety basis. Various in process and scrap recovery items stored in gloveboxes, plutonium oxide and plutonium oxide mixed with uranium oxide stored in 2736-2 vaults will be processed through the stabilization furnaces until the safety basis for the metal items has been resolved. The purpose of thermal stabilization is to heat the material to 1000 degrees Celsius to drive off all volatile materials and leave the plutonium and/or uranium as oxides. The stabilized material will be sampled to determine the Loss On Ignition (LOI). The stabilized material must meet LOI of less than 0.5% to be acceptable for storage under DOE-STD-3013-94 specifications. Out of specification material will be recycled through the furnaces until the LOI limits are met

Thermal stabilization FY 1999 blend plan

Energy Technology Data Exchange (ETDEWEB)

RISENMAY, H.R.

1999-06-01

This Blend Plan documents the alternate feed material items for the thermal stabilization process that will be used in place of the metal items that were originally planned to be processed. Problems with resolution of the safety basis for the metal items resulted in the decision to run material that already had an established safety basis. Various in process and scrap recovery items stored in gloveboxes, plutonium oxide and plutonium oxide mixed with uranium oxide stored in 2736-2 vaults will be processed through the stabilization furnaces until the safety basis for the metal items has been resolved. The purpose of thermal stabilization is to heat the material to 1000 degrees Celsius to drive off all volatile materials and leave the plutonium and/or uranium as oxides. The stabilized material will be sampled to determine the Loss On Ignition (LOI). The stabilized material must meet LOI of less than 0.5% to be acceptable for storage under DOE-STD-3013-94 specifications. Out of specification material will be recycled through the furnaces until the LOI limits are met.

Boosting catalytic activity of metal nanoparticles for 4-nitrophenol reduction: Modification of metal naoparticles with poly(diallyldimethylammonium chloride)

Energy Technology Data Exchange (ETDEWEB)

You, Jyun-Guo; Shanmugam, Chandirasekar [Department of Chemistry, National Sun Yat-sen University, Taiwan (China); Liu, Yao-Wen; Yu, Cheng-Ju [Department of Applied Physics and Chemistry, University of Taipei, Taiwan (China); Tseng, Wei-Lung, E-mail: tsengwl@mail.nsysu.edu.tw [Department of Chemistry, National Sun Yat-sen University, Taiwan (China); School of Pharmacy, College of Pharmacy, Kaohsiung Medical University, Taiwan (China); Center for Nanoscience and Nanotechnology, National Sun Yat-sen University, Taiwan (China)

2017-02-15

Highlights: • The choice of capping ligand determines catalytic activity of metal nanocatalysts. • PDDA-capped metal nanoparticles electrostatically interact with 4-NP and BH4{sup −}. • PDDA-capped metal nanoparticles have good recyclability and large scalability. • PDDA-capped Pd nanoparticles show the highest rate constant and activity parameter. - Abstract: Most of the previously reported studies have focused on the change in the size, morphology, and composition of metal nanocatalysts for improving their catalytic activity. Herein, we report poly(diallyldimethylammonium chloride) [PDDA]-stabilized nanoparticles (NPs) of platinum (Pt) and palladium (Pd) as highly active and efficient catalysts for hydrogenation of 4-nitrophenol (4-NP) in the presence of NaBH4. PDDA-stabilized Pt and Pd NPs possessed similar particle size and same facet with citrate-capped Pt and Pd NPs, making this study to investigate the inter-relationship between catalytic activity and surface ligand without the consideration of the effects of particle size and facet. Compared to citrate-capped Pt and Pd NPs, PDDA-stabilized Pt and Pd NPs exhibited excellent pH and salt stability. PDDA could serve as an electron acceptor for metal NPs to produce the net positive charges on the metal surface, which provide strong electrostatic attraction with negatively charged nitrophenolate and borohydride ions. The activity parameter and rate constant of PDDA-stabilized metal NPs were higher than those of citrate-capped metal NPs. Compared to the previously reported Pd nanomaterials for the catalysis of NaBH4-mediated reduction of 4-NP, PDDA-stabilized Pd NPs exhibited the extremely high activity parameter (195 s{sup −1} g{sup −1}) and provided excellent scalability and reusability.

Fluidized-bed-combustion ash for the solidification and stabilization of a metal-hydroxide sludge.

Science.gov (United States)

Knoll, K L; Behr-Andres, C

1998-01-01

Fluidized-bed-combustion (FBC) ash is a by-product from a developing technology for coal-fired power plants that will economically reduce air emissions to meet requirements of the Clean Air Act. FBC ash has physical and chemical properties similar to Portland cement, but only has moderate success as a pozzolan in concrete applications due to low compressive strengths. However, FBC ash has proven effective for use as a binder for the solidification and stabilization (S/S) of metal-bearing sludges. Physical and chemical characterization procedures were used to analyze FBC ash and a metal-bearing sludge obtained from a hazardous waste treatment facility to develop 12 different S/S mix designs. The mix designs consist of four binder designs to evaluate sludge-to-binder ratios of approximately 0, 0.5, and 1. Portland cement is used as a control binder to compare unconfined compressive strengths and Toxicity Characteristic Leaching Procedure (TCLP) analyses from different ratios of the FBC ash streams: fly ash, char, and spent bed material (SBM). Compressive strengths ranging from 84 lbs per square inch (psi) to 298 psi were obtained from various mix designs containing different sludge-to-ash ratios cured for 28 days. All the mix designs passed the TCLP. Recoveries from leaching for each metal were less than 5% for most mix designs. Results of unconfined compressive strengths, TCLP, and percent recovery calculations indicate that the mix design containing approximately a 1:1 ratio of fly ash to char-and-sludge is the best mix design for the S/S of the metal-bearing sludge.

Devoluming and stabilizing method for end piece

International Nuclear Information System (INIS)

Ikeda, Satoshi; Shiotsuki, Msao; Kawamura, Shigeyoshi; Komatsu, Fumiaki.

1991-01-01

As a first method, end pieces and other radioactive metal wastes are filled as a mixture in a vessel, and preliminary compression is conducted. Then, the bulk density of the radioactive metal wastes is reduced and gaps in the end pieces are filled with radioactive metal wastes. If they are applied with heat treatment under high pressure in this state together with the vessel, they are devolumed and stabilized without damaging the vessel. As a second method, metal powders are mixed and filled in the vessel together with the end pieces. The gaps in the end pieces are filled with the metal powders and if they are applied with heat treatment under high pressure in this state together with the vessel, the end pieces are devolumed and stabilized without damaging the vessel in the same manner. This can devolume and stabilize the end pieces separated from nuclear fuel assemblies easily and safely. (T.M.)

Transition metal carbide and boride abrasive particles

International Nuclear Information System (INIS)

Valdsaar, H.

1978-01-01

Abrasive particles and their preparation are discussed. The particles consist essentially of a matrix of titanium carbide and zirconium carbide, at least partially in solid solution form, and grains of crystalline titanium diboride dispersed throughout the carbide matrix. These abrasive particles are particularly useful as components of grinding wheels for abrading steel. 1 figure, 6 tables

Co-treatment of flotation waste, neutralization sludge, and arsenic-containing gypsum sludge from copper smelting: solidification/stabilization of arsenic and heavy metals with minimal cement clinker.

Science.gov (United States)

Liu, De-Gang; Min, Xiao-Bo; Ke, Yong; Chai, Li-Yuan; Liang, Yan-Jie; Li, Yuan-Cheng; Yao, Li-Wei; Wang, Zhong-Bing

2018-03-01

Flotation waste of copper slag (FWCS), neutralization sludge (NS), and arsenic-containing gypsum sludge (GS), both of which are difficult to dispose of, are major solid wastes produced by the copper smelting. This study focused on the co-treatment of FWCS, NS, and GS for solidification/stabilization of arsenic and heavy metals with minimal cement clinker. Firstly, the preparation parameters of binder composed of FWCS, NS, and cement clinker were optimized to be FWCS dosage of 40%, NS dosage of 10%, cement clinker dosage of 50%, mill time of 1.5 h, and water-to-binder ratio of 0.25. On these conditions, the unconfined compressive strength (UCS) of the binder reached 43.24 MPa after hydration of 28 days. Then, the binder was used to solidify/stabilize the As-containing GS. When the mass ratio of binder-to-GS was 5:5, the UCS of matrix can reach 11.06 MPa after hydration of 28 days, meeting the required UCS level of MU10 brick in China. Moreover, arsenic and other heavy metals in FWCS, NS, and GS were effectively solidified or stabilized. The heavy metal concentrations in leachate were much lower than those in the limits of China standard leaching test (CSLT). Therefore, the matrices were potential to be used as bricks in some constructions. XRD analysis shows that the main hydration products of the matrix were portlandite and calcium silicate hydrate. These hydration products may play a significant role in the stabilization/solidification of arsenic and heavy metals.

Electrode stabilizing materials

Science.gov (United States)

Amine, Khalil; Abouimrane, Ali; Moore, Jeffrey S.; Odom, Susan A.

2015-11-03

An electrolyte includes a polar aprotic solvent; an alkali metal salt; and an electrode stabilizing compound that is a monomer, which when polymerized forms an electrically conductive polymer. The electrode stabilizing compound is a thiophene, a imidazole, a anilines, a benzene, a azulene, a carbazole, or a thiol. Electrochemical devices may incorporate such electrolytes.

Cu-TiB metal matrix composites prepared by powder metallurgy route

Directory of Open Access Journals (Sweden)

Guo Z.

2015-01-01

Full Text Available Titanium boride (TiB is characterized by good conductivity, high strength and high melting point. In this work, TiB was used to make Cu-TiB metal matrix composites (MMCs. Amounts of TiB added into Cu matrix were 2wt.%, 5wt.%, 10 wt.% and 15 wt.%. The samples were pressed at pressures of 500MPa, 600MPa, 700MPa and 800MPa and sintered at 820o and 920o, respectively. The properties of the sintered composites such as hardness and impact toughness were studied. Hardness and impact toughness of samples increased with increasing pressures and decreased with increasing contents of TiB. Composite with good mechanical properties and high conductivity was obtained from the sample containing 2wt.%TiB compacted at 800MPa and sintered at 920o. It was shown that 2wt.% TiB is a suitable content to make Cu-TiB MMCs with good mechanical properties and excellent conductivity.

Stabilizing effect of epoxidized sunflower oil as a secondary stabilizer for Ca/Hg stabilized PVC

Directory of Open Access Journals (Sweden)

2008-01-01

Full Text Available Unsaturated triglyceride oil sunflower was epoxidized and characterized by chemical and spectroscopic methods. Epoxidized sunflower oil (ESO was used as an organic thermal co-stabilizer for rigid poly(vinyl chloride (PVC in the presence of tricalcium dicitrate (Ca3(C6H5O72 and mercury (II acetate (Hg(CH3COO2. The thermo-oxidative degradation of PVC was studied in the presence of these ternary stabilizer systems at 170, 180, 190 and 200°C in N2 atmosphere. The effects of metal carboxylate combination Ca/Hg in the absence and in the presence of epoxidized sunflower oil on static heat treatment of PVC have been studied. The formation of polyene sequences was investigated by UV-visible and FT-IR spectroscopy and by comparing viscosity data obtained in the presence and in the absence of the additives. It was found that the additives retard the rate of degradation and reduce the extent of polymer chain scission associated with the thermal degradation of poly(vinyl chloride. Synergistic effects were found when stabilizer was blended in 50:50 weight ratios with either. It was found that ESO exerted a stabilizing effect on the degradation of PVC. The activation energy for degraded PVC in absence of stabilizers was 38.6 kJ•mol–1 and in the presence of Ca/Hg and Ca/Hg/ESO were 53.3 and 64.7 kJ•mol–1 respectively. In order of compare the efficiency of the epoxidized sunflower oil with these metal soap stabilizers, thermal stabilities were evaluated on the basis of evolved hydrogen chloride determined by conductometry technique and degree of discoloration are discussed.

Influence of Al addition on the thermal stability and mechanical properties of Fe76.5-xCu1Si13.5b9Alx amorphous alloys

Directory of Open Access Journals (Sweden)

Sun Y.Y.

2012-01-01

Full Text Available This paper fabricated Fe76.5-xCu1Si13.5B9Alx (x=0,1,2,3,5,7 at.% amorphous ribbons using singleroller melt-spinning method. The effect of Al content on the thermal stability and mechanical properties was investigated. The results indicated that Al addition have little effect on the amorphous formation ability of the alloys. On the other hand, increasing the Al content can substantially increase Tx2, which corresponds to the crystallization of Fe borides. Nanoindentation tests indicated that hardness of the alloys increase slightly with increasing the Al content, and Young’s modulus has a complicated relationship with the Al content.

Isolated Pt Atoms Stabilized by Amorphous Tungstenic Acid for Metal-Support Synergistic Oxygen Activation.

Science.gov (United States)

Zhang, Qian; Qin, Xixi; Duanmu, Fanpeng; Ji, Huiming; Shen, Zhurui; Han, Xiaopeng; Hu, Wenbin

2018-06-05

Oxygen activation plays a crucial role in many important chemical reactions such as organics oxidation and oxygen reduction. For developing highly active materials for oxygen activation, herein, we report an atomically dispersed Pt on WO3 nanoplates stabilized by in-situ formed amorphous H2WO4 out-layer and the mechanism for activating molecular oxygen. Experimental and theoretical studies demonstrate that the isolated Pt atoms coordinated with oxygen atoms from [WO6] and water of H2WO4, consequently leading to optimized surface electronic configuration and strong metal support interaction (SMSI). In exemplified reactions of butanone oxidation sensing and oxygen reduction, the atomic Pt/WO3 hybrid exhibits superior activity than those of Pt nanoclusters/WO3 and bare WO3 as well as enhanced long-term durability. This work will provide insight on the origin of activity and stability for atomically dispersed materials, thus promoting the development of highly efficient and durable single atom-based catalysts. © 2018 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Phase stability of transition metals and alloys

International Nuclear Information System (INIS)

Hixson, R.S.; Schiferl, D.; Wills, J.M.; Hill, M.A.

1997-01-01

This is the final report of a three-year, Laboratory-Directed Research and Development (LDRD) project at the Los Alamos National Laboratory (LANL). This project was focused on resolving unexplained differences in calculated and measured phase transition pressures in transition metals. Part of the approach was to do new, higher accuracy calculations of transmission pressures for group 4B and group 6B metals. Theory indicates that the transition pressures for these baseline metals should change if alloyed with a d-electron donor metal, and calculations done using the Local Density Approximation (LDA) and the Virtual Crystal Approximation (VCA) indicate that this is true. Alloy systems were calculated for Ti, Zr and Hf based alloys with various solute concentrations. The second part of the program was to do new Diamond Anvil Cell (DAC) measurements to experimentally verify calculational results. Alloys were prepared for these systems with grain size suitable for Diamond Anvil Cell experiments. Experiments were done on pure Ti as well as Ti-V and Ti-Ta alloys. Measuring unambiguous transition pressures for these systems proved difficult, but a new technique developed yielded good results

Corrosion resistant composite materials

International Nuclear Information System (INIS)

Ul'yanin, E.A.

1986-01-01

Foundations for corrosion-resistant composite materials design are considered with account of components compatibility. Fibrous and lamellar composites with metal matrix, dispersion-hardened steels and alloys, refractory metal carbides-, borides-, nitrides-, silicides-based composites are described. Cermet compositions and fields of their application, such as protective coatings for operation in agressive media at high temperatures, are presented

Prelithiation of silicon-carbon nanotube anodes for lithium ion batteries by stabilized lithium metal powder (SLMP).

Science.gov (United States)

Forney, Michael W; Ganter, Matthew J; Staub, Jason W; Ridgley, Richard D; Landi, Brian J

2013-09-11

Stabilized lithium metal powder (SLMP) has been applied during battery assembly to effectively prelithiate high capacity (1500-2500 mAh/g) silicon-carbon nanotube (Si-CNT) anodes, eliminating the 20-40% first cycle irreversible capacity loss. Pressure-activation of SLMP is shown to enhance prelithiation and enable capacity matching between Si-CNT anodes and lithium nickel cobalt aluminum oxide (NCA) cathodes in full batteries with minimal added mass. The prelithiation approach enables high energy density NCA/Si-CNT batteries achieving >1000 cycles at 20% depth-of-discharge.

Rice Husk Ash to Stabilize Heavy Metals Contained in Municipal Solid Waste Incineration Fly Ash: First Results by Applying New Pre-treatment Technology

Directory of Open Access Journals (Sweden)

Laura Benassi

2015-10-01

Full Text Available A new technology was recently developed for municipal solid waste incineration (MSWI fly ash stabilization, based on the employment of all waste and byproduct materials. In particular, the proposed method is based on the use of amorphous silica contained in rice husk ash (RHA, an agricultural byproduct material (COSMOS-RICE project. The obtained final inert can be applied in several applications to produce “green composites”. In this work, for the first time, a process for pre-treatment of rice husk, before its use in the stabilization of heavy metals, based on the employment of Instant Pressure Drop technology (DIC was tested. The aim of this work is to verify the influence of the pre-treatment on the efficiency on heavy metals stabilization in the COSMOS-RICE technology. DIC technique is based on a thermomechanical effect induced by an abrupt transition from high steam pressure to a vacuum, to produce changes in the material. Two different DIC pre-treatments were selected and thermal annealing at different temperatures were performed on rice husk. The resulting RHAs were employed to obtain COSMOS-RICE samples, and the stabilization procedure was tested on the MSWI fly ash. In the frame of this work, some thermal treatments were also realized in O2-limiting conditions, to test the effect of charcoal obtained from RHA on the stabilization procedure. The results of this work show that the application of DIC technology into existing treatment cycles of some waste materials should be investigated in more details to offer the possibility to stabilize and reuse waste.

Rice Husk Ash to Stabilize Heavy Metals Contained in Municipal Solid Waste Incineration Fly Ash: First Results by Applying New Pre-treatment Technology

Science.gov (United States)

Benassi, Laura; Franchi, Federica; Catina, Daniele; Cioffi, Flavio; Rodella, Nicola; Borgese, Laura; Pasquali, Michela; Depero, Laura E.; Bontempi, Elza

2015-01-01

A new technology was recently developed for municipal solid waste incineration (MSWI) fly ash stabilization, based on the employment of all waste and byproduct materials. In particular, the proposed method is based on the use of amorphous silica contained in rice husk ash (RHA), an agricultural byproduct material (COSMOS-RICE project). The obtained final inert can be applied in several applications to produce “green composites”. In this work, for the first time, a process for pre-treatment of rice husk, before its use in the stabilization of heavy metals, based on the employment of Instant Pressure Drop technology (DIC) was tested. The aim of this work is to verify the influence of the pre-treatment on the efficiency on heavy metals stabilization in the COSMOS-RICE technology. DIC technique is based on a thermomechanical effect induced by an abrupt transition from high steam pressure to a vacuum, to produce changes in the material. Two different DIC pre-treatments were selected and thermal annealing at different temperatures were performed on rice husk. The resulting RHAs were employed to obtain COSMOS-RICE samples, and the stabilization procedure was tested on the MSWI fly ash. In the frame of this work, some thermal treatments were also realized in O2-limiting conditions, to test the effect of charcoal obtained from RHA on the stabilization procedure. The results of this work show that the application of DIC technology into existing treatment cycles of some waste materials should be investigated in more details to offer the possibility to stabilize and reuse waste. PMID:28793605

Quantum-size colloid metal systems

International Nuclear Information System (INIS)

Roldugin, V.I.

2000-01-01

In the review dealing with quantum-dimensional metallic colloid systems the methods of preparation, electronic, optical and thermodynamic properties of metal nanoparticles and thin films are considered, the effect of ionizing radiation on stability of silver colloid sols and existence of a threshold radiation dose affecting loss of stability being discussed. It is shown that sol stability loss stems from particles charge neutralization due to reduction of sorbed silver ions induced by radiation, which results in destruction of double electric layer on colloid particles boundary [ru

Influence of Metal Transfer Stability and Shielding Gas Composition on CO and CO2 Emissions during Short-circuiting MIG/MAG Welding

Directory of Open Access Journals (Sweden)

Valter Alves de Meneses

Full Text Available Abstract: Several studies have demonstrated the influence of parameters and shielding gas on metal transfer stability or on the generation of fumes in MIG/MAG welding, but little or nothing has been discussed regarding the emission of toxic and asphyxiating gases, particularly as it pertains to parameterization of the process. The purpose of this study was to analyze and evaluate the effect of manufacturing aspects of welding processes (short-circuit metal transfer stability and shielding gas composition on the gas emission levels during MIG/MAG welding (occupational health and environmental aspects. Using mixtures of Argon with CO2 and O2 and maintaining the same average current and the same weld bead volume, short-circuit welding was performed with carbon steel welding wire in open (welder’s breathing zone and confined environments. The welding voltage was adjusted to gradually vary the transfer stability. It was found that the richer the composition of the shielding gas is in CO2, the more CO and CO2 are generated by the arc. However, unlike fume emission, voltage and transfer stability had no effect on the generation of these gases. It was also found that despite the large quantity of CO and CO2 emitted by the arc, especially when using pure CO2 shielding gas, there was no high level residual concentration of CO and CO2 in or near the worker’s breathing zone, even in confined work cells.

A novel RE-chrome-boronizing technology assisted by fast multiple rotation rolling treatment at low temperature

Energy Technology Data Exchange (ETDEWEB)

Yuan, Xing-dong [School of Materials Science and Engineering, Shandong University, Jinan 250061 (China); School of Materials Science and Engineering, Shandong Jianzhu University, Jinan 250101 (China); Xu, Bin, E-mail: xubin@sdjzu.edu.cn [School of Materials Science and Engineering, Shandong Jianzhu University, Jinan 250101 (China); Cai, Yu-cheng [School of Materials Science and Engineering, Shandong Jianzhu University, Jinan 250101 (China)

2015-12-01

Highlights: • A nanostructured layer with grain size of approximately 30 nm was successfully fabricated in the upper-layer of carbon steel. • The penetrating rate was enhanced significantly by the fast multiple rotation rolling (FMRR) treatment at low temperature. • A novel and efficient RE-Chrome-Boronizing technology assisted by fast multiple rotation rolling (FMRR) treatment at low temperature was used to fabricate boride layers on the surface of carbon steel. - Abstract: The boride layer was fabricated on the surface of carbon steel by a novel RE-Chrome-Boronizing technology assisted by fast multiple rotation rolling (FMRR) treatment at low temperature. The microstructure of the boride layer was characterized by using scanning electron microscopy (SEM). The microstructure of the top surface layer of substrate was characterized by transmission electron microscopy (TEM) and high resolution rransmission electron microscopy (HRTEM). Experimental results showed that a nanostructured layer with grain size of approximately 30 nm was obtained; the amorphous phase and high-density dislocations were observed in upper-layer of FMRR samples, which led to the reduction of diffusion activation energy of boron atoms. Boride layers fabricated on the FMRR samples are continuous, dense, uniform, and low in brittleness. The penetrating rate was enhanced significantly when the FMRR samples were Cr-Rare earth-boronized at 650 °C for 6 h. The thickness of the boride layer of FMRR samples on carbon steel was approximately 25 μm when the duration was 60 min, which was approximately 1.5 times higher than the original sample. The boride layer consisted of mainly Fe2B, and adheres well to the metallic substrate.

Radical bonding: structure and stability of bis(phenalenyl) complexes of divalent metals from across the periodic table.

Science.gov (United States)

Craciun, Smaranda; Donald, Kelling J

2009-07-06

We examine the bonding possibilities of the bis(phenalenyl) MP(2) sandwich complexes of the divalent metals M = Be, Mg, Ca, Sr, Ba, Zn, Cd, and Hg, at the B3LYP level of theory. The outcome is an extraordinarily diverse class of low symmetry bis(phenalenyl)metal complexes in which bonding preferences and binding enthalpies differ dramatically. The lowest energy group 2 metal MP(2) complexes include an intriguing eta(1),eta(3) BeP(2) structure, and bent eta(6),eta(6) systems for M = Ca, Sr, and Ba. The group 12 bis(phenalenyl) complexes are thermodynamically unstable eta(1),eta(1) slip-sandwich structures. To better understand changes in the structural preferences going from the (eta(6),eta(6)) group 2 to the (eta(1),eta(1)) group 12 complexes, we explored the bonding in the bis(phenalenyl) complexes of transition metals with stable +2 oxidations states between Ca and Zn in period 4. The computed binding enthalpies are large and negative for nearly all of the minimum energy bis(phenalenyl) complexes of the group 2 and the transition metals; they are tiny for MgP(2), and are quite positive for the group 12 systems. The structural preferences and stability of the complexes is a subtle negotiation of several influences: the (un)availability of (n - 1)d and np, orbitals for bonding, the cost of the rehybridization at carbon sites in the phenalenyl rings in preparation for bonding to the metals, and the (P---P) interaction between the phenalenyl radicals.

Critical evaluation of the stability of highly concentrated LiTFSI - Acetonitrile electrolytes vs. graphite, lithium metal and LiFePO4 electrodes

Science.gov (United States)

Nilsson, Viktor; Younesi, Reza; Brandell, Daniel; Edström, Kristina; Johansson, Patrik

2018-04-01

Highly concentrated LiTFSI - acetonitrile electrolytes have recently been shown to stabilize graphite electrodes in lithium-ion batteries (LIBs) much better than comparable more dilute systems. Here we revisit this system in order to optimise the salt concentration vs. both graphite and lithium metal electrodes with respect to electrochemical stability. However, we observe an instability regardless of concentration, making lithium metal unsuitable as a counter electrode, and this also affects evaluation of e.g. graphite electrodes. While the highly concentrated electrolytes have much improved electrochemical stabilities, their reductive decomposition below ca. 1.2 V vs. Li+/Li° still makes them less practical vs. graphite electrodes, and the oxidative reaction with Al at ca. 4.1 V vs. Li+/Li° makes them problematic for high voltage LIB cells. The former originates in an insufficiently stable solid electrolyte interphase (SEI) dissolving and continuously reforming - causing self-discharge, as observed by paused galvanostatic cycling, while the latter is likely caused by aluminium current collector corrosion. Yet, we show that medium voltage LiFePO4 positive electrodes can successfully be used as counter and reference electrodes.

The pH-dependent long-term stability of an amorphous manganese oxide in smelter-polluted soils: implication for chemical stabilization of metals and metalloids.

Science.gov (United States)

Ettler, Vojtěch; Tomášová, Zdeňka; Komárek, Michael; Mihaljevič, Martin; Šebek, Ondřej; Michálková, Zuzana

2015-04-09

An amorphous manganese oxide (AMO) and a Pb smelter-polluted agricultural soil amended with the AMO and incubated for 2 and 6 months were subjected to a pH-static leaching procedure (pH 3-8) to verify the chemical stabilization effect on metals and metalloids. The AMO stability in pure water was pH-dependent with the highest Mn release at pH 3 (47% dissolved) and the lowest at pH 8 (0.14% dissolved). Secondary rhodochrosite (MnCO3) was formed at the AMO surfaces at pH>5. The AMO dissolved significantly less after 6 months of incubation. Sequential extraction analysis indicated that "labile" fraction of As, Pb and Sb in soil significantly decreased after AMO amendment. The pH-static experiments indicated that no effect on leaching was observed for Cd and Zn after AMO treatments, whereas the leaching of As, Cu, Pb and Sb decreased down to 20%, 35%, 7% and 11% of the control, respectively. The remediation efficiency was more pronounced under acidic conditions and the time of incubation generally led to increased retention of the targeted contaminants. The AMO was found to be a promising agent for the chemical stabilization of polluted soils. Copyright © 2015 Elsevier B.V. All rights reserved.

Microstructural characterization aluminium alloys from the addition of boron; Caracterizacao microestrutural de ligas de aluminio a partir da adicao de boro

Energy Technology Data Exchange (ETDEWEB)

Nunes, A.G.P.; Pipano, T.F.; Mota, M.A.; Mariano, N.A.; Ramos, E.C.T. [Universidade Federal de Alfenas (UNIFAL), Pocos de Caldas, MG (Brazil). Instituto de Ciencias e Tecnologia

2014-07-01

In the electrical industry, the aluminum becomes attractive because it has excellent characteristics for transmitting electricity. The liquid aluminum has in its composition transition elements (zirconium, titanium, vanadium and chromium) that interfere negatively on the quality of the product. The addition of aluminum-boron alloys have been used to remove transition metals through the formation of borides, enabling an increase in electrical conductivity. However, no detailed reports of reactions between boron, transition metals and primary aluminum engines. However, the objective is to determine the stoichiometric composition that enables an increase in electrical conductivity of an aluminum alloy. Samples with different concentrations of boron were characterized by optical emission spectrometry, electrical conductivity and X-ray diffraction. The addition of boron in excess reduces the time in the formation of borides, and enable an increase in electrical conductivity. (author)

Microstructural characterization aluminium alloys from the addition of boron

International Nuclear Information System (INIS)

Nunes, A.G.P.; Pipano, T.F.; Mota, M.A.; Mariano, N.A.; Ramos, E.C.T.

2014-01-01

In the electrical industry, the aluminum becomes attractive because it has excellent characteristics for transmitting electricity. The liquid aluminum has in its composition transition elements (zirconium, titanium, vanadium and chromium) that interfere negatively on the quality of the product. The addition of aluminum-boron alloys have been used to remove transition metals through the formation of borides, enabling an increase in electrical conductivity. However, no detailed reports of reactions between boron, transition metals and primary aluminum engines. However, the objective is to determine the stoichiometric composition that enables an increase in electrical conductivity of an aluminum alloy. Samples with different concentrations of boron were characterized by optical emission spectrometry, electrical conductivity and X-ray diffraction. The addition of boron in excess reduces the time in the formation of borides, and enable an increase in electrical conductivity. (author)

The effect of lunar soil, metal oxides on thermal and radio-chemical stability of amino acids

International Nuclear Information System (INIS)

Khenokh, M.A.; Lapinskaya, E.M.

1983-01-01

Data on study of the effect of lunar soil and some metal oxides characteristic both for land and sea basaltS of lunar sojls on thermal and radio-chemical stability of amino acids are presented. The data obtained permit to suppose that extremely small quantity of amino acids discovered in lunar soil is conditioned by their decomposition under combined effect of different types of radiation, solar wind and sharp change of temperature. Probably, the effect of soil on photochemical activity of UV-radiation of the Sun and solid-phase radiolysis is not practically observed

Laser aided direct metal deposition of Inconel 625 superalloy: Microstructural evolution and thermal stability

International Nuclear Information System (INIS)

Dinda, G.P.; Dasgupta, A.K.; Mazumder, J.

2009-01-01

Direct metal deposition technology is an emerging laser aided manufacturing technology based on a new additive manufacturing principle, which combines laser cladding with rapid prototyping into a solid freeform fabrication process that can be used to manufacture near net shape components from their CAD files. In the present study, direct metal deposition technology was successfully used to fabricate a series of samples of the Ni-based superalloy Inconel 625. A high power CO 2 laser was used to create a molten pool on the Inconel 625 substrate into which an Inconel 625 powder stream was delivered to create a 3D object. The structure and properties of the deposits were investigated using optical and scanning electron microscopy, X-ray diffraction and microhardness test. The microstructure has been found to be columnar dendritic in nature, which grew epitaxially from the substrate. The thermal stability of the dendritic morphology was investigated in the temperature range 800-1200 deg. C. These studies demonstrate that Inconel 625 is an attractive material for laser deposition as all samples produced in this study are free from relevant defects such as cracks, bonding error and porosity.

Laser aided direct metal deposition of Inconel 625 superalloy: Microstructural evolution and thermal stability

Energy Technology Data Exchange (ETDEWEB)

Dinda, G.P., E-mail: dindag@focushope.edu [Center for Advanced Technologies, Focus: HOPE, Detroit, MI 48238 (United States); Center for Laser Aided Intelligent Manufacturing, University of Michigan, Ann Arbor, MI 48109 (United States); Dasgupta, A.K. [Center for Advanced Technologies, Focus: HOPE, Detroit, MI 48238 (United States); Mazumder, J. [Center for Laser Aided Intelligent Manufacturing, University of Michigan, Ann Arbor, MI 48109 (United States)

2009-05-25

Direct metal deposition technology is an emerging laser aided manufacturing technology based on a new additive manufacturing principle, which combines laser cladding with rapid prototyping into a solid freeform fabrication process that can be used to manufacture near net shape components from their CAD files. In the present study, direct metal deposition technology was successfully used to fabricate a series of samples of the Ni-based superalloy Inconel 625. A high power CO{sub 2} laser was used to create a molten pool on the Inconel 625 substrate into which an Inconel 625 powder stream was delivered to create a 3D object. The structure and properties of the deposits were investigated using optical and scanning electron microscopy, X-ray diffraction and microhardness test. The microstructure has been found to be columnar dendritic in nature, which grew epitaxially from the substrate. The thermal stability of the dendritic morphology was investigated in the temperature range 800-1200 deg. C. These studies demonstrate that Inconel 625 is an attractive material for laser deposition as all samples produced in this study are free from relevant defects such as cracks, bonding error and porosity.

Bio-oil Stabilization by Hydrogenation over Reduced Metal Catalysts at Low Temperatures

Energy Technology Data Exchange (ETDEWEB)

Wang, Huamin; Lee, Suh-Jane; Olarte, Mariefel V.; Zacher, Alan H.

2016-08-30

Biomass fast pyrolysis integrated with bio-oil upgrading represents a very attractive approach for converting biomass to hydrocarbon transportation fuels. However, the thermal and chemical instability of bio-oils presents significant problems when they are being upgraded, and development of effective approaches for stabilizing bio-oils is critical to the success of the technology. Catalytic hydrogenation to remove reactive species in bio-oil has been considered as one of the most efficient ways to stabilize bio-oil. This paper provides a fundamental understanding of hydrogenation of actual bio-oils over a Ru/TiO2 catalyst under conditions relevant to practical bio-oil hydrotreating processes. Bio-oil feed stocks, bio-oils hydrogenated to different extents, and catalysts have been characterized to provide insights into the chemical and physical properties of these samples and to understand the correlation of the properties with the composition of the bio-oil and catalysts. The results indicated hydrogenation of various components of the bio-oil, including sugars, aldehydes, ketones, alkenes, aromatics, and carboxylic acids, over the Ru/TiO2 catalyst and 120 to 160oC. Hydrogenation of these species significantly changed the chemical and physical properties of the bio-oil and overall improved its thermal stability, especially by reducing the carbonyl content, which represented the content of the most reactive species (i.e., sugar, aldehydes, and ketones). The change of content of each component in response to increasing hydrogen additions suggests the following bio-oil hydrogenation reaction sequence: sugar conversion to sugar alcohols, followed by ketone and aldehyde conversion to alcohols, followed by alkene and aromatic hydrogenation, and then followed by carboxylic acid hydrogenation to alcohols. Hydrogenation of bio-oil samples with different sulfur contents or inorganic material contents suggested that sulfur poisoning of the reduced Ru metal catalysts was

[Study on composite stabilization of arsenic (As) contaminated soil].

Science.gov (United States)

Wang, Hao; Pan, Li-xiang; Zhang, Xiang-yu; Li, Meng; Song, Bao-hua

2013-09-01

Since the contaminated soil may contain various kinds of heavy metals, use of single chemical reagent leads to poor remediation and high cost. In this study, soil containing As, Zn, Cd was sampled, and different reagents were selected to carry out the rapid stabilization of contaminated soil. The TCLP (toxicity characteristic leaching procedure) was used to evaluate the leachate toxicity of heavy metals and the results indicated that calcium-containing, sulphur-containing and iron-containing reagents had good performance in reducing the metal mobility. The stabilization efficiency of the six reagents tested ranked in the order of CaO > Na2S > organic sulfur > Chitosan > FeSO4 > (C2H5)2NCS2Na. Two types of reagents (six reagents) were combined based on the target properties of different reagents and the stabilization efficiency was evaluated and analyzed. The results indicated that the composite reagents had higher stabilization efficiency: the efficiency of 3% FeSO4 + 5% CaO was 81.7%, 97.2% and 68.2% for As, Cd and Zn, respectively, and the efficiency of 3% CaO + 5% organic sulfur was 76.6%, 95.7% and 93.8% for these three metals, respectively. Speciation analysis was carried out in this study and the results suggested that it was the change of metals from the exchangeable state to the reduction (for inorganic reagent) or oxidation state (for organic reagent) that caused the soil stabilization and the degree of change determined the stabilization efficiency.

Effect of transition metal ions on the conductivity and stability of stabilized zirconia

DEFF Research Database (Denmark)

Lybye, D.; Mogensen, Mogens Bjerg

2007-01-01

the effect of co-doping with smaller transition metal ions such as Ti-, Fe- and Mn-ions. Many of the ionic radii of the transition metal ions are too small compared to the host lattice ionic radius of zirconium. Here we explore the effect of a) the small ionic radii compared to the large ionic radii...

Peroxidase-Mimicking Nanozyme with Enhanced Activity and High Stability Based on Metal-Support Interactions.

Science.gov (United States)

Li, Zhihao; Yang, Xiangdong; Yang, Yanbing; Tan, Yaning; He, Yue; Liu, Meng; Liu, Xinwen; Yuan, Quan

2018-01-09

Peroxidase-mimicking nanozymes offer unique advantages in terms of high stability and low cost over natural peroxidase for applications in bioanalysis, biomedicine, and the treatment of pollution. However, the design of high-efficiency peroxidase-mimicking nanozymes remains a great challenge. In this study, we adopted a structural-design approach through hybridization of cube-CeO 2 and Pt nanoparticles to create a new peroxidase-mimicking nanozyme with high efficiency and excellent stability. Relative to pure cube-CeO 2 and Pt nanoparticles, the as-hybridized Pt/cube-CeO 2 nanocomposites display much improved activities because of the strong metal-support interaction. Meanwhile, the nanocomposites also maintain high catalytic activity after long-term storage and multiple recycling. Based on their excellent properties, Pt/cube-CeO 2 nanocomposites were used to construct high-performance colorimetric biosensors for the sensitive detection of metabolites, including H 2 O 2 and glucose. Our findings highlight opportunities for the development of high-efficiency peroxidase-mimicking nanozymes with potential applications such as diagnostics, biomedicine, and the treatment of pollution. © 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

STABILITY CONSTANT OF THE TRISGLYCINATO METAL ...

African Journals Online (AJOL)

DR. AMINU

overall stability constants of the complexes were found to be similar. Keywords: Glycinato, titration ... +. −. = 1 where Ka = dissociation constant of the amino acid. [ ]+. H = concentration of the .... Synthesis and techniques in inorganic chemistry.

Thermal Stability of Copper-Aluminum Alloy Thin Films for Barrierless Copper Metallization on Silicon Substrate

Science.gov (United States)

Wang, C. P.; Dai, T.; Lu, Y.; Shi, Z.; Ruan, J. J.; Guo, Y. H.; Liu, X. J.

2017-08-01

Copper thin films with thickness of about 500 nm doped with different aluminum concentrations have been prepared by magnetron sputtering on Si substrate and their crystal structure, microstructure, and electrical resistivity after annealing at various temperatures (200°C to 600°C) for 1 h or at 400°C for different durations (1 h to 11 h) investigated by grazing-incidence x-ray diffraction (GIXRD) analysis, scanning electron microscopy (SEM), and four-point probe (FPP) measurements. Cu-1.8Al alloy thin film exhibited good thermal stability and low electrical resistivity (˜5.0 μΩ cm) after annealing at 500°C for 1 h or 400°C for 7 h. No copper silicide was observed at the Cu-Al/Si interface by GIXRD analysis or SEM for this sample. This result indicates that doping Cu thin film with small amounts of Al can achieve high thermal stability and low electrical resistivity, suggesting that Cu-1.8Al alloy thin film could be used for barrierless Cu metallization on Si substrate.

Stability constant of the trisglycinto metal complexes | Na'aliya ...

African Journals Online (AJOL)

The stability constants of iron, manganese, cobalt, and nickel complexes of glycine have been determined in aqueous solution by potentiometric titration with standard sodium hydroxide solution. The values of the stepwise stability constants were obtained by ORIGIN '50' program. The overall stability constants of the ...

Theoretical Investigation of the Structural Stabilities of Ceria Surfaces and Supported Metal Nanocluster in Vapor and Aqueous Phases

Energy Technology Data Exchange (ETDEWEB)

Ren, Zhibo [State Key Laboratory of Chemical Resource Engineering, Beijing University of Chemical Technology, Beijing 100029, China; Institute for Integrated Catalysis, Pacific Northwest National Laboratory, Richland, Washington 99352, United States; Liu, Ning [State Key Laboratory of Chemical Resource Engineering, Beijing University of Chemical Technology, Beijing 100029, China; Institute for Integrated Catalysis, Pacific Northwest National Laboratory, Richland, Washington 99352, United States; Chen, Biaohua [State Key Laboratory of Chemical Resource Engineering, Beijing University of Chemical Technology, Beijing 100029, China; Li, Jianwei [State Key Laboratory of Chemical Resource Engineering, Beijing University of Chemical Technology, Beijing 100029, China; Mei, Donghai [Institute for Integrated Catalysis, Pacific Northwest National Laboratory, Richland, Washington 99352, United States

2018-01-25

Understanding the structural stability and dynamics at the interface between the solid metal oxide and aqueous phase is significant in a variety of industrial applications including heterogeneous catalysis and environmental remediation. In the present work, the stabilities of three low-index ceria (CeO2) surfaces, i.e., (111), (110) and (100) in vapor and aqueous phases were studied using ab initio molecular dynamics simulations and density functional theory (DFT) calculations. Gibbs surface free energies as a function of temperature, water partial pressure, and water coverages were calculated using DFT based atomistic thermodynamic approach. On the basis of surface free energies, the morphology and exposed surface structures of the CeO2 nanoparticle were predicted using Wulff construction principle. It is found that the partially hydroxylated (111) and (100) are two major surface structures of CeO2 nanoparticles in vapor phase at ambient temperature (300 K). As the temperature increases, the fully dehydrated (111) surface gradually becomes the most dominant surface structure. While in aqueous phase, the exposed surface of the CeO2 nanoparticle is dominated by the hydroxylated (110) structure at 393 K. Finally, the morphology and stability of a cuboctahedron Pt13 nanocluster supported on CeO2 surfaces in both gas and aqueous phases were investigated. In gas phase, the supported Pt13 nanocluster has the tendency to wetting the CeO2 surface due to the strong metal-support interaction. The calculated interaction energies suggest the CeO2(110) surface provides the best stability for the Pt13 nanocluster. The CeO2 supported Pt13 nanoclusters are oxidized. Compared to the gas phase, the morphology of the CeO2 supported Pt13 nanocluster is less distorted due to the solvation effect provided by surrounding water molecules in aqueous phase. More electrons are transferred from the Pt13 nanocluster to the CeO2 support, implying the supported Pt13 nanocluster is further

Composite interlayer for diffusion bonding

International Nuclear Information System (INIS)

1976-01-01

A ductile interlayer is described, which is useful for transient liquid phase diffusion bonding of metallic articles; the interlayer consisting of a melting point depressant and a plurality of ductile lamellae which are free from carbides, aluminides and borides. The composition and fabrication of the lamellae, and the process for bonding the metallic articles, depend on the composition of the metals to be bonded, and are exemplified in the specification. (U.K.)

The Effect of Thermal Cycling Treatments on the Thermal Stability and Mechanical Properties of a Ti-Based Bulk Metallic Glass Composite

Directory of Open Access Journals (Sweden)

Fan Bu

2016-11-01

Full Text Available The effect of thermal cycling treatments on the thermal stability and mechanical properties of a Ti48Zr20Nb12Cu5Be15 bulk metallic glass composite (BMGC has been investigated. Results show that moderate thermal cycles in a temperature range of −196 °C (cryogenic temperature, CT to 25 °C (room temperature, RT or annealing time at CT has not induced obvious changes of thermal stability and then it decreases slightly over critical thermal parameters. In addition, the dendritic second phases with a bcc structure are homogeneously embedded in the amorphous matrix; no visible changes are detected, which shows structural stability. Excellent mechanical properties as high as 1599 MPa yield strength and 34% plastic strain are obtained, and the yield strength and elastic modulus also increase gradually. The effect on the stability is analyzed quantitatively by crystallization kinetics and plastic-flow models, and indicates that the reduction of structural relaxation enthalpy, which is related to the degradation of spatial heterogeneity, reduces thermal stability but does not imperatively deteriorate the plasticity.

Water Splitting over Epitaxially Grown InGaN Nanowires on-Metallic Titanium/Silicon Template: Reduced Interfacial Transfer Resistance and Improved Stability

KAUST Repository

Ebaid, Mohamed

2018-03-09

Water splitting using InGaN-based photocatalysts may have a great contribution in future renewable energy production systems. Among the most important parameters to solve are those related to substrate lattice-matching compatibility. Here, we directly grow InGaN nanowires (NWs) on a metallic Ti/Si template, for improving water splitting performance compared to a bare Si substrate. The open circuit potential of the epitaxially grown InGaN NWs on metallic Ti was almost two times that of those grown on Si substrate. The interfacial transfer resistance was also reduced significantly after introducing the metallic Ti interlayer. An applied-bias-photon-to-current conversion efficiency of 2.2% and almost unity Faradic efficiency for hydrogen generation were achieved using this approach. The InGaN NWs grown on Ti showed improved stability of hydrogen generation under continuous operation conditions, when compared to those grown on Si, emphasizing the role of the semiconductor-on-metal approach in enhancing the overall efficiency of water splitting catalysts.

Flourescent Peptide-Stabilized Silver-Nanoclusters

DEFF Research Database (Denmark)

Gregersen, Simon

to their physical and optoelectronic properties. These include great photostability, low toxicity, small size, and tunable spectral properties. Chemical stability of noble metal NCs is, however, very low, and they only exist transiently without a stabilizing scaffold. This has to date been done in solution using...

Does Increased Coefficient of Friction of Highly Porous Metal Increase Initial Stability at the Acetabular Interface?

Science.gov (United States)

Goldman, Ashton H; Armstrong, Lucas C; Owen, John R; Wayne, Jennifer S; Jiranek, William A

2016-03-01

Highly porous metal acetabular components illustrate a decreased rate of aseptic loosening in short-term follow-up compared with previous registry data. This study compared the effect of component surface roughness at the bone-implant interface and the quality of the bone on initial pressfit stability. The null hypothesis is that a standard porous coated acetabular cup would show no difference in initial stability as compared with a highly porous acetabular cup when subjected to a bending moment. Second, would bone mineral density (BMD) be a significant variable under these test conditions. In a cadaveric model, acetabular cup micromotion was measured during a 1-time cantilever bending moment applied to 2 generations of pressfit acetabular components. BMD data were also obtained from the femoral necks available for associated specimen. The mean bending moment at 150 μm was not found to be significantly different for Gription (24.6 ± 14.0 N m) cups vs Porocoat (25 ± 10.2 N m; P > .84). The peak bending moment tolerated by Gription cups (33.9 ± 20.3 N m) was not found to be significantly different from Porocoat (33.5 ± 12.2 N m; P > .92). No correlation between BMD and bending moment at 150 μm of displacement could be identified. The coefficient of friction provided by highly porous metal acetabular shells used in this study did not provide better resistance to migration under bending load when compared with a standard porous coated component. Copyright © 2016 Elsevier Inc. All rights reserved.

Evaluation of Stability of Complexes of Inner Transition Metal Ions with 2-Oxo-1-pyrrolidine Acetamide and Role of Systematic Errors

Directory of Open Access Journals (Sweden)

Sangita Sharma

2011-01-01

Full Text Available BEST FIT models were used to study the complexation of inner transition metal ions like Y(III, La(III, Ce(III, Pr(III, Nd(III, Sm(III, Gd(III, Dy(III and Th(IV with 2-oxo-1-pyrrolidine acetamide at 30 °C in 10%, 20, 30, 40, 50% and 60% v/v dioxane-water mixture at 0.2 M ionic strength. Irving Rossotti titration method was used to get titration data. Calculations were carried out with PKAS and BEST Fortran IV computer programs. The expected species like L, LH+, ML, ML2 and ML(OH3, were obtained with SPEPLOT. Stability of complexes has increased with increasing the dioxane content. The observed change in stability can be explained on the basis of electrostatic effects, non electrostatic effects, solvating power of solvent mixture, interaction between ions and interaction of ions with solvents. Effect of systematic errors like effect of dissolved carbon dioxide, concentration of alkali, concentration of acid, concentration of ligand and concentration of metal have also been explained here.

Thermal investigation of alkali metal hexacyanoruthenate (2)

International Nuclear Information System (INIS)

Okorskaya, A.P.; Sergeeva, A.N.; Pavlenko, L.I.; Semenishin, D.I.

1978-01-01

Thermal stability of Li, Na, K, Rb and Cs hexacyanoruthenates has been investigated. It has been established, that thermal decomposition of complexes depends upon outer spherical cations; complex compound stability decreasing with the rize of cation ionization potential. According to their thermal stability, alkali metal hexacyanoruthenates can be placed in the following row: Li < Na < K < Rb < Cs. Decomposition of Na, Rb and Cs complexes is accompanied by formation of thermally stable cyanides of these metals

Surface modification and functionalization of metal and metal oxide nanoparticles by organic ligands

NARCIS (Netherlands)

Neouze, M.A.; Schubert, U.S.

2008-01-01

Metal or metal oxide nanoparticles possess unique features compared to equivalent larger-scale materials. For applications, it is often necessary to stabilize or functionalize such nanoparticles. Thus, modification of the surface of nanoparticles is an important chemical challenge. In this survey,

Investigation of sulfur-tolerant catalysts for selective synthesis of hydrocarbon liquids from coal-derived gases. Annual technical progress report, September 19, 1980-September 18, 1981

Energy Technology Data Exchange (ETDEWEB)

Bartholomew, C.H.

1981-10-31

During the past contract year, considerable progress was made in characterization and activity/selectivity testing of iron and cobalt catalysts. Preparation of boride promoted cobalt and iron catalysts was refined and nearly completed. H/sub 2/ and CO adsorption and oxygen titration measurements were performed on a number of supported and unsupported catalysts, especially several boride promoted cobalt and iron catalysts. Activity/selectivity tests of 3 and 15% Fe/SiO/sub 2/ and Co/SiO/sub 2/ and of 6 borided cobalt and iron catalysts were completed. The product distributions for iron and cobalt boride catalysts are unusual and interesting. Boron promoted iron is more active and stable than iron/silica; cobalt boride has an unusually high selectivity for alcohols. Tests to determine effects of H/sub 2/S poisoning on activity/selectivity properties of 15% Co/SiO/sub 2/ indicate that a significant loss of activity occurs over a period of 24 to 28 h in the presence of 10 to 20 ppM H/sub 2/S. Product selectivity to liquids increased through a maximum during the gradual addition of sulfur. Reactant CO and H/sub 2/S interact partially to form COS which is less toxic than H/sub 2/S. H/sub 2/ and CO adsorption data were obtained for 3, 6 and 9% Co/ZSM-5 catalysts prepared and reactor tested by PETC. The unusual and interesting results suggest that metal-support interactions may have an important influence on reactant adsorption properties.

Stabilized superconductors

International Nuclear Information System (INIS)

Wong, J.

1975-01-01

The stable, high field, high current composite wire comprises multiple filaments in a depleted bronze matrix, each filament comprising a type II superconducting, beta-tungsten structure, intermetallic compound layer jacketing and metallurgically bonded to a stabilizing copper core, directly or via an intermediate layer of refractory metal

Preparation, thermal stability, and magnetic properties of Fe-Zr-Mo-W-B bulk metallic glass

International Nuclear Information System (INIS)

Liu, D.Y.; Sun, W.S.; Wang, A.M.; Zhang, H.F.; Hu, Z.Q.

2004-01-01

A bulk metallic glass (BMG) cylinder of Fe 60 Co 8 Zr 10 Mo 5 W 2 B 15 with a diameter of 1.5 mm was prepared by copper mould casting of industrial raw materials. The amorphous state and the crystallization behavior were investigated by X-ray diffraction (XRD). The thermal stability parameters, such as glass transition temperature (T g ), crystallization temperature (T x ), supercooled liquid region (ΔT x ) between T g and T x , and reduced glass transition temperature T rg (T g /T m ) were measured by differential scanning calorimetry (DSC) to be 891, 950, 59 K, and 0.62, respectively. The crystallization process took place through a single stage, and involved crystallization of the phases α-Fe, ZrFe 2 , Fe 3 B, MoB 2 , Mo 2 FeB 2 , and an unknown phase, as determined by X-ray analysis of the sample annealed for 1.5 ks at 1023 K, 50 K above the DSC peak temperature of crystallization. Moessbauer spectroscopy was studied for this alloy. The spectra exhibit a broadened and asymmetric doublet-like structure that indicated paramagnetic behavior and a fully amorphous structure. α-Fe was found in the amorphous matrix for a cylinder with a diameter of 2.5 mm. The success of synthesis of the Fe-based bulk metallic glass from industrial materials is important for the future progress in research and practical application of new bulk metallic glasses

Manhattan Project Technical Series The Chemistry of Uranium (I) Chapters 1-10

International Nuclear Information System (INIS)

Rabinowitch, E. I.; Katz, J. J.

1946-01-01

This constitutes Chapters 1 through 10. inclusive, of The Survey Volume on Uranium Chemistry prepared for the Manhattan Project Technical Series. Chapters are titled: Nuclear Properties of Uranium; Properties of the Uranium Atom; Uranium in Nature; Extraction of Uranium from Ores and Preparation of Uranium Metal; Physical Properties of Uranium Metal; Chemical Properties of Uranium Metal; Intermetallic Compounds and Alloy systems of Uranium; the Uranium-Hydrogen System; Uranium Borides, Carbides, and Silicides; Uranium Nitrides, Phosphides, Arsenides, and Antimonides.

Reliably Modeling the Mechanical Stability of Rigid and Flexible Metal-Organic Frameworks.

Science.gov (United States)

Rogge, Sven M J; Waroquier, Michel; Van Speybroeck, Veronique

2018-01-16

Over the past two decades, metal-organic frameworks (MOFs) have matured from interesting academic peculiarities toward a continuously expanding class of hybrid, nanoporous materials tuned for targeted technological applications such as gas storage and heterogeneous catalysis. These oft-times crystalline materials, composed of inorganic moieties interconnected by organic ligands, can be endowed with desired structural and chemical features by judiciously functionalizing or substituting these building blocks. As a result of this reticular synthesis, MOF research is situated at the intriguing intersection between chemistry and physics, and the building block approach could pave the way toward the construction of an almost infinite number of possible crystalline structures, provided that they exhibit stability under the desired operational conditions. However, this enormous potential is largely untapped to date, as MOFs have not yet found a major breakthrough in technological applications. One of the remaining challenges for this scale-up is the densification of MOF powders, which is generally achieved by subjecting the material to a pressurization step. However, application of an external pressure may substantially alter the chemical and physical properties of the material. A reliable theoretical guidance that can presynthetically identify the most stable materials could help overcome this technological challenge. In this Account, we describe the recent research the progress on computational characterization of the mechanical stability of MOFs. So far, three complementary approaches have been proposed, focusing on different aspects of mechanical stability: (i) the Born stability criteria, (ii) the anisotropy in mechanical moduli such as the Young and shear moduli, and (iii) the pressure-versus-volume equations of state. As these three methods are grounded in distinct computational approaches, it is expected that their accuracy and efficiency will vary. To date

Influence of in situ formed ZrB2 particles on microstructure and mechanical properties of AA6061 metal matrix composites

International Nuclear Information System (INIS)

Dinaharan, I.; Murugan, N.; Parameswaran, Siva

2011-01-01

Highlights: → In situ fabrication of aluminium metal matrix composite reinforced ZrB 2 particles. → Colour metallography of composites. → Improvement of matrix properties by ZrB 2 particles. → Sliding wear behaviour of in situ composites. - Abstract: Particulate reinforced metal matrix composites (PMMCs) have gained considerable amount of research emphasis and attention in the present era. Research is being carried out across the globe to produce new combination of PMMCs. PMMCs are prepared by adding a variety of ceramic particles with monolithic alloys using several techniques. An attempt has been made to produce aluminium metal matrix composites reinforced with zirconium boride (ZrB 2 ) particles by the in situ reaction of K 2 ZrF 6 and KBF 4 salts with molten aluminium. The influence of in situ formed ZrB 2 particles on the microstructure and mechanical properties of AA6061 alloy was studied in this work. The in situ formed ZrB 2 particles significantly refined the microstructure and enhanced the mechanical properties of AA6061 alloy. The weight percentage of ZrB 2 was varied from 0 to 10 in steps of 2.5. Improvement of hardness, ultimate tensile strength and wear resistance of AA6061 alloy was observed with the increase in ZrB 2 content.

Thermal stability of atomic layer deposited WCxNy electrodes for metal oxide semiconductor devices

Science.gov (United States)

Zonensain, Oren; Fadida, Sivan; Fisher, Ilanit; Gao, Juwen; Danek, Michal; Eizenberg, Moshe

2018-01-01

This study is a thorough investigation of the chemical, structural, and electrical stability of W based organo-metallic films, grown by atomic layer deposition, for future use as gate electrodes in advanced metal oxide semiconductor structures. In an earlier work, we have shown that high effective work-function (4.7 eV) was produced by nitrogen enriched films (WCxNy) dominated by W-N chemical bonding, and low effective work-function (4.2 eV) was produced by hydrogen plasma resulting in WCx films dominated by W-C chemical bonding. In the current work, we observe, using x-ray diffraction analysis, phase transformation of the tungsten carbide and tungsten nitride phases after 900 °C annealing to the cubic tungsten phase. Nitrogen diffusion is also observed and is analyzed with time-of-flight secondary ion mass spectroscopy. After this 900 °C anneal, WCxNy effective work function tunability is lost and effective work-function values of 4.7-4.8 eV are measured, similar to stable effective work function values measured for PVD TiN up to 900 °C anneal. All the observed changes after annealing are discussed and correlated to the observed change in the effective work function.

Effects of interface formation kinetics on the microstructural properties of wear-resistant metal-matrix composites

International Nuclear Information System (INIS)

Ilo, S.; Just, Ch.; Badisch, E.; Wosik, J.; Danninger, H.

2010-01-01

Research highlights: The dissolution reaction kinetics and the formation of intermediate layers of tungsten carbides in Ni-(Cr)-B-Si matrices were studied in liquid-phase sintering with well-defined temperature/time relationship. → The internal intermediate layer formation, close to the original primary tungsten carbide showed diffusion-controlled kinetic (∼t 0.5 ), whereas the outside layer thickness formation, proportional to the processing time (∼t), was formed by the subsequent eutectic reaction of the Ni-(Cr)-B-Si matrix with the WC/W 2 C component. → Cr-addition in the matrix highly influences the inner layer thickness caused probably by increasing the C-diffusion rate, whereas the outer layer thickness was not dependent on the initial Cr-content in the matrix. Generally, the Cr-addition in the Ni-based matrix increased the hardness and elastic modulus of the intermediate phases along the carbide/matrix interface. → The different microstructure gradients are depended mainly on the interface growth kinetics. → The intermediate layers are hard phases (carbides, borides or carbo-borides). → The hardness of the carbide/matrix interface area is significantly lower as the hardness of the original primary tungsten carbides. - Abstract: Hard-particle metal-matrix composites (MMC) are generally used to increase the lifetime of machinery equipment exposed to severe wear conditions. Depending on the manufacturing technology, dissolution reactions of hard phases undergo different temperature/time profiles during processing affecting the microstructure and mechanical properties of the MMCs. Therefore, quantification of the carbide dissolution effects on the microstructure and micro-mechanical properties is the key to success in the development and optimisation of MMCs. Dissolution kinetics of WC/W 2 C in Ni-based matrices were determined in the liquid-sintering with a well-defined temperature/time profile. Microscopic evaluation of the samples showed two

Treatment of Petroleum Sludge By Using Solidification/Stabilization (S/S) Method : Effect of Hydration Days to Heavy Metals Leaching and Strength

Science.gov (United States)

Murshid, N.; Kamil, N. A. F. M.; Kadir, A. A.

2018-04-01

Petroleum sludge is one of the major solid wastes generated in the petroleum industry. Generally, there are numbers of heavy metals in petroleum sludge and one treatment that is gaining prominence to treat a variety of mixed organic and inorganic waste is solidification/stabilization (S/S) method. The treatment protects human health and the environment by immobilizing contaminants within the treated material and prevents migration of the contaminants. In this study, solidification/stabilization (S/S) method has been used to treat the petroleum sludge. The comparison of hydration days, namely, 7th and 28th days in these cement-based waste materials were studied by using Synthetic Precipitate Leaching Procedure (SPLP). The results were compared to the United States Environmental Protection Agency (USEPA) standards. The results for leaching test concluded that less percentage OPC gave maximum concentration of heavy metals leaching due to deficient in Calcium Oxide (CaO), which is can caused weak solidification in the mixture. Physical and mechanical properties conducted such as compressive strength and density test. From the results, it shows addition up to of 30percentage PS give results which comply with minimum landfill dispose limit. The results shows correlation between strength and density are strong regression coefficient of 82.7%. In conclusion, S/S method can be alternative disposal method for PS in the same time complies with standard for minimum landfill disposal limit. The results for leaching test concluded the less OPC percentage gave maximum concentration of heavy metals leaching.

Integrating the stabilization of nuclear materials

Energy Technology Data Exchange (ETDEWEB)

Dalton, H.F. [Department of Energy, Washington, DC (United States)

1996-05-01

In response to Recommendation 94-1 of the Defense Nuclear Facilities Safety Board, the Department of Energy committed to stabilizing specific nuclear materials within 3 and 8 years. These efforts are underway. The Department has already repackaged the plutonium at Rocky Flats and metal turnings at Savannah River that had been in contact with plastic. As this effort proceeds, we begin to look at activities beyond stabilization and prepare for the final disposition of these materials. To describe the plutonium materials being stabilize, Figure 1 illustrates the quantities of plutonium in various forms that will be stabilized. Plutonium as metal comprises 8.5 metric tons. Plutonium oxide contains 5.5 metric tons of plutonium. Plutonium residues and solutions, together, contain 7 metric tons of plutonium. Figure 2 shows the quantity of plutonium-bearing material in these four categories. In this depiction, 200 metric tons of plutonium residues and 400 metric tons of solutions containing plutonium constitute most of the material in the stabilization program. So, it is not surprising that much of the work in stabilization is directed toward the residues and solutions, even though they contain less of the plutonium.

Stabilization of the initial electrochemical potential for a metal-based potentiometric titration study of a biosorption process.

Science.gov (United States)

Naja, Ghinwa; Mustin, Christian; Volesky, Bohumil; Berthelin, Jacques

2006-01-01

An interactive metal-based potentiometric titration method has been developed using an ion selective electrode for studying the sorption of metal cations. The accuracy of this technique was verified by analyzing the metal sorption mechanism for the biomass of Rhizopus arrhizus fungus and diatomite, two dissimilar materials (organic and mineral, strong sorbent and weak sorbent) of a different order of cation exchange capacity. The problem of the initial electrochemical potential was addressed identifying the usefulness of a Na-sulfonic resin as a strong chelating agent applied before the beginning of sorption titration experiments so that the titration curves and the sorption uptake could be quantitatively compared. The resin stabilized the initial electrochemical potential to -405+/-5 mV corresponding to 2 micro gl(-1) of lead concentration in solution. The amounts of lead sorbed by R. arrhizus biomass and diatomite were 0.9 mmol g(-1) (C(e)=5.16 x 10(-2)mM) and 0.052 mmol g(-1) (C(e)=5.97 x 10(-2) mM), respectively. Lead sorption by the fungal biomass was pinpointed to at least two types of chemical active sites. The first type was distinguished by high reactivity and a low number of sites whereas the other was characterized by their higher number and lower reactivity.

Stability Constants of Mixed Ligand Complexes of Transition Metal(II Ions with Salicylidene-4-methoxyaniline as Primary Ligand and 5-Bromosalicylidene-4-nitroaniline as Secondary Ligand

Directory of Open Access Journals (Sweden)

N. G. Nadkarni

2011-01-01

Full Text Available Binary and ternary complexes of the type M-Y and M-X-Y [M = Mn(II, Ni(II, Cu(II and Zn(II; X = salicylidene-4-methoxyaniline and Y=5-bromosalicylidene-4-nitroaniline] have been examined pH-metrically at 27±0.5 °C and at constant ionic strength, μ= 0.1 M (KCl in 75 : 25(v/v 1,4-dioxne-water medium. The stability constants for binary (M-Y and ternary (M-X-Y systems were calculated. The relative stability (Δ log KT values of the ternary complexes with corresponding binary complexes for all the metal(II ions in the present study found to be negative indicating that ternary 1:1:1 (M-X-Y complexes are less stable than binary 1:1 (M-Y complexes. In the ternary system studied, the order of stability constants of mixed ligand complexes with respect to the metal ions was found to be Cu(II > NI(II > Mn(II > Zn(II; which is same as in the corresponding binary (M-Y systems.

Sol-Gel Stabilization of Heavy Metal Waste

National Research Council Canada - National Science Library

Cropek, Donald

2000-01-01

.... The types of media are varied and include soils, ashes, and sludges. Waste having a leachable metal concentration above the Toxicity Characteristic Leaching Procedure limit established by the U.S...

Ternary ceramic thermal spraying powder and method of manufacturing thermal sprayed coating using said powder

Energy Technology Data Exchange (ETDEWEB)

Vogli, Evelina; Sherman, Andrew J.; Glasgow, Curtis P.

2018-02-06

The invention describes a method for producing ternary and binary ceramic powders and their thermal spraying capable of manufacturing thermal sprayed coatings with superior properties. Powder contain at least 30% by weight ternary ceramic, at least 20% by weight binary molybdenum borides, at least one of the binary borides of Cr, Fe, Ni, W and Co and a maximum of 10% by weight of nano and submicro-sized boron nitride. The primary crystal phase of the manufactured thermal sprayed coatings from these powders is a ternary ceramic, while the secondary phases are binary ceramics. The coatings have extremely high resistance against corrosion of molten metal, extremely thermal shock resistance and superior tribological properties at low and at high temperatures.

Development of rapidly quenched nickel-based non-boron filler metals for brazing corrosion resistant steels

Science.gov (United States)

Ivannikov, A.; Kalin, B.; Suchkov, A.; Penyaz, M.; Yurlova, M.

2016-04-01

Corrosion-resistant steels are stably applied in modern rocket and nuclear technology. Creating of permanent joints of these steels is a difficult task that can be solved by means of welding or brazing. Recently, the use rapidly quenched boron-containing filler metals is perspective. However, the use of such alloys leads to the formation of brittle borides in brazing zone, which degrades the corrosion resistance and mechanical properties of the compounds. Therefore, the development of non-boron alloys for brazing stainless steels is important task. The study of binary systems Ni-Be and Ni-Si revealed the perspective of replacing boron in Ni-based filler metals by beryllium, so there was the objective of studying of phase equilibrium in the system Ni-Be-Si. The alloys of the Ni-Si-Be with different contents of Si and Be are considered in this paper. The presence of two low-melting components is revealed during of their studying by methods of metallography analysis and DTA. Microhardness is measured and X-ray diffraction analysis is conducted for a number of alloys of Ni-Si-Be. The compositions are developed on the basis of these data. Rapidly quenched brazing alloys can be prepared from these compositions, and they are suitable for high temperature brazing of steels.

Thermodynamics of Pore Filling Metal Clusters in Metal Organic Frameworks: Pd in UiO-66

DEFF Research Database (Denmark)

Vilhelmsen, Lasse; Sholl, David S.

2012-01-01

Metal organic frameworks (MOFs) have experimentally been demonstrated to be capable of supporting isolated transition-metal clusters, but the stability of these clusters with respect to aggregation is unclear. In this letter we use a genetic algorithm together with density functional theory...... calculations to predict the structure of Pd clusters in UiO-66. The cluster sizes examined are far larger than those in any previous modeling studies of metal clusters in MOFs and allow us to test the hypothesis that the physically separated cavities in UiO-66 could stabilize isolated Pd clusters. Our...... calculations show that Pd clusters in UiO-66 are, at best, metastable and will aggregate into connected pore filling structures at equilibrium....

General predictive model of friction behavior regimes for metal contacts based on the formation stability and evolution of nanocrystalline surface films.

Energy Technology Data Exchange (ETDEWEB)

Argibay, Nicolas [Sandia National Lab. (SNL-CA), Livermore, CA (United States); Cheng, Shengfeng [Virginia Polytechnic Inst. and State Univ. (Virginia Tech), Blacksburg, VA (United States); Sawyer, W. G. [Univ. of Florida, Gainesville, FL (United States); Michael, Joseph R. [Sandia National Lab. (SNL-CA), Livermore, CA (United States); Chandross, Michael E. [Sandia National Lab. (SNL-CA), Livermore, CA (United States)

2015-09-01

The prediction of macro-scale friction and wear behavior based on first principles and material properties has remained an elusive but highly desirable target for tribologists and material scientists alike. Stochastic processes (e.g. wear), statistically described parameters (e.g. surface topography) and their evolution tend to defeat attempts to establish practical general correlations between fundamental nanoscale processes and macro-scale behaviors. We present a model based on microstructural stability and evolution for the prediction of metal friction regimes, founded on recently established microstructural deformation mechanisms of nanocrystalline metals, that relies exclusively on material properties and contact stress models. We show through complementary experimental and simulation results that this model overcomes longstanding practical challenges and successfully makes accurate and consistent predictions of friction transitions for a wide range of contact conditions. This framework not only challenges the assumptions of conventional causal relationships between hardness and friction, and between friction and wear, but also suggests a pathway for the design of higher performance metal alloys.

Experimentation and simulation of H.S.L.A. sheet metal bending bent pats behaviour's prediction during working life

International Nuclear Information System (INIS)

Avril, Ludovic

2003-01-01

A pulsed Nd-YAG laser is used to irradiate and alloy X30Cr13 stainless steel by surface melting, with incorporation of boron or hexagonal boron nitride (h-BN), and to obtain thick coatings: multiphase borided alloys or metal-ceramic composites. The metallographic analyses allow to determine the thickness for each coating (melting zone) and reveal characteristic solidification microstructures: planar front and cellular dendrites. Optical characteristics of the laser beam are measured: divergence, focal length spot radius and power distribution in the focal plane. Heat effect simulations are based on the finite difference modelling of the temporal progression of temperature distribution in the steel irradiated by scanning of the pulsed beam. Melting zone thickness is computed and progression of melting front during irradiation is simulated and so, a better description of the conditions of material incorporation by successive melting and solidifications becomes possible. The mechanical properties, elastic modulus and hardness, of the different coatings are determined from nano-indentation tests. Under optimal irradiation conditions, the hardness reaches 14 GPa for composite coating and 10 GPa for borided alloy, whereas that for untreated steel is 4 GPa. Friction and wear tests are systematically performed in a ball-on-disc configuration, at 25 C under various loads (1 to 10 N), then at 300 and 500 C under 2 N. At ambient temperature, the dry sliding on ruby ball of these two types of coatings is characterized by a reduced friction coefficient and a weak wear rate, compared with the untreated steel, revealing a very reinforced resistance towards adhesive and/or abrasive wear. On the other hand, their wear resistance is decreased from 300 C, in the spite of the significant lowering of friction coefficient. (author)

ESTABLISHING SUSTAINABLE US HEV/PHEV MANUFACTURING BASE: STABILIZED LITHIUM METAL POWDER, ENABLING MATERIAL AND REVOLUTIONARY TECHNOLOGY FOR HIGH ENERGY LI-ION BATTERIES

Energy Technology Data Exchange (ETDEWEB)

Yakovleva, Marina

2012-12-31

FMC Lithium Division has successfully completed the project “Establishing Sustainable US PHEV/EV Manufacturing Base: Stabilized Lithium Metal Powder, Enabling Material and Revolutionary Technology for High Energy Li-ion Batteries”. The project included design, acquisition and process development for the production scale units to 1) produce stabilized lithium dispersions in oil medium, 2) to produce dry stabilized lithium metal powders, 3) to evaluate, design and acquire pilot-scale unit for alternative production technology to further decrease the cost, and 4) to demonstrate concepts for integrating SLMP technology into the Li- ion batteries to increase energy density. It is very difficult to satisfy safety, cost and performance requirements for the PHEV and EV applications. As the initial step in SLMP Technology introduction, industry can use commercially available LiMn2O4 or LiFePO4, for example, that are the only proven safer and cheaper lithium providing cathodes available on the market. Unfortunately, these cathodes alone are inferior to the energy density of the conventional LiCoO2 cathode and, even when paired with the advanced anode materials, such as silicon composite material, the resulting cell will still not meet the energy density requirements. We have demonstrated, however, if SLMP Technology is used to compensate for the irreversible capacity in the anode, the efficiency of the cathode utilization will be improved and the cost of the cell, based on the materials, will decrease.

Equilibrium properties of simple metal thin films in the self-compressed stabilized jellium model.

Science.gov (United States)

Mahmoodi, T; Payami, M

2009-07-01

In this work, we have applied the self-compressed stabilized jellium model to predict the equilibrium properties of isolated thin Al, Na and Cs slabs. To make a direct correspondence to atomic slabs, we have considered only those L values that correspond to n-layered atomic slabs with 2≤n≤20, for surface indices (100), (110), and (111). The calculations are based on the density functional theory and self-consistent solution of the Kohn-Sham equations in the local density approximation. Our results show that firstly, the quantum size effects are significant for slabs with sizes smaller than or near to the Fermi wavelength of the valence electrons λ(F), and secondly, some slabs expand while others contract with respect to the bulk spacings. Based on the results, we propose a criterion for realization of significant quantum size effects that lead to expansion of some thin slabs. For more justification of the criterion, we have tested it on Li slabs for 2≤n≤6. We have compared our Al results with those obtained from using all-electron or pseudo-potential first-principles calculations. This comparison shows excellent agreements for Al(100) work functions, and qualitatively good agreements for the other work functions and surface energies. These agreements justify the way we have used the self-compressed stabilized jellium model for the correct description of the properties of simple metal slab systems. On the other hand, our results for the work functions and surface energies of large- n slabs are in good agreement with those obtained from applying the stabilized jellium model for semi-infinite systems. In addition, we have performed the slab calculations in the presence of surface corrugation for selected Al slabs and have shown that the results are worsened.

Flexible high power-per-weight perovskite solar cells with chromium oxide-metal contacts for improved stability in air

Science.gov (United States)

Kaltenbrunner, Martin; Adam, Getachew; Głowacki, Eric Daniel; Drack, Michael; Schwödiauer, Reinhard; Leonat, Lucia; Apaydin, Dogukan Hazar; Groiss, Heiko; Scharber, Markus Clark; White, Matthew Schuette; Sariciftci, Niyazi Serdar; Bauer, Siegfried

2015-10-01

Photovoltaic technology requires light-absorbing materials that are highly efficient, lightweight, low cost and stable during operation. Organolead halide perovskites constitute a highly promising class of materials, but suffer limited stability under ambient conditions without heavy and costly encapsulation. Here, we report ultrathin (3 μm), highly flexible perovskite solar cells with stabilized 12% efficiency and a power-per-weight as high as 23 W g-1. To facilitate air-stable operation, we introduce a chromium oxide-chromium interlayer that effectively protects the metal top contacts from reactions with the perovskite. The use of a transparent polymer electrode treated with dimethylsulphoxide as the bottom layer allows the deposition--from solution at low temperature--of pinhole-free perovskite films at high yield on arbitrary substrates, including thin plastic foils. These ultra-lightweight solar cells are successfully used to power aviation models. Potential future applications include unmanned aerial vehicles--from airplanes to quadcopters and weather balloons--for environmental and industrial monitoring, rescue and emergency response, and tactical security applications.

Nanoporous silica membranes with high hydrothermal stability

DEFF Research Database (Denmark)

Boffa, Vittorio; Magnacca, Giualiana; Yue, Yuanzheng

to improve the stability of nanoporous silica structure. This work is a quantitative study on the impact of type and concentration of transition metal ions on the microporous structure and stability of amorphous silica-based membranes, which provides information on how to design chemical compositions...

First-principles study of structural stabilities, elastic and electronic properties of transition metal monocarbides (TMCs) and mononitrides (TMNs)

Energy Technology Data Exchange (ETDEWEB)

Rached, H.; Rached, D.; Benalia, S. [Laboratoire des Matériaux Magnétiques, Faculté des Sciences, Université Djillali Liabès de Sidi Bel-Abbès, Sidi Bel-Abbès 22000 (Algeria); Reshak, A.H., E-mail: maalidph@yahoo.co.uk [Institute of Complex Systems, FFPW, CENAKVA, University of South Bohemia in CB, Nove Hrady 37333 (Czech Republic); Center of Excellence Geopolymer and Green Technology, School of Material Engineering, University Malaysia Perlis, 01007 Kangar, Perlis (Malaysia); Rabah, M. [Laboratoire des Matériaux Magnétiques, Faculté des Sciences, Université Djillali Liabès de Sidi Bel-Abbès, Sidi Bel-Abbès 22000 (Algeria); Khenata, R. [Laboratoire de Physique Quantique et de Modélisation Mathématique de la Matière (LPQ3M), université de Mascara, Mascara 29000 (Algeria); Bin Omran, S. [Department of Physics and Astronomy, Faculty of Science, King Saud University, Riyadh 11451 (Saudi Arabia)

2013-12-16

The structural stabilities, elastic and electronic properties of 5d transition metal mononitrides (TMNs) XN with (X = Ir, Os, Re, W and Ta) and 5d transition metal monocarbides (TMCs) XC with (X = Ir, Os, Re and Ta) were investigated using the full-potential linear muffin-tin orbital (FP-LMTO) method, in the framework of the density functional theory (DFT) within the local density approximation (LDA) for the exchange correlation functional. The ground state quantities such as the lattice parameter, bulks modulus and its pressure derivatives for the six considered crystal structures, Rock-salt (B1), CsCl (B2), zinc-blend (B3), Wurtzite (B4), NiAs (B8{sub 1}) and the tungsten carbides (B{sub h}) are calculated. The elastic constants of TMNs and TMCs compounds in its different stable phases are determined by using the total energy variation with strain technique. The elastic modulus for polycrystalline materials, shear modulus (G), Young's modulus (E), and Poisson's ratio (ν) are calculated. The Debye temperature (θ{sub D}) and sound velocities (v{sub m}) were also derived from the obtained elastic modulus. The analysis of the hardness of the herein studied compounds classifies OsN – (B4 et B8{sub 1}), ReN – (B8{sub 1}), WN – (B8{sub 1}) and OsC – (B8{sub 1}) as superhard materials. Our results for the band structure and densities of states (DOS), show that TMNs and TMCs compounds in theirs energetically and mechanically stable phase has metallic characteristic with strong covalent nature Metal–Nonmetal elements. - Highlights: • Structural stabilities, elastic, electronic properties of 5d TMNs XN are investigated. • 5d TMCs XC with (X = Ir, Os, Re and Ta) were investigated. • The ground state properties for the six considered crystal structure are calculated. • The elastic constants of TMNs and TMCs in its different stable phases are determined. • The elastic modulus for polycrystalline materials, G, E, and ν are calculated.

Controllable reductive method for synthesizing metal-containing particles

Science.gov (United States)

Moon, Ji-Won; Jung, Hyunsung; Phelps, Tommy Joe; Duty, Chad E.; Ivanov, Ilia N.; Joshi, Pooran Chandra; Jellison, Jr., Gerald Earle; Armstrong, Beth Louise; Smith, Sean Campbell; Rondinone, Adam Justin; Love, Lonnie J.

2018-03-06

The invention is directed to a method for producing metal-containing particles, the method comprising subjecting an aqueous solution comprising a metal salt, E.sub.h, lowering reducing agent, pH adjusting agent, and water to conditions that maintain the E.sub.h value of the solution within the bounds of an E.sub.h-pH stability field corresponding to the composition of the metal-containing particles to be produced, and producing said metal-containing particles in said aqueous solution at a selected E.sub.h value within the bounds of said E.sub.h-pH stability field. The invention is also directed to the resulting metal-containing particles as well as devices in which they are incorporated.

Surface Grafting of Ru(II) Diazonium-Based Sensitizers on Metal Oxides Enhances Alkaline Stability for Solar Energy Conversion.

Science.gov (United States)

Bangle, Rachel; Sampaio, Renato N; Troian-Gautier, Ludovic; Meyer, Gerald J

2018-01-24

The electrografting of [Ru(ttt)(tpy-C 6 H 4 -N 2 + )] 3+ , where "ttt" is 4,4',4″-tri-tert-butyl-2,2':6',2″-terpyridine, was investigated on several wide band gap metal oxide surfaces (TiO 2 , SnO 2 , ZrO 2 , ZnO, In 2 O 3 :Sn) and compared to structurally analogous sensitizers that differed only by the anchoring group, i.e., -PO 3 H 2 and -COOH. An optimized procedure for diazonium electrografting to semiconductor metal oxides is presented that allowed surface coverages that ranged between 4.7 × 10 -8 and 10.6 × 10 -8 mol cm -2 depending on the nature of the metal oxide. FTIR analysis showed the disappearance of the diazonium stretch at 2266 cm -1 after electrografting. XPS analysis revealed a characteristic peak of Ru 3d at 285 eV as well as a peak at 531.6 eV that was attributed to O 1s in Ti-O-C bonds. Photocurrents were measured to assess electron injection efficiency of these modified surfaces. The electrografted sensitizers exhibited excellent stability across a range of pHs spanning from 1 to 14, where classical binding groups such as carboxylic and phosphonic derivatives were hydrolyzed.

Influence of compositions on thermal stability and thermodynamic parameter in Ca-Mg-Cu bulk metallic glasses

Science.gov (United States)

Deshmukh, A. A.; Khond, A. A.; Palikundwar, U. A.

2018-05-01

In the present manuscript, influence of compositions on thermal stability (ΔTx) and thermodynamic parameter PHSS of Ca-Mg-Cu bulk metallic glasses (BMGs) is evaluated. The statistical approach of regression analysis is adopted to investigate the compositional variation with ΔTx and PHSS. It is found that calcium (Ca) and copper (Cu) content has goodlinear relationship with ΔTx and PHSS. It is observed that with increase in Ca content, ΔTx and PHSS decreases. On the other hand, increase in Cu content, both ΔTx and PHSS increases. Correlation fit of magnesium (Mg) content with both ΔTx and PHSS is very poor. A graph is also plotted to understand the relationship between ΔTx and PHSS. Result of the relationship between ΔTx and PHSS reveals that the alloy composition having more negative value of PHSS will have more stability. Therefore, compositions with more negative value of PHSS will lead to ease of BMGs formation in Ca-Mg-Cu alloy system and hence more stable it will be. It is expected that these results will be supportive in identifying the compositions having these elements for making BMGs.

Alkali metal for ultraviolet band-pass filter

Science.gov (United States)

Mardesich, Nick (Inventor); Fraschetti, George A. (Inventor); Mccann, Timothy A. (Inventor); Mayall, Sherwood D. (Inventor); Dunn, Donald E. (Inventor); Trauger, John T. (Inventor)

1993-01-01

An alkali metal filter having a layer of metallic bismuth deposited onto the alkali metal is provided. The metallic bismuth acts to stabilize the surface of the alkali metal to prevent substantial surface migration from occurring on the alkali metal, which may degrade optical characteristics of the filter. To this end, a layer of metallic bismuth is deposited by vapor deposition over the alkali metal to a depth of approximately 5 to 10 A. A complete alkali metal filter is described along with a method for fabricating the alkali metal filter.

Composition and method for coke retardant during hydrocarbon processing

International Nuclear Information System (INIS)

Reid, D.K.

1988-01-01

A process is described for inhibiting the formation and deposition of filamentous coke on metallic surfaces in contact with a hydrocarbon having a temperature of 600 0 -1300 0 F which comprises adding to the hydrocarbon a sufficient amount for the purpose of a boron compound selected from the group of boron oxide compounds, boric acid and metal borides, with the proviso that when boric acid is used, it is substantially free of water

Scandium, yttrium and the lanthanide metals

International Nuclear Information System (INIS)

Brown, Paul L.; Ekberg, Christian

2016-01-01

The hydroxide and oxide phases that exist for scandium(III) include scandium hydroxide, which likely has both amorphous and crystalline forms, ScOOH(s), and scandium oxide. This chapter presents the data selected for the stability constants of the polymeric hydrolysis species of scandium at zero ionic strength. The behaviour of yttrium, and the lanthanide metals, in the environment is largely dependent on their solution equilibria. Hydrolysis and other complexation reactions of yttrium and the lanthanide metals are important in the disposal of nuclear waste. The trivalent lanthanide metals include lanthanum(III) through lutetium(III). A number of studies have reported a tetrad effect for the geochemical behaviour of the lanthanide series, including stability constants and distribution coefficients. The solubility of many of the lanthanide hydroxide phases has been studied at fixed ionic strength. In studying the hydrolysis of cerium(IV), a number of studies have utilised oxidation-reduction reactions in determining the relevant stability constants.

Synthesis and Stability of Lanthanum Superhydrides

Energy Technology Data Exchange (ETDEWEB)

Geballe, Zachary M. [Geophysical Laboratory, Carnegie Institution of Washington, Washington DC 20015 USA; Liu, Hanyu [Geophysical Laboratory, Carnegie Institution of Washington, Washington DC 20015 USA; Mishra, Ajay K. [Geophysical Laboratory, Carnegie Institution of Washington, Washington DC 20015 USA; Permanent address: HP& SRPD, Bhabha Atomic Research Center, Mumbai-85 India; Ahart, Muhtar [Geophysical Laboratory, Carnegie Institution of Washington, Washington DC 20015 USA; Somayazulu, Maddury [Geophysical Laboratory, Carnegie Institution of Washington, Washington DC 20015 USA; Meng, Yue [HPCAT, Geophysical Laboratory, Carnegie Institution of Washington, Argonne IL 60439 USA; Baldini, Maria [Geophysical Laboratory, Carnegie Institution of Washington, Washington DC 20015 USA; Hemley, Russell J. [Institute of Materials Science and Department of Civil and Environmental Engineering, The George Washington University, Washington DC 20052 USA

2017-12-15

Recent theoretical calculations predict that megabar pressure stabilizes very hydrogen-rich simple compounds having new clathrate-like structures and remarkable electronic properties including room-temperature superconductivity. X-ray diffraction and optical studies demonstrate that superhydrides of lanthanum can be synthesized with La atoms in an fcc lattice at 170 GPa upon heating to about 1000 K. The results match the predicted cubic metallic phase of LaH10 having cages of thirty-two hydrogen atoms surrounding each La atom. Upon decompression, the fcc-based structure undergoes a rhombohedral distortion of the La sublattice. The superhydride phases consist of an atomic hydrogen sublattice with H-H distances of about 1.1 Å, which are close to predictions for solid atomic metallic hydrogen at these pressures. With stability below 200 GPa, the superhydride is thus the closest analogue to solid atomic metallic hydrogen yet to be synthesized and characterized.

New phosphate-based binder for stabilization of soils contaminated with heavy metals: leaching, strength and microstructure characterization.

Science.gov (United States)

Du, Yan-Jun; Wei, Ming-Li; Reddy, Krishna R; Jin, Fei; Wu, Hao-Liang; Liu, Zhi-Bin

2014-12-15

Cement stabilization is used extensively to remediate soils contaminated with heavy metals. However, previous studies suggest that the elevated zinc (Zn) and lead (Pb) concentrations in the contaminated soils would substantially retard the cement hydration, leading to the deterioration of the performance of cement stabilized soils. This study presents a new binder, KMP, composed of oxalic acid-activated phosphate rock, monopotassium phosphate and reactive magnesia. The effectiveness of stabilization using this binder is investigated on soils spiked with Zn and Pb, individually and together. Several series of tests are conducted including toxicity characteristic leaching (TCLP), ecotoxicity in terms of luminescent bacteria test and unconfined compressive strength. The leachability of a field Zn- and Pb- contaminated soil stabilized with KMP is also evaluated by TCLP leaching test. The results show that the leached Zn concentrations are lower than the China MEP regulatory limit except when Zn and Pb coexist and for the curing time of 7 days. On the other hand, the leached Pb concentrations for stabilized soils with Pb alone or mixed Zn and Pb contamination are much lower than the China MEP or USEPA regulatory limit, irrespective of the curing time. The luminescent bacteria test results show that the toxicity of the stabilized soils has been reduced considerably and is classified as slightly toxic class. The unconfined compressive strength of the soils decrease with the increase in the Zn concentration. The stabilized soils with mixed Zn and Pb contaminants exhibit notably higher leached Zn concentration, while there is lower unconfined compressive strength relative to the soils when contaminated with Zn alone. The X-ray diffraction and scanning electron microscope analyses reveal the presence of bobierrite (Mg3(PO4)2·8H2O) and K-struvite (MgKPO4·6H2O) as the main products formed in the KMP stabilized uncontaminated soils; the formation of hopeite (Zn3(PO4)2·4H2O

Small hazardous waste generators in developing countries: use of stabilization/solidification process as an economic tool for metal wastewater treatment and appropriate sludge disposal.

Science.gov (United States)

Silva, Marcos A R; Mater, Luciana; Souza-Sierra, Maria M; Corrêa, Albertina X R; Sperb, Rafael; Radetski, Claudemir M

2007-08-25

The aim of this study was to propose a profitable destination for an industrial sludge that can cover the wastewater treatment costs of small waste generators. Optimized stabilization/solidification technology was used to treat hazardous waste from an electroplating industry that is currently released untreated to the environment. The stabilized/solidified (S/S) waste product was used as a raw material to build concrete blocks, to be sold as pavement blocks or used in roadbeds and/or parking lots. The quality of the blocks containing a mixture of cement, lime, clay and waste was evaluated by means of leaching and solubility tests according to the current Brazilian waste regulations. Results showed very low metal leachability and solubility of the block constituents, indicating a low environmental impact. Concerning economic benefits from the S/S process and reuse of the resultant product, the cost of untreated heavy metal-containing sludge disposal to landfill is usually on the order of US$ 150-200 per tonne of waste, while 1tonne of concrete roadbed blocks (with 25% of S/S waste constitution) has a value of around US$ 100. The results of this work showed that the cement, clay and lime-based process of stabilization/solidification of hazardous waste sludge is sufficiently effective and economically viable to stimulate the treatment of wastewater from small industrial waste generators.

Evaluating the Long-Term Stability of Metals Precipitated In-Situ

Science.gov (United States)

Because metals (including metals and metalloids) cannot be destroyed, unlike organic contaminants, in-situ approaches for their removal from groundwater necessarily involves fixation/immobilization in the solid aquifer matrix. Consequently, the success of precipitation based in...

High-performance characteristics of the bonded magnets produced from the Sm2 Fe17 Nx powder stabilized by photo-induced zinc metal coatings

International Nuclear Information System (INIS)

Machida, K.; Izumi, H.; Shiomi, A.; Iguchi, M.; Adachi, G.

1996-01-01

Finely and uniformly ground powders of Sm 2 Fe 17 N x were stabilized by surface-coating with the zinc metal produced from Zn (C 2 H 5 ) 2 . The epoxy resin-bonded magnets produced from the Zn/Sm 2 Fe 17 N x composite powder provided high-performance permanent magnetic characteristics: (BH)max=∼ 176 kJm -3 . (author)

Li4SiO4-Based Artificial Passivation Thin Film for Improving Interfacial Stability of Li Metal Anodes.

Science.gov (United States)

Kim, Ji Young; Kim, A-Young; Liu, Guicheng; Woo, Jae-Young; Kim, Hansung; Lee, Joong Kee

2018-03-14

An amorphous SiO 2 (a-SiO 2 ) thin film was developed as an artificial passivation layer to stabilize Li metal anodes during electrochemical reactions. The thin film was prepared using an electron cyclotron resonance-chemical vapor deposition apparatus. The obtained passivation layer has a hierarchical structure, which is composed of lithium silicide, lithiated silicon oxide, and a-SiO 2 . The thickness of the a-SiO 2 passivation layer could be varied by changing the processing time, whereas that of the lithium silicide and lithiated silicon oxide layers was almost constant. During cycling, the surface of the a-SiO 2 passivation layer is converted into lithium silicate (Li 4 SiO 4 ), and the portion of Li 4 SiO 4 depends on the thickness of a-SiO 2 . A minimum overpotential of 21.7 mV was observed at the Li metal electrode at a current density of 3 mA cm -2 with flat voltage profiles, when an a-SiO 2 passivation layer of 92.5 nm was used. The Li metal with this optimized thin passivation layer also showed the lowest charge-transfer resistance (3.948 Ω cm) and the highest Li ion diffusivity (7.06 × 10 -14 cm 2 s -1 ) after cycling in a Li-S battery. The existence of the Li 4 SiO 4 artificial passivation layer prevents the corrosion of Li metal by suppressing Li dendritic growth and improving the ionic conductivity, which contribute to the low charge-transfer resistance and high Li ion diffusivity of the electrode.

Highly stabilized gadolinium chelates functionalized on metal nanoparticles as magnetic resonance imaging contrast agent

Science.gov (United States)

Siddiqui, Talha S.

Magnetic resonance imaging (MRI) is a non-invasive method for imaging and diagnosing tissue damage, organ function and the vascular system. Magnevist(TM) a complex of diethylenetriaminepentaacetic acid (DTPA) and Gd3+ is a clinically approved contrast agent for MRI. A derivative of DTPA was formed by the addition of two cysteine groups (DTPA-L-Cys) through amide linkage. The Gd complex of this ligand bonds with the silver surfaces through the cysteine thiols. GdDTPA-L-Cys was bound to ˜10nm diameter Ag nanoparticles for use as a multifunctional MRI contrast agent. The ligand and complex were characterized by 1H and 13C NMR, ESI-MS and IR spectroscopy. The silver construct was characterized by TEM, TGA and UV-Vis absorption spectra. The per metal complex r1 relaxivity of GdDTPA-L-Cys{Ag} greater than that of Magnavist(TM) with the same molarity for both compounds. The synthesis of a DTPA derivative is described that allows it to bind to silver or gold nanoparticles through a single thiol linkage (DTPASH). The resulting Gd complex, GdDTPASH, was bound to Ag nanoparticles to create a single monolayer on the surface. The construct was further stabilized in buffered solution with the addition of a thiolated PEG chain. The highly stabilized nanoparticle construct delivers a high payload of Gd compelex and is an effective T1 brightening agent. The production of this type of construct opens the way for engineered multimodal MRI contrast agents.

Structural energetics of noble metals

International Nuclear Information System (INIS)

Mujibur Rahman, S.M.

1982-06-01

Structural energetics of the noble metals, namely Cu, Ag, and Au are investigated by employing a single-parameter pseudopotential. The calculations show that the lowest energy for all of these metals corresponds to FCC - their observed crystal structure. The one-electron contribution to the free energy is found to dominate the structural prediction for these metals. The present investigation strongly emphasizes that the effects due to band hybridization and core-core exchange play a significant role on the structural stability of the noble metals. (author)

Stability of accelerated metal shells

International Nuclear Information System (INIS)

Tahsiri, H.

1976-01-01

A systematic treatment has been developed for the Rayleigh-Taylor instability of an accelerated liner. It is applicable to one-dimensional models either compressible or incompressible. With this model several points have been clarified. For an incompressible liner model, the Rayleigh-Taylor instability will have about five e-folding periods and the usual growth rate is independent of the current distribution or current rise time. Adequate stability will therefore depend on the magnitude of the initial perturbations or the precision of the initial liner and the thickness over which the shell is accelerated. However, for a compressible model, theory predicts that the current rise time is important and the Rayleigh-Taylor instability is suppressed if the current rise time is less than the shock transit time

Abductor dysfunction and related sciatic nerve palsy, a new complication of metal-on-metal arthroplasty.

Science.gov (United States)

Beaver, Walter B; Fehring, Thomas K

2012-08-01

The optimal bearing for use in young patients with hip arthritis remains elusive. Current options include metal-on-cross-linked polyethylene, ceramic-on-cross-linked polyethylene, ceramic on ceramic, and metal on metal. Each of these bearing couples has advantages and disadvantages. Metal-on-metal designs allow the use of large heads that decrease impingement and improve stability. This fact has made this bearing an attractive option for surgeons and patients alike. This case report will illustrate a severe adverse reaction to metal debris with necrosis of soft tissues and subsequent damage to the sciatic nerve. Copyright © 2012 Elsevier Inc. All rights reserved.

Improving hardness and toughness of boride composites based on aluminum magnesium boride

Science.gov (United States)

Peters, Justin Steven

The search for new super-hard materials has usually focused on strongly bonded, highly symmetric crystal structures similar to diamond. The two hardest single-phase materials, diamond and cubic boron nitride (cBN), are metastable, and both must be produced at high temperatures and pressures, which makes their production costly. In 2000, a superhard composite based on a low-symmetry, boron-rich compound was reported. Since then, many advances have been made in the study of this AlMgB14--TiB2 composite. The composite has been shown to exhibit hardness greater than either of its constituent phases, relying on its sub-micron microstructure to provide hardening and strengthening mechanisms. With possible hardness around 40 GPa, an AlMgB 14--60 vol% TiB2 approaches the hardness of cBN, yet is amenable to processing under ambient pressure conditions. There are interesting aspects of both the AlMgB14 and TiB 2 phases. AlMgB14 is comprised of a framework of boron, mostly in icosahedral arrangements. It is part of a family of 12 known compounds with the same boron lattice, with the metal atoms replaced by Li, Na, Y or a number of Lanthanides. Another peculiar trait of this family of compounds is that every one contains a certain amount of intrinsic vacancies on one or both of the metal sites. These vacancies are significant, ranging from 3 to 43% of sites depending on the composition. TiB2 is a popular specialty ceramic material due to its high hardness, moderate toughness, good corrosion resistance, and high thermal and electrical conductivity. The major drawback is the difficulty of densification of pure TiB2 ceramics. A combination of sintering aids, pressure, and temperatures of 1800°C are often required to achieve near full density articles. The AlMgB14--TiB2 composites can achieve 99% density from hotpressing at 1400°C. This is mostly due to the preparation of powders by a high-energy milling technique known as mechanical alloying. The resulting fine powders have

Raman spectra of hot-pressed boron suboxide

CSIR Research Space (South Africa)

Machaka, R

2011-01-01

Full Text Available on in- situ/online measurements (such as GIXRD, Raman Spectroscopy, FIB- Electron Microscopy) during (i) ion implantation, (ii) PLD growth of nanoparticles SW/MW-CNTs, oxide semiconductor multi-layer, metal/Si and metal/metal systems. Moreover, He...], aluminium magnesium boride ? AlMgB14 [8], and the newly synthesized boron subnitride ? B13N2 [9, 10]. With hardness values reported between 24 GPa and 45 GPa [7, 11, 12], B6O is sometimes considered to be the third hardest material only after diamond...

Magnetohydrodynamic instability of a cylindrical liquid-metal brush

International Nuclear Information System (INIS)

Hong, S.H.; Wilhelm, H.E.

1976-01-01

The stability of a homopolar generator brush, consisting of a liquid-metal-filled cavity between rotating (rotor) and fixed (stator) cylinder electrodes, is analyzed in the presence of radial current transport and an axial homogeneous magnetic field. Within the frame of linear magnetohydrodynamics, it is shown that the liquid-metal flow in the brush is always unstable if the brush transports current. In the absence of current flow (infinite load) the axial magnetic field stabilizes the liquid-metal flow in the brush if the magnetic energy density is larger than a certain fraction of the energy density of the rotating fluid

Synthesis and characterization of thermally stable oligomer-metal ...

African Journals Online (AJOL)

The thermal stabilities of the oligomer-metal complexes were compared by thermogravimetric (TG) and differential thermal (DTA) analyses. According to TG, oligomer-metal complexes were stable against to temperature and thermooxidative decomposition. The weight losses of oligomer-metal complexes were found to be 5 ...

Synthesis and stability of lanthanum superhydrides

Energy Technology Data Exchange (ETDEWEB)

Geballe, Zachary M.; Liu, Hanyu; Mishra, Ajay K.; Ahart, Muhtar; Somayazulu, Maddury; Baldini, Maria [Geophysical Laboratory, Carnegie Institution, Washington, DC (United States); Meng, Yue [HPCAT, Geophysical Laboratory, Carnegie Institution of Washington, Argonne, IL (United States); Hemley, Russell J. [Institute of Materials Science and Department of Civil and Environmental Engineering, The George Washington University, Washington, DC (United States)

2018-01-15

Recent theoretical calculations predict that megabar pressure stabilizes very hydrogen-rich simple compounds having new clathrate-like structures and remarkable electronic properties including room-temperature superconductivity. X-ray diffraction and optical studies demonstrate that superhydrides of lanthanum can be synthesized with La atoms in an fcc lattice at 170 GPa upon heating to about 1000 K. The results match the predicted cubic metallic phase of LaH{sub 10} having cages of thirty-two hydrogen atoms surrounding each La atom. Upon decompression, the fcc-based structure undergoes a rhombohedral distortion of the La sublattice. The superhydride phases consist of an atomic hydrogen sublattice with H-H distances of about 1.1 Aa, which are close to predictions for solid atomic metallic hydrogen at these pressures. With stability below 200 GPa, the superhydride is thus the closest analogue to solid atomic metallic hydrogen yet to be synthesized and characterized. (copyright 2018 Wiley-VCH Verlag GmbH and Co. KGaA, Weinheim)

Promotion Effect of Alkali Metal Hydroxides on Polymer-Stabilized Pd Nanoparticles for Selective Hydrogenation of C–C Triple Bonds in Alkynols

OpenAIRE

Nikoshvili, Linda Zh.; Bykov, Alexey V.; Khudyakova, Tatiana E.; Lagrange, Thomas; Héroguel, Florent; Luterbacher, Jeremy S.; Matveeva, Valentina G.; Sulman, Esther M.; Dyson, Paul J.; Kiwi-Minsker, Lioubov

2017-01-01

Postimpregnation of Pd nanoparticles (NPs) stabilized within hyper-cross-linked polystyrene with sodium or potassium hydroxides of optimal concentration was found to significantly increase the catalytic activity for the partial hydrogenation of the C–C triple bond in 2-methyl-3-butyn-2-ol at ambient hydrogen pressure. The alkali metal hydroxide accelerates the transformation of the residual Pd(II) salt into Pd(0) NPs and diminishes the reaction induction period. In addition, the selectivity t...

Management of metal-bearing industrial solid waste by stabilization/solidification process

Energy Technology Data Exchange (ETDEWEB)

Sunitha, C.; Palanivelu, K. [Anna University, Chennai (India). Centre for Environmental Studies

2005-07-01

Metal-bearing sludge from an electroplating industry was immobilised by the solidification stabilisation treatment method. Reduction of the leachability of metals from the waste was studied in different combinations of waste and additives - cement, lime and fly ash. The study revealed that the optimum proportion for cement: metal hydroxide sludge: fly ash as 1:2:2 is the best. The encapsulation efficiency calculated for the metals such as Cu, Cr, Ni, Pb, and Zn was above 92%. The unconfined compressive strength (UCS) for the developed block was found to be 11.5 kg/cm{sup 2} after curing. The toxicity characteristic leach test (TCLP) test reveals that the heavy metal content in the leachate was well below the maximum permissible limit of WHO drinking water standard. 10 refs., 6 tabs.

Non-hydrolytic metal oxide films for perovskite halide overcoating and stabilization

Science.gov (United States)

Martinson, Alex B.; Kim, In Soo

2017-09-26

A method of protecting a perovskite halide film from moisture and temperature includes positioning the perovskite halide film in a chamber. The chamber is maintained at a temperature of less than 200 degrees Celsius. An organo-metal compound is inserted into the chamber. A non-hydrolytic oxygen source is subsequently inserted into the chamber. The inserting of the organo-metal compound and subsequent inserting of the non-hydrolytic oxygen source into the chamber is repeated for a predetermined number of cycles. The non-hydrolytic oxygen source and the organo-metal compound interact in the chamber to deposit a non-hydrolytic metal oxide film on perovskite halide film. The non-hydrolytic metal oxide film protects the perovskite halide film from relative humidity of greater than 35% and a temperature of greater than 150 degrees Celsius, respectively.

Characteristics and Modification of Non-metallic Inclusions in Titanium-Stabilized AISI 409 Ferritic Stainless Steel

Science.gov (United States)

Kruger, Dirk; Garbers-Craig, Andrie

2017-06-01

This study describes an investigation into the improvement of castability, final surface quality and formability of titanium-stabilized AISI 409 ferritic stainless steel on an industrial scale. Non-metallic inclusions found in this industrially produced stainless steel were first characterized using SEM-EDS analyses through the INCA-Steel software platform. Inclusions were found to consist of a MgO·Al2O3 spinel core, which acted as heterogeneous nucleation site for titanium solubility products. Plant-scale experiments were conducted to either prevent the formation of spinel, or to modify it by calcium treatment. Modification to spherical dual-phase spinel-liquid matrix inclusions was achieved with calcium addition, which eliminated submerged entry nozzle clogging for this grade. Complete modification to homogeneous liquid calcium aluminates was achieved at high levels of dissolved aluminum. A mechanism was suggested to explain the extent of modification achieved.

Assessment of water-soluble thiourea-formaldehyde (WTF) resin for stabilization/solidification (S/S) of heavy metal contaminated soils.

Science.gov (United States)

Liu, She-Jiang; Jiang, Jia-Yu; Wang, Shen; Guo, Yu-Peng; Ding, Hui

2018-03-15

Stabilization/Solidification (S/S) can be regarded as necessary for remediation of heavy metal contaminated soil. There is, however, solid agent is not very convenient to use. Water-soluble thiourea-formaldehyde (WTF) is a novel chelating agent, which has more practical applications. The process of WTF resin for S/S process of heavy metal contaminated soils was studied. Laboratory-prepared slurries, made of field soils spiked with Cd 2+ and Cr 6+ were treated with WTF resin. The toxicity characteristic leaching procedure (TCLP) showed that with 2 wt% WTF, in the neutral condition of soil after treatment for 7 d, the leaching concentrations of Cd 2+ and Cr 6+ in contaminated soil were decreased by 80.3% and 92.6% respectively. Moreover, Tessier sequence extraction procedure showed WTF resin reduced the leaching concentration by transforming heavy metal from exchange form to organic form. The structure of WTF is obtained according to elemental analysis result and reaction mechanism. Through analysis of the infrared spectrogram of WTF and WTF heavy mental chelating precipitation, WTF can form stable chelate with heavy mental through coordination. The significant groups are hydroxyl, nitrogen and sulphur function groups in WTF mainly. Toxicology test revealed that the WTF resin is nontoxic to microorganism in the soils. Copyright © 2017 Elsevier B.V. All rights reserved.

Crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides: First-principles calculations

Energy Technology Data Exchange (ETDEWEB)

Wang, Y.; Chen, W. [International Center for New-Structured Materials (ICNSM), Zhejiang University, and Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, Department of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Chen, X.; Liu, H.Y. [State Key Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); Ding, Z.H.; Ma, Y.M. [State Key Laboratory of Inorganic Synthesis and Preparative Chemistry, Jilin University, Changchun 130012 (China); Wang, X.D.; Cao, Q.P. [International Center for New-Structured Materials (ICNSM), Zhejiang University, and Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, Department of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Jiang, J.Z., E-mail: jiangjz@zju.edu.cn [International Center for New-Structured Materials (ICNSM), Zhejiang University, and Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, Department of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China)

2012-10-15

Highlights: Black-Right-Pointing-Pointer Changes from NaCl-, WC- to anti-NiAs-type structures are for 4d and 5d metal monoborides. Black-Right-Pointing-Pointer Vickers hardnesses of monoborides are relatively low. Black-Right-Pointing-Pointer B-vacancies cause the difference in lattice parameters for IrB and PtB. Black-Right-Pointing-Pointer Nonstoichiometric IrB and PtB phases synthesized. - Abstract: The crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides have been studied by first principles calculations. It is found that NaCl-type ZrB, NbB, MoB, HfB, TaB and WB, WC-type TcB, RuB, ReB, OsB and IrB, and anti-NiAs-type RhB and PdB are thermodynamically stable at zero pressure. They all are metallic. The Vickers hardnesses of these monoborides are relatively low as compared with monocarbides and mononitrides. It is clarified that the presence of B-vacancies is the origin for the difference of lattice parameters between theoretical and experimental results for WC-type IrB and anti-NiAs-type PtB while IrB and PtB with stoichiometry from calculations are revealed to be mechanically unstable and dynamically unstable, respectively.

Crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides: First-principles calculations

International Nuclear Information System (INIS)

Wang, Y.; Chen, W.; Chen, X.; Liu, H.Y.; Ding, Z.H.; Ma, Y.M.; Wang, X.D.; Cao, Q.P.; Jiang, J.Z.

2012-01-01

Highlights: ► Changes from NaCl-, WC- to anti-NiAs-type structures are for 4d and 5d metal monoborides. ► Vickers hardnesses of monoborides are relatively low. ► B-vacancies cause the difference in lattice parameters for IrB and PtB. ► Nonstoichiometric IrB and PtB phases synthesized. - Abstract: The crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides have been studied by first principles calculations. It is found that NaCl-type ZrB, NbB, MoB, HfB, TaB and WB, WC-type TcB, RuB, ReB, OsB and IrB, and anti-NiAs-type RhB and PdB are thermodynamically stable at zero pressure. They all are metallic. The Vickers hardnesses of these monoborides are relatively low as compared with monocarbides and mononitrides. It is clarified that the presence of B-vacancies is the origin for the difference of lattice parameters between theoretical and experimental results for WC-type IrB and anti-NiAs-type PtB while IrB and PtB with stoichiometry from calculations are revealed to be mechanically unstable and dynamically unstable, respectively.

Complexes of 3.6 kDa Maltodextrin with Some Metals

Directory of Open Access Journals (Sweden)

Christopher H. Schilling

2004-06-01

Full Text Available Preparation of magnesium, lanthanum, and bismuth(III complexes of 3.6 kDa maltodextrin and some properties of the resulting materials are presented. The metal derivatives contain metals bound to the oxygen atoms of the hydroxyl groups of maltodextrin. Additionally, the metal atoms are coordinated to the hydroxyl groups of the D-glucose units of the macroligand. Such coordination stabilized the metal – oxygen bond against hydrolysis, even in boiling water. The presence of magnesium and lanthanum atoms increased the thermal stability of maltodextrin, whereas bismuth atoms decreased it.

Microstructure of Ti6Al4V reinforced by coating W particles through laser metal deposition

CSIR Research Space (South Africa)

Ndou, N

2016-10-01

Full Text Available properties. Metallurgical and Materials transactions A, 33, 3489- 3498, 2002. [2] E. Atar, E.S. Kayali & H. Cimenoglu, Characteristics and wear performance of borided Ti6Al4V alloy. Surface and Coatings technology, 202, 4583-4590, 2008. [3] C. Lee, A...

Preparation of nanodispersed titania using stabilized ammonium nitrate melts

KAUST Repository

Raciulete, Monica

2010-10-01

An expedite one-step approach using simple precursors has been proposed to obtain metallic oxide compounds and exemplified by preparation of highly dispersed TiO2. The technique consists in heating to 400500 °C of molten ammonium nitrate stabilized with an organic nitrogen-containing compound (urea, melamine, ammonium oxalate) and containing dissolved metal salt precursor (TiOCl2). The crystallites of the resulting TiO2 demonstrated variable size and shape as a function of stabilizer used. Their activity in photocatalytic oxidation of formic acid also depends on the nature of the stabilizer. The catalysts as-prepared showed high photocatalytic performance, superior to that of the Degussa P25 reference. Nitrogen containing stabilizers play a double role of increasing the process safety and modifying the properties of the solid products. © 2010 Elsevier Inc. All rights reserved.

Metallic complexes with glyphosate: a review

OpenAIRE

Coutinho, Cláudia F. B.; Mazo, Luiz Henrique

2005-01-01

We present studies involving metallic ions and the herbicide glyphosate. The metallic complexes of Cu(II), Zn(II), Mn(II), Ni(II), Cd(II), Pb(II), Cr(III), Fe(III), Co(III), ammonium, sodium, Ag(I), alkaline earth metals and of some lanthanides ions are described. The complexes are discussed in terms of their synthesis, identification, stability and structural properties, based on data from the current literature.

Laccase Immobilization by Chelated Metal Ion Coordination Chemistry

Directory of Open Access Journals (Sweden)

Qingqing Wang

2014-09-01

Full Text Available In this work, amidoxime polyacrylonitrile (AOPAN nanofibrous membrane was prepared by a reaction between PAN nanofibers and hydroxylamine hydrochloride. The AOPAN nanofibrous membranes were used for four metal ions (Fe3+, Cu2+, Ni2+, Cd2+ chelation under different conditions. Further, the competition of different metal ions coordinating with AOPAN nanofibrous membrane was also studied. The AOPAN chelated with individual metal ion (Fe3+, Cu2+, Ni2+, Cd2+ and also the four mixed metal ions were further used for laccase (Lac immobilization. Compared with free laccase, the immobilized laccase showed better resistance to pH and temperature changes as well as improved storage stability. Among the four individual metal ion chelated membranes, the stability of the immobilized enzymes generally followed the order as Fe–AOPAN–Lac > Cu–AOPAN–Lac > Ni–AOPAN–Lac > Cd–AOPAN–Lac. In addition, the immobilized enzyme on the carrier of AOPAN chelated with four mixed metal ions showed the best properties.

Reactive synthesis of Ti-W-Cr-B mixing powder by spark plasma sintering; Hoden plasma shoketsu ni yoru Ti-W-Cr-B kongo funmatsu no hanno gosei

Energy Technology Data Exchange (ETDEWEB)

Kaga, H. [Hokkaido Industrial Technology Center, Sapporo (Japan); Carrillo-Heian, E.M.; Munir, Z.A. [University of California, CA, (United States)

2000-08-15

The reactive sintered compacts of Ti-W-Cr-B mixed powders were manufactured by a pulse electric current technique. Identification and characterization of the resulting boride phase were done using EPMA, XRD and other methods. The density of the sintered compacts rose rapidly with sintering temperature up to 1,773 K, at which temperature the relative density was 94%. Above this temperature, the density rose only slightly with increasing sintering temperature. The borides of Ti and W were synthesized from mixed metal powders by this method. The type of boride formed and its composition depended on sintering temperature. Compacts sintered at lower temperatures consisted of WB{sub 2} and TiB{sub 2} phases, but at the highest sintering temperature, 2,173K, the main phase was (Ti, W, Cr)B{sub 2} solid solution, in which W and Cr were dissolved in TiB{sub 2}. There was also a very small amount of {beta}-(W, Ti, Cr)B phase. By annealing compact sintered at high temperature, the (Ti, W, Cr)B{sub 2} solid solution phase decomposed and the amount decreased. (author)

Structure of polyvalent metal halide melts

International Nuclear Information System (INIS)

Tosi, M.P.

1990-12-01

A short review is given of recent progress in determining and understanding the structure of molten halide salts involving polyvalent metal ions. It covers the following three main topics: (i) melting mechanisms and types of liquid structure for pure polyvalent-metal chlorides; (ii) geometry and stability of local coordination for polyvalent metal ions in molten mixtures of their halides with alkali halides; and (iii) structure breaking and electron localization on addition of metal to the melt. (author). 28 refs, 3 figs, 1 tab

Combustion synthesis of boride and other composites

International Nuclear Information System (INIS)

Halverson, D.C.; Lum, B.Y.; Munir, Z.A.

1989-01-01

This patent describes a self-sustaining combustion synthesis process for producing hard, tough, lightweight B 4 C/TiB 2 composites. It is based on the thermodynamic dependence of adiabatic temperature and product composition on the stoichiometry of the B 4 C and TiB 2 reactants. For lightweight products the composition must be relatively rich in the B 4 C component. B 4 C-rich composites are obtained by varying the initial temperature of the reactants. The product is hard, porous material whose toughness can be enhanced by filling the pores with aluminum or other metal phases using a liquid metal infiltration process. The process can be extended to the formation of other composites having a low exothermic component.0:008360his patent describes a neutron reactivity control system for a LWBR incorporating a stationary seed-blanket core arrangement. The core arrangement includes a plurality of contiguous hexagonal shaped regions. Each region has a central and a peripheral blanket area juxapositioned an annular seed area. The blanket areas contain thoria fuel rods while the annular seed area includes seed fuel rods and movable thoria shim control rods

Electron concentration and phase stability in NbCr2-based Laves phase alloys

Energy Technology Data Exchange (ETDEWEB)

Zhu, J.H.; Liaw, P.K. [Univ. of Tennessee, Knoxville, TN (United States). Dept. of Materials Science and Engineering; Liu, C.T. [Oak Ridge National Lab., TN (United States). Metals and Ceramics Div.

1997-05-12

Phase stability in NbCr{sub 2}-based transition-metal Laves phases was studied, based on the data reported for binary X-Cr, Nb-X, and ternary Nb-Cr-X phase diagrams. It was shown that when the atomic size ratios are kept identical, the average electron concentration factor, e/a, is the dominating factor in controlling the phase stability of NbCr{sub 2}-based transition-metal Laves phases. The e/a ratios for different Laves polytypes were determined as followed: with e/a < 5.76, the C15 structure is stabilized; at an e/a range of 5.88--7.53, the C14 structure is stabilized; with e/a > 7.65, the C15 structure is stabilized again. A further increase in the electron concentration factor (e/a > 8) leads to the disordering of the alloy. The electron concentration effect on the phase stability of Mg-based Laves phases and transition-metal A{sub 3}B intermetallic compounds is also reviewed and compared with the present observations in transition-metal Laves phases. In order to verify the e/a/phase stability relationship experimentally, additions of Cu (with e/a = 11) were selected to replace Cr in the NbCr{sub 2} Laves phase. Experimental results for the ternary Nb-Cr-Cu system are reported and discussed in terms of the correlation between the e/a ratio and phase stability in NbCr{sub 2}-based Laves phases. A new phase was found, which has an average composition of Nb-47Cr-3Cu. Within the solubility limit, the electron concentration and phase stability relationship is obeyed in the Nb-Cr-Cu system.

Stability investigations of zinc and cobalt precipitates immobilized by in situ bioprecipitation (ISBP) process

KAUST Repository

Satyawali, Yamini; Schols, Edo; Van Roy, Sandra; Dejonghe, Winnie; Diels, Ludo; Vanbroekhoven, Karolien

2010-01-01

In situ bioprecipitation (ISBP), which involves immobilizing the metals as precipitates (mainly sulphides) in the solid phase, is an effective method of metal removal from contaminated groundwater. This study investigated the stability of metal precipitates formed after ISBP in two different solid-liquid matrices (artificial and natural). The artificial matrix consisted of sand, Zn (200mgL-1), artificial groundwater and a carbon source (electron donor). Here the stability of the Zn precipitates was evaluated by manipulation of redox and pH. The natural system matrices included aquifer material and groundwater samples collected from three different metal (Zn and Co) contaminated sites and different carbon sources were provided as electron donors. In the natural matrices, metal precipitates stability was assessed by changing aquifer redox conditions, sequential extraction, and BIOMET® assay. The results indicated that, in the artificial matrix, redox manipulation did not impact the Zn precipitates. However the sequential pH change proved detrimental, releasing 58% of the precipitated Zn back into liquid phase. In natural matrices, the applied carbon source largely affected the stability of metal precipitates. Elemental analysis performed on the precipitates formed in natural matrix showed that the main elements of the precipitates were sulphur with Zn and Co. © 2010 Elsevier B.V.

Stability investigations of zinc and cobalt precipitates immobilized by in situ bioprecipitation (ISBP) process

KAUST Repository

Satyawali, Yamini

2010-09-01

In situ bioprecipitation (ISBP), which involves immobilizing the metals as precipitates (mainly sulphides) in the solid phase, is an effective method of metal removal from contaminated groundwater. This study investigated the stability of metal precipitates formed after ISBP in two different solid-liquid matrices (artificial and natural). The artificial matrix consisted of sand, Zn (200mgL-1), artificial groundwater and a carbon source (electron donor). Here the stability of the Zn precipitates was evaluated by manipulation of redox and pH. The natural system matrices included aquifer material and groundwater samples collected from three different metal (Zn and Co) contaminated sites and different carbon sources were provided as electron donors. In the natural matrices, metal precipitates stability was assessed by changing aquifer redox conditions, sequential extraction, and BIOMET® assay. The results indicated that, in the artificial matrix, redox manipulation did not impact the Zn precipitates. However the sequential pH change proved detrimental, releasing 58% of the precipitated Zn back into liquid phase. In natural matrices, the applied carbon source largely affected the stability of metal precipitates. Elemental analysis performed on the precipitates formed in natural matrix showed that the main elements of the precipitates were sulphur with Zn and Co. © 2010 Elsevier B.V.

Synthesis, Characterizations, and Applications of Metal-Ions Incorporated High Quality MCM-41 Catalysts

International Nuclear Information System (INIS)

Lim, Steven S.; Haller, Gary L.

2013-01-01

Various metal ions (transition and base metals) incorporated MCM-41 catalysts can be synthesized using colloidal and soluble silica with non-sodium involved process. Transition metal ion-typically V 5+ , Co 2+ , and Ni 2+ -incorporated MCM-41 catalysts were synthesized by isomorphous substitution of Si ions in the framework. Each incorporated metal ion created a single species in the silica framework, single-site solid catalyst, showing a substantial stability in reduction and catalytic activity. Radius of pore curvature effect was investigated with Co-MCM-41 by temperature programmed reduction (TPR). The size of metallic Co clusters, sub-nanometer, could be controlled by a proper reduction treatment of Co-MCM-41 having different pore size and the initial pH adjustment of the Co-MCM-41 synthesis solution. These small metallic clusters showed a high stability under a harsh reaction condition without serious migration, resulting from a direct anchoring of small metallic clusters to the partially or unreduced metal ions on the surface. After a complete reduction, partial occlusion of the metallic cluster surface by amorphous silica stabilized the particles against aggregations. As a probe reaction of particle size sensitivity, carbon single wall nanotubes (SWNT) were synthesized using Co-MCM-41. A metallic cluster stability test was performed by CO methanation using Co- and Ni-MCM-41. Methanol and methane partial oxidations were carried out with V-MCM-41, and the radius of pore curvature effect on the catalytic activity was investigated