Sample records for metal compounds formed

  1. Complexing in the systems of thorium tetrabromide-alkali metal bromide and structure of formed compounds

    International Nuclear Information System (INIS)

    Gershanovich, A.Ya.; Suglobova, I.G.


    Phase diagrams of the ThBr 4 -MBr binary systems (M=Na, K, Rb, Cs) are obtained using the methods of thermographic and X-ray phase analyses. Congruently melting compounds of the M 2 ThBr 6 form (M=K, Rb, Cs) with melting temperatures of 635, 650 and 680 deg C, respectively, and the NaThBr 5 decomposing in the solid phase reaction at 356 deg C, realized in the systems. The presence of eutectic points is established, their composition and melting temperatures are determined. Roentgenograms of all compounds prepared by the polycrystal method are obtained. K 2 ThBr 6 and Rb 2 ThBr 6 crystallize in the hexagonal crystal system (Rb 2 MnF 6 structure type) with 2 formula units in the lattice cell. The parameters of the K 2 ThBr 6 cell are a=0.752 nm, c=1.180 nm. The cell parameters of the Rb 2 ThBr 6 cell are a=0.758 nm, c=1.224 nm. The Cs 2 ThBr 6 has a pseudocubic tetragonal structure with 4 formula units in a cell. Parameters of the Cs 2 ThBr 6 cell are a=1.137 nm; c=1.069 nm [ru

  2. Highly water-soluble ruthenium(II terpyridine coordination compounds form stable adducts with blood-borne metal transporting proteins

    Directory of Open Access Journals (Sweden)

    Marija Nišavić


    Full Text Available Three coordination compounds of ruthenium(II, belonging to a recently synthesised series of water-soluble compounds of general formula mer-[Ru(L3(N-NCl]Cl, where L3 = 4'-chloro-2,2':6',2″-terpyridine (Cl-tpy, N-N = ethylenediamine (en, 1,2-diaminocyclohexane (dach or 2,2'-bipyridine (bpy, have shown strong binding to calf thymus DNA and moderate in vitro cytotoxicity towards cancer cell lines. Knowing that serum proteins play a crucial role in the transport and deactivation of ruthenium drugs, we have conducted a detailed study of their interactions with two major metal-transporting serum proteins, albumin and transferrin, and it is presented herein. Ruthenated protein adducts were formed with various concentrations of the three compounds and then separated from the unbound portions by ultrafiltration through 10 kDa cut-off centrifugal filter units. The stoichiometry of binding was determined using inductively coupled plasma optical emission spectrometry. One mol of albumin bound up to 7, 8.5 and 1.5 mol of compound 1 ([Ru(Cl-tpy(enCl][Cl], 2 ([Ru(Cl-tpy(dachCl][Cl] and 3 ([Ru(Cl-tpy(bpyCl][Cl], respectively. One mol of transferrin bound up to 3, 3.5 and 0.4 mol of 1, 2 and 3, respectively. The affinity of albumin and transferrin for the three ruthenium compounds was evaluated using fluorescence quenching. The binding constants for 1 and 2 lay within the range 104–105 M−1, suggesting moderate-to-strong attachment to albumin. Both compounds showed much lower affinity for transferrin (102–103 M−1. Compound 3 bound weakly to each studied protein. High resolution ESI qTOF mass spectra of albumin before and after binding of 1 revealed the high stoichiometry of binding. Although the binding of the compounds 1–3 to albumin and transferrin did not affect proteins’ secondary structure much, their tertiary structures underwent some alterations, as deduced from the circular dichroism study. Changes in the stability of albumin, after

  3. Interaction of intermetallic compounds formed by rare earths, scandium, yttrium and 3d-transition metals, with gaseous ammonia

    International Nuclear Information System (INIS)

    Shilkin, S.P.; Volkova, L.S.


    Interaction of the RT n intermetallic compounds, where R Sc, Y, rare earths, T = Fe, Co, Ni; n = 2,3,5, with gaseous ammonia under pressure of 1MPa and at temperatures of 293, 723 and 798 K is studied. It is established on the basis of roentgenographic studied, chemical analysis data, X-ray photoelectron spectroscopy and specific surface measurements that metallic matrixes of intermetallides decompose into nitrides and transition metal phases at temperatures of 723 and 798 K under effect of ammonia and independent of structural types of the source materials; partial or complete decomposition of intermetallides through ammonia with formation of transition metal mixture, binary hydrides and nitrides of the most electropositive metal the above systems occurs at the temperature of 293 K depending on the heat of the source compounds and their tendency to decomposition under ammonia effect

  4. Thin films of mixed metal compounds (United States)

    Mickelsen, R.A.; Chen, W.S.


    Disclosed is a thin film heterojunction solar cell, said heterojunction comprising a p-type I-III-IV[sub 2] chalcopyrite substrate and an overlying layer of an n-type ternary mixed metal compound wherein said ternary mixed metal compound is applied to said substrate by introducing the vapor of a first metal compound to a vessel containing said substrate from a first vapor source while simultaneously introducing a vapor of a second metal compound from a second vapor source of said vessel, said first and second metals comprising the metal components of said mixed metal compound; independently controlling the vaporization rate of said first and second vapor sources; reducing the mean free path between vapor particles in said vessel, said gas being present in an amount sufficient to induce homogeneity of said vapor mixture; and depositing said mixed metal compound on said substrate in the form of a uniform composition polycrystalline mixed metal compound. 5 figs.

  5. Micro metal forming

    CERN Document Server


    Micro Metal Forming, i. e. forming of parts and features with dimensions below 1 mm, is a young area of research in the wide field of metal forming technologies, expanding the limits for applying metal forming towards micro technology. The essential challenges arise from the reduced geometrical size and the increased lot size. In order to enable potential users to apply micro metal forming in production, information about the following topics are given: tribological behavior: friction between tool and work piece as well as tool wear mechanical behavior: strength and formability of the work piece material, durability of the work pieces size effects: basic description of effects occurring due to the fact, that the quantitative relation between different features changes with decreasing size process windows and limits for forming processes tool making methods numerical modeling of processes and process chains quality assurance and metrology All topics are discussed with respect to the questions relevant to micro...

  6. Metal forming and lubrication

    DEFF Research Database (Denmark)

    Bay, Niels


    Lubrication is essential in most metal forming processes. The lubricant film has two basic functions, [1]: i. to separate the work piece and tool surfaces and ii. to cool the workpiece and the tool. Separation of the two surfaces implies lower friction facilitating deformation and lowering the tool...

  7. Transition Metal Compounds Towards Holography

    Directory of Open Access Journals (Sweden)

    Volker Dieckmann


    Full Text Available We have successfully proposed the application of transition metal compounds in holographic recording media. Such compounds feature an ultra-fast light-induced linkage isomerization of the transition-metal–ligand bond with switching times in the sub-picosecond regime and lifetimes from microseconds up to hours at room temperature. This article highlights the photofunctionality of two of the most promising transition metal compounds and the photophysical mechanisms that are underlying the hologram recording. We present the latest progress with respect to the key measures of holographic media assembled from transition metal compounds, the molecular embedding in a dielectric matrix and their impressive potential for modern holographic applications.

  8. Advances in metal forming expert system for metal forming

    CERN Document Server

    Hingole, Rahulkumar Shivajirao


    This comprehensive book offers a clear account of the theory and applications of advanced metal forming. It provides a detailed discussion of specific forming processes, such as deep drawing, rolling, bending extrusion and stamping. The author highlights recent developments of metal forming technologies and explains sound, new and powerful expert system techniques for solving advanced engineering problems in metal forming. In addition, the basics of expert systems, their importance and applications to metal forming processes, computer-aided analysis of metalworking processes, formability analysis, mathematical modeling and case studies of individual processes are presented.


    Directory of Open Access Journals (Sweden)

    T. V. Koksharova


    Full Text Available The effect of anions on the structure and properties of coordination compounds of transition metals has been discussed. The examples of changes in the composition of the formed complexes by replacement of the anion are given: metal ratio to a neutral ligand, the composition of the inner sphere, the direction of template synthesis. Anions can determine the presence of isomers in complexes with different ligands. Examples of conformational, ionization isomerism, inner sphere bond isomerization are given. The nature of the coordination polyhedron is highly sensitive to the replacement of the anion too. Examples of coordination compounds where the anion change causes a change in coordination capacity of neutral ligands and the strength of their bonds with the metal, coordination number and geometry of the inner sphere, the organization of molecular structures (the structure of the hydrogen bond networks and the degree of polymerization, crystal packing. The anions significantly affect the binding of the solvent molecules, complexes magnetic and luminescent properties, they can change the compound color, the mechanisms of thermolysis. Anions make a very noticeable influence on possible redox processes following the complexation in some cases. Anions in the coordination sphere can change catalytic and biochemical processes as well as the ways of interaction of metal ions with drugs.

  10. Green Lubricants for Metal Forming

    DEFF Research Database (Denmark)

    Bay, Niels


    The increasing focus on legislation towards diminishing the impact on working environment as well as external environment has driven efforts to develop new, environmentally benign lubricants for metal forming. The present paper gives an overview of these efforts to substitute environmentally...

  11. Biologically active compounds of semi-metals. (United States)

    Rezanka, Tomás; Sigler, Karel


    Semi-metals (boron, silicon, arsenic and selenium) form organo-metal compounds, some of which are found in nature and affect the physiology of living organisms. They include, e.g., the boron-containing antibiotics aplasmomycin, borophycin, boromycin, and tartrolon or the silicon compounds present in "silicate" bacteria, relatives of the genus Bacillus, which release silicon from aluminosilicates through the secretion of organic acids. Arsenic is incorporated into arsenosugars and arsenobetaines by marine algae and invertebrates, and fungi and bacteria can produce volatile methylated arsenic compounds. Some prokaryotes can use arsenate as a terminal electron acceptor while others can utilize arsenite as an electron donor to generate energy. Selenium is incorporated into selenocysteine that is found in some proteins. Biomethylation of selenide produces methylselenide and dimethylselenide. Selenium analogues of amino acids, antitumor, antibacterial, antifungal, antiviral, anti-infective drugs are often used as analogues of important pharmacological sulfur compounds. Other metalloids, i.e. the rare and toxic tellurium and the radioactive short-lived astatine, have no biological significance.

  12. Modeling of the self-organization processes in crystal-forming systems. Tetrahedral metal clusters and the self-assembly of crystal structures of intermetallic compounds (United States)

    Ilyushin, G. D.


    A combinatorial and topological modeling of 1D, 2D, and 3D packings of symmetrically linked A4 tetrahedra has been performed. Three types of 1D chains with tetrahedra connectivities of 4, 6, and 8 were used to model 2D layers L-1, L-2, and L-3 and 3D frameworks FR-1, FR-2, FR-3, and FR-4. A family of tetrahedral structures with FR-1, FR-2, and FR-3 frameworks has been selected among the intermetallic compounds with chemical compositions of A 3 B, A 2 B 2, AB 3, A 2 BC, AB 2 C, and ABCD; this family includes more than 1900 compounds (TOPOS program package). It is found that the topological models of tetrahedral 3D frameworks are in correspondence with all types of the crystal structures formed in Au-Cu binary systems (FR-1 for Cu3Au (auricupride), Cu2Au2 (tetraauricupride), and CuAu3 (bogdanovite)), in the Mg-Cd system (FR-3 for Mg3Cd, Mg2Cd2, and MgCd3), in the Li-Hg system (FR-2 for Li3Hg and Li2Hg2 and FR-3 for LiHg3), in the Li-Ag-Al ternary system (FR-2 for LiAg2Al and Li2AgAl), and in the Li-Mg-Pd-Sn quaternary system (FR-2 for LiMgPdSn). Framework FR-4 has been established in ternary intermetallic compounds A(Li2Sn2); A = Cu, Ag, Au.

  13. Thin films of metal-organic compounds and metal nanoparticle

    Indian Academy of Sciences (India)

    Thin films of metal-organic compounds and metal nanoparticle-embedded polymers for nonlinear optical applications. S Philip Anthony Shatabdi Porel D ... Thin films based on two very different metal-organic systems are developed and some nonlinear optical applications are explored. A family of zinc complexes which ...

  14. Strategic surfaces in sheet metal forming

    DEFF Research Database (Denmark)

    Olsson, David Dam; Andreasen, Jan Lasson; Bay, Niels

    Out-line: Introduction to tribology in sheet metal forming Developed strategic surfaces Tribological testing of strategic surfaces Conclusion......Out-line: Introduction to tribology in sheet metal forming Developed strategic surfaces Tribological testing of strategic surfaces Conclusion...

  15. Extraction of complexes of metal ions with pyridine oxyazo compounds

    International Nuclear Information System (INIS)

    Lobanov, F.I.; Nurtaeva, G.K.; Ergozhin, E.E.


    Modern state and prospects of the development of investigas tions in the field of extraction of complexes of metal ions (V, In, Cd, Nb, REE, RU, Ta, U, Zr and others) with pyridine oxyazo compoUnds are analyzed. Application of pyridine oxyazo compounds as extraction-photometric reagents is described. Basic methods of oxyazo compounds preparation are considered along with reagent properties and physical-chemical characteristics. Flow diagrams of ion extraction are presented for the above metals. Mechanisms of complexing reactions for metal ions with pyridine oxyazo compounds and stability of forming complexes are considered in detail. Concrete methods of extraction-photometric separation and element determination permitting to find simultaneously several metal ions with similar properties in the case of their joint presence are described

  16. New Approach for Fractioning Metal Compounds Studies in Soils (United States)

    Minkina, Tatiana; Motuzova, Galina; Mandzhieva, Saglara; Bauer, Tatiana; Burachevskaya, Marina; Sushkova, Svetlana; Nevidomskaya, Dina; Kalinitchenko, Valeriy


    A combined approach for fractioning metal compounds in soils on the basis of sequential (Tessier, 1979) and parallel extractions (1 N NH4Ac, pH 8; 1% EDTA in NH4Ac; and 1N HCl) is proposed. Metal compounds in sequential and parallel extracts are grouped according to the strength of their bonds with soil components. A given group includes metal compounds with similar strengths of bonds and, hence, with similar migration capacities. The groups of firmly and loosely bound metal compounds can be distinguished. This approach has been used to assess the group composition of Zn, Cu, and Pb compounds in an ordinary chernozem and its changes upon the soil contamination with metals. Contamination of an ordinary chernozem from Rostov oblast with heavy metals caused a disturbance of the natural ratios between the metal compounds. In the natural soil, firmly bound metals predominate (88-95%of the total content), which is mainly caused by the fixation of metals in lattices of silicate minerals (56-83%of the total content). The mobility of the metals in the natural soil is low (5-12%) and is mainly related to metal compounds loosely bound with the soil carbonates. Upon the soil contamination with metals (application rates of 100-300 mg/kg), the content of all the metal compounds increases, but the ratio between them shifts towards a higher portion of the potentially mobile metal compounds (up to 30-40% of the bulk contents of the metals). Organic substances and non-silicate Fe, Al, and Mn minerals become the main carriers of the firmly and loosely bound metals. The strengths of their bonds with Cu, Pb, and Zn differ. Lead in the studied chernozems is mainly fixed in a loosely bound form with organic matter, whereas copper and zinc are fixed both by the organic matter and by the non-silicate Fe, Al, and Mn compounds. Firm fixation of the applied Cu and Pb is mainly ensured by the soil organic matter and non-silicate minerals, whereas firm fixation of Zn is mainly due to non

  17. A new lubricant carrier for metal forming

    DEFF Research Database (Denmark)

    Arentoft, Mogens; Bay, Niels; Tang, Peter Torben


    A lubricant carrier for metal forming processes is developed. Surfaces with pores of micrometer size for entrapping lubricant are generated by electrochemical deposition of an alloy, consisting of two immiscible metals, of which one metal subsequently is etched away leaving 5 mu m layers with a s...... extrusion at high reduction and excessive stroke comparing with conventionally lubrication using phosphate coating and soap....

  18. Raman scattering in transition metal compounds: Titanium and compounds of titanium

    Energy Technology Data Exchange (ETDEWEB)

    Jimenez, J.; Ederer, D.L.; Shu, T. [Tulane Univ., New Orleans, LA (United States)] [and others


    The transition metal compounds form a very interesting and important set of materials. The diversity arises from the many states of ionization the transition elements may take when forming compounds. This variety provides ample opportunity for a large class of materials to have a vast range of electronic and magnetic properties. The x-ray spectroscopy of the transition elements is especially interesting because they have unfilled d bands that are at the bottom of the conduction band with atomic like structure. This group embarked on the systematic study of transition metal sulfides and oxides. As an example of the type of spectra observed in some of these compounds they have chosen to showcase the L{sub II, III} emission and Raman scattering in some titanium compounds obtained by photon excitation.

  19. AI applications in sheet metal forming

    CERN Document Server

    Hussein, Hussein


    This book comprises chapters on research work done around the globe in the area of artificial intelligence (AI) applications in sheet metal forming. The first chapter offers an introduction to various AI techniques and sheet metal forming, while subsequent chapters describe traditional procedures/methods used in various sheet metal forming processes, and focus on the automation of those processes by means of AI techniques, such as KBS, ANN, GA, CBR, etc. Feature recognition and the manufacturability assessment of sheet metal parts, process planning, strip-layout design, selecting the type and size of die components, die modeling, and predicting die life are some of the most important aspects of sheet metal work. Traditionally, these activities are highly experience-based, tedious and time consuming. In response, researchers in several countries have applied various AI techniques to automate these activities, which are covered in this book. This book will be useful for engineers working in sheet metal industri...

  20. Studies of Metal-Metal Bonded Compounds in Catalysis

    Energy Technology Data Exchange (ETDEWEB)

    Berry, John [University of Wisconsin-Madison


    The focus in this grant period has been on the preparation and study of compounds containing two metals (M) and a reactive main group fragment (E) aligned in a M–M=E linear array. These structures contain multiple bonds that interconnect the M and E groups, and are structures that had been proposed, but never observed, before our work.

  1. Mechanochemical synthesis and characterisation of cocrystals and metal organic compounds. (United States)

    Tröbs, L; Emmerling, F


    The mechanochemical synthesis of two model compounds, a metal organic framework (H2Im)[Bi(1,4-bdc)2] (bdc = benzene dicarboxylate, H2Im = imidazole cation)) and a cocrystal (carbamazepine : indometacin 1 : 1) were followed ex situ using a combination of two analytical methods. Powder X-ray diffraction (XRD) and Raman spectroscopy data were evaluated for the synthesis of the metal organic framework. The XRD measurements and REM images were analysed for the synthesis of the cocrystal. The measurements revealed that both model compounds were synthesised within minutes. The metal organic framework (H2Im)[Bi(1,4-bdc)2] is synthesised via an intermediate structure. The cocrystal carbamazepine : indometacin 1 : 1 is formed within a few seconds. The crystallite size decreases during the further milling treatment.

  2. Lubricant failure in sheet metal forming processes

    NARCIS (Netherlands)

    van der Heide, Emile


    The application of tribology to sheet metal forming processes (SMF) contributes to a general industrial aim i.e., to make products of high quality at an increasingly competitive way, by enhancing the tool life and maintaining a constant level of friction during forming. Both aspects are served by

  3. Thin films of metal-organic compounds and metal nanoparticle ...

    Indian Academy of Sciences (India)

    Thin films based on two very different metal-organic systems are developed and some nonlinear optical applications are explored. A family of zinc complexes which form perfectly polar assemblies in their crystalline state are found to organize as uniaxially oriented crystallites in vapor deposited thin films on glass substrate.

  4. Mesoporous metal catalysts formed by ultrasound

    Energy Technology Data Exchange (ETDEWEB)

    Schaeferhans, Jana; Pazos Perez, Nicolas; Andreeva, Daria [Physikalische Chemie II, Universitaet Bayreuth (Germany)


    We study the ultrasound-driven formation of mesoporous metal sponges. The collapse of acoustic cavitations leads to very high temperatures and pressures on very short scales. Therefore, structures may be formed and quenched far from equilibrium. Mechanism of metal modification by ultrasound is complex and involves a variety of aspects. We propose that modification of metal particles and formation of mesoporous inner structures can be achieved due to thermal etching of metals by ultrasound stimulated high speed jets of liquid. Simultaneously, oxidation of metal surfaces by free radicals produced in water during cavitation stabilizes developed metal structures. Duration and intensity of the ultrasonication treatment is able to control the structure and morphology of metal sponges. We expect that this approach to the formation of nanoscale composite sponges is universal and opens perspective for a whole new class of catalytic materials that can be prepared in a one-step process. The developed method makes it possible to control the sponge morphology and can be used for formation of modern types of catalysts. For example, the sonication technique allows to combine the fabrication of mesoporous support and distribution of metal (Cu, Pd, Au, Pt etc.) nanoparticles in its pores into a single step.

  5. Ultrasonic imaging of sheet metal forming. (United States)

    Keitmann-Curdes, Oliver; Hansen, Christian; Knoll, Patrick; Meier, Horst; Ermert, Helmut


    With sheet metal hydroforming, a sheet metal is formed by a liquid medium under high pressure (up to 1000 bar) and a cavity contour (die). As the exact state of forming is of interest, an ultrasonic imaging system is under development. The task is to determine the geometry of a sheet metal contour with respect to the original (before forming) and the final (die) state of the sheet metal. For this purpose, two different contour reconstruction algorithms were designed, tested and compared. With the reconstruction results it will be possible to determine the optimal distribution of transmitters and receivers in the ultrasonic transducer matrix. Experiments were conducted with one pair of transducers (unfocussed, center frequency 2 MHz) and a three axis stepper motor set-up. For each experimental set of data, the contour was reconstructed with both SAFT reconstruction algorithms. Both algorithms incorporate a priori information such as original and final contour and maximal axial dislocation of the sheet metal. The results for both algorithms are compared and the relative mean error in axial direction is 0.30% and 0.48%.

  6. Characterization of fracture loci in metal forming

    DEFF Research Database (Denmark)

    Martins, P.A.F.; Bay, Niels; Tekkaya, A.E.


    Fracture in metal forming can occur in three different modes: (i) tensile; (ii) in-plane shear; and (iii) out-of-plane shear (respectively the same as modes I, II and III of fracture mechanics). The circumstances under which each mode will occur are identified in terms of plastic flow and microst...

  7. Advanced friction modeling in sheet metal forming

    NARCIS (Netherlands)

    Hol, J.; Cid Alfaro, M.V.; Meinders, Vincent T.; Huetink, Han


    The Coulomb friction model is frequently used for sheet metal forming simulations. This model incorporates a constant coefficient of friction and does not take the influence of important parameters such as contact pressure or deformation of the sheet material into account. This article presents a

  8. Failure by fracture in bulk metal forming

    DEFF Research Database (Denmark)

    Silva, C.M.A.; Alves, Luis M.; Nielsen, Chris Valentin


    This paper revisits formability in bulk metal forming in the light of fundamental concepts of plasticity,ductile damage and crack opening modes. It proposes a new test to appraise the accuracy, reliability and validity of fracture loci associated with crack opening by tension and out-of-plane shear...

  9. Metal Compression Forming of aluminum alloys and metal matrix composites

    Energy Technology Data Exchange (ETDEWEB)

    Viswanathan, S.; Ren, W.; Porter, W.D.; Brinkman, C.R.; Sabau, A.S.; Purgert, R.M.


    Metal Compression Forming (MCF) is a variant of the squeeze casting process, in which molten metal is allowed to solidify under pressure in order to close porosity and form a sound part. However, the MCF process applies pressure on the entire mold face, thereby directing pressure on all regions of the casting and producing a uniformly sound part. The process is capable of producing parts with properties close to those of forgings, while retaining the near net shape, complexity in geometry, and relatively low cost of the casting process.

  10. Forming of bulk metallic glass microcomponents

    DEFF Research Database (Denmark)

    Wert, John A.; Thomsen, Christian; Jensen, Rune Debel


    The present article considers forward extrusion, closed-die forging and backward extrusion processes for fabrication of individual microcomponents from two bulk metallic glass (BMG) compositions: Mg60Cu30Y10 and Zr44Cu40Ag8Al8. Two types of tooling were used in the present work: relatively massive...... die sets characteristic of cold forming operations for crystalline metals and lightweight die sets adapted to the special characteristics of BMGs. In addition to demonstrating that microcomponents of several geometries can be readily fabricated from BMGs, rheological properties are combined...

  11. Insertion compounds of transition-metal and uranium oxides

    International Nuclear Information System (INIS)

    Chippindale, A.M.; Dickens, P.G.; Powell, A.V.


    Several transition-metal and actinide oxides, in which the metal occurs in a high oxidation state, have open covalent structures and are capable of incorporating alkali and other electropositive metals under mild conditions to form insertion compounds A x MO n . These are solids which have several features in common: Over a range of compositions, A x MO n exists as one or more stable or metastable phases in which the structure of the parent oxide MO n is largely retained and the insertion element A is accommodated interstitially. Insertion is accompanied by a redox process A=A i . + e - M in which M is reduced and the electronic properties of the parent oxide change to those typical of a mixed-valence compound. The insertion process xA + MO n = A x MO n can be reversed, at least to some extent, by chemical or electrochemical reaction, with retention of structure (topotactic reaction). This review concentrates on methods of synthesis, characterisation, crystal structure and thermochemistry of these insertion compounds. It updates and extends previous work. (author)

  12. Sheet-bulk metal formingforming of functional components from sheet metals

    Directory of Open Access Journals (Sweden)

    Merklein Marion


    Full Text Available The paper gives an overview on the application of sheet-bulk metal forming operations in both scientific and industrial environment. Beginning with the need for an innovative forming technology, the definition of this new process class is introduced. The rising challenges of the application of bulk metal forming operations on sheet metals are presented and the demand on a holistic investigation of this topic is motivated. With the help of examples from established production processes, the latest state of technology and the lack on fundamental knowledge is shown. Furthermore, perspectives regarding new research topics within sheet-bulk metal forming are presented. These focus on processing strategies to improve the quality of functional components by the application of process-adapted semi-finished products as well as the local adaption of the tribological system.

  13. Trends and Visions in Metal Forming Tribology

    DEFF Research Database (Denmark)

    Bay, Niels


    Research and development in metal forming tribology is characterized by intensified focus on new tribo-systems such as new lubricants, tool materials and tool coatings in order to substitute environmentally hazardous lubricant systems. Other means to solve these problems include the development...... of structured work piece and tool surfaces to facilitate micro-hydro-dynamic lubrication. Increased knowledge on skin-pass rolling to establish structured sheet surfaces and new automatic polishing equipment to manufacture tailored tool surfaces are important means to improve tribo-conditions in severe forming...

  14. Lubricant Test Methods for Sheet Metal Forming

    DEFF Research Database (Denmark)

    Bay, Niels; Olsson, David Dam; Andreasen, Jan Lasson


    Sheet metal forming of tribologically difficult materials such as stainless steel, Al-alloys and Ti-alloys or forming in tribologically difficult operations like ironing, punching or deep drawing of thick plate requires often use of environmentally hazardous lubricants such as chlorinated paraffin...... oils in order to avoid galling. The present paper describes a systematic research in the development of new, environmentally harmless lubricants focusing on the lubricant testing aspects. A system of laboratory tests has been developed to study the lubricant performance under the very varied conditions...... appearing in different sheet forming operations such as stretch forming, deep drawing, ironing and punching. The laboratory tests have been especially designed to model the conditions in industrial production. Application of the tests for evaluating new lubricants before introducing them in production has...

  15. Neoclassical compounds and final combining forms in English

    Directory of Open Access Journals (Sweden)

    Ana Díaz-Negrillo


    Full Text Available English neoclassical compounds rely on a distinct vocabulary stock and present morphological features which raise a number of theoretical questions. Generalisations about neoclassical compounds are also problematic because the output is by no means homogeneous, that is, defining features of neoclassical compounds sometimes co-exist with features that are not prototypical of these formations. The paper looks at neoclassical compounds with a view to exploring patterns of morphological behaviour and development in this class of compounds. The approach is both synchronic and diachronic: it researches whether the morphological behaviour of recently formed compounds is different from that of earlier compounds and, if so, in which respects. This is assessed on data from the BNC with respect to some of the features that are cited in the literature as defining properties of neoclassical compounds, specifically, their internal configuration, the occurrence or not of a linking vowel, and their productivity.

  16. Colloidal forming of metal/ceramic composites

    Energy Technology Data Exchange (ETDEWEB)

    Sanchez-Herencia, A.J.; Gutierrez, C.A.; Millan, A.J.; Nieto, M.I.; Moreno, R. [Inst. de Ceramica y Vidrio, Madrid (Spain)


    Metal/Ceramic composites have very attractive properties as either structural or electronic materials. For certain applications, complex microstructures and shapes are required. Colloidal processing of ceramics has proved to provide better properties and allows to obtain near net complex shaped parts. However colloidal processing has not received a similar attention in powder metallurgy. This work deals with the colloidal approach to the forming of metallic and metal/ceramic composites in an aqueous medium. Rheological behavior of concentrated pure nickel, nickel/alumina and nickel/zirconia suspensions is studied and optimized for obtaining flat surfaces or near net shaped parts by tape casting and gel casting respectively. In each case the influence of the processing additives (acrylic binders for tape casting and carrageenans for gel casting) on the rheological behavior of the slurries is determined. Pure nickel and nickel/ceramic composites with different compositions have been prepared. Static and dynamic sintering studies were performed at different conditions in order to control the porosity and microstructure of the final bodies, which were characterized by optical microscopy. (orig.)

  17. Heterocycles by Transition Metals Catalyzed Intramolecular Cyclization of Acetylene Compounds

    International Nuclear Information System (INIS)

    Vizer, S.A.; Yerzhanov, K.B.; Dedeshko, E.C.


    Review shows the new strategies in the synthesis of heterocycles, having nitrogen, oxygen and sulfur atoms, via transition metals catalyzed intramolecular cyclization of acetylenic compounds on the data published at the last 30 years, Unsaturated heterocyclic compounds (pyrroles and pyrroline, furans, dihydro furans and benzofurans, indoles and iso-indoles, isoquinolines and isoquinolinones, aurones, iso coumarins and oxazolinone, lactams and lactones with various substitutes in heterocycles) are formed by transition metals, those salts [PdCl 2 , Pd(OAc) 2 , HgCl 2 , Hg(OAc) 2 , Hg(OCOCF 3 ) 2 , AuCl 3 ·2H 2 O, NaAuCl 4 ·2H 2 O, CuI, CuCl], oxides (HgO) and complexes [Pd(OAc) 2 (PPh 3 )2, Pd(PPh 3 ) 4 , PdCl 2 (MeCN) 2 , Pd(OAc ) 2 /TPPTS] catalyzed intramolecular cyclization of acetylenic amines, amides, ethers, alcohols, acids, ketones and βdiketones. More complex hetero polycyclic systems typical for natural alkaloids can to obtain similar. Proposed mechanisms of pyrroles, isoquinolines, iso indoles and indoles, benzofurans and iso coumarins, thiazolopyrimidinones formation are considered. (author)

  18. Forming and Bending of Metal Foams (United States)

    Nebosky, Paul; Tyszka, Daniel; Niebur, Glen; Schmid, Steven


    This study examines the formability of a porous tantalum foam, known as trabecular metal (TM). Used as a bone ingrowth surface on orthopedic implants, TM is desirable due to its combination of high strength, low relative density, and excellent osteoconductive properties. This research aims to develop bend and stretch forming as a cost-effective alternative to net machining and EDM for manufacturing thin parts made of TM. Experimentally, bending about a single axis using a wiping die was studied by observing cracking and measuring springback. It was found that die radius and clearance strongly affect the springback properties of TM, while punch speed, embossings, die radius and clearance all influence cracking. Depending on the various combinations of die radius and clearance, springback factor ranged from .70-.91. To examine the affect of the foam microstructure, bending also was examined numerically using a horizontal hexagonal mesh. As the hexagonal cells were elongated along the sheet length, elastic springback decreased. This can be explained by the earlier onset of plastic hinging occurring at the vertices of the cells. While the numerical results matched the experimental results for the case of zero clearance, differences at higher clearances arose due to an imprecise characterization of the post-yield properties of tantalum. By changing the material properties of the struts, the models can be modified for use with other open-cell metallic foams.

  19. Electrochemical corrosion testing of metal waste forms

    International Nuclear Information System (INIS)

    Abraham, D. P.; Peterson, J. J.; Katyal, H. K.; Keiser, D. D.; Hilton, B. A.


    Electrochemical corrosion tests have been conducted on simulated stainless steel-zirconium (SS-Zr) metal waste form (MWF) samples. The uniform aqueous corrosion behavior of the samples in various test solutions was measured by the polarization resistance technique. The data show that the MWF corrosion rates are very low in groundwaters representative of the proposed Yucca Mountain repository. Galvanic corrosion measurements were also conducted on MWF samples that were coupled to an alloy that has been proposed for the inner lining of the high-level nuclear waste container. The experiments show that the steady-state galvanic corrosion currents are small. Galvanic corrosion will, hence, not be an important mechanism of radionuclide release from the MWF alloys

  20. Internal shear cracking in bulk metal forming

    DEFF Research Database (Denmark)

    Christiansen, Peter; Nielsen, Chris Valentin; Bay, Niels Oluf


    This paper presents an uncoupled ductile damage criterion for modelling the opening and propagation of internal shear cracks in bulk metal forming. The criterion is built upon the original work on the motion of a hole subjected to shear with superimposed tensile stress triaxiality and its overall...... performance is evaluated by means of side-pressing formability tests in Aluminium AA2007-T6 subjected to different levels of pre-strain. Results show that the new proposed criterionis able to combine simplicity with efficiency for predicting the onset of fracture and the crack propagation path for the entire...... set of test cases regardless the amount of pre-strain derived from previous upsetting under near frictionless conditions. The new proposed criterion can be easily implemented in existing finite element programs and its scope of application allows extending previous work on the opening modes in surface...

  1. Inorganic insertion compounds under the form of Langmuir-Blodgett films

    International Nuclear Information System (INIS)

    Zylberajch, Claire


    As the study of organic or mineral compounds under the form of thin layers showed that they are displaying very original properties with respect to massive compounds, this research thesis reports a work which aimed at obtaining mineral conductive materials under the form of extremely thin layers, notably metallic sulfides of mercury and cadmium. Synthesis is performed in soft conditions within an organic matrix produced by using the Langmuir-Blodgett technique with successive diffusions of mineral reactants. Salt formation is monitored by infrared spectroscopy. Physical properties of these compounds have been studied by various techniques (UV, visible, and IR spectroscopy, linear dichroism, X ray diffraction, X ray photoelectron spectrometry, conduction, and so on). Structural and electronic properties of these extremely thin films confirm that metallic sulfides adopt a lamellar geometry with molecular thickness. Conductivity and photo-conductivity are interpreted by means of a conventional band diagram [fr

  2. Metal organic frameworks for removal of compounds from a fluid

    KAUST Repository

    Eddaoudi, Mohamed


    Embodiments provide a method of compound removal from a fluid. The method includes contacting one or more metal organic framework (MOF) compositions with a fluid and sorbing one or more compounds, such as CO2, H2S and condensable hydrocarbons. One or more of CO2, H2S and condensable hydrocarbons can be sorbed simultaneously or in series. The metal organic framework can be an M-soc-MOF.

  3. Effect of some metal-containing compounds and fertilizers on ...

    African Journals Online (AJOL)



    Jun 28, 2010 ... Department of Plant Production, Moghan Junior College of Agriculture, University of Mohaghegh-Ardabili, Ardabil, Iran. E-mail: ... percentage of the fungus mycelia growth due to metal containing compound at the inhibitory effect exhibited ... tolerance against metals and accumulates high amounts.

  4. Tribo-systems for Sheet Metal Forming

    DEFF Research Database (Denmark)

    Bay, Niels


    The present paper gives an overview of more than 10 years work by the author’s research group through participation in national as well as international framework programmes on developing and testing environmentally friendly lubricants and tool materials and coatings inhibiting galling. Partners ......’s research group has especially been involved in the development of a system of tribo-tests for sheet metal forming and in testing and modelling of friction and limits of lubrication of new, environmentally friendly lubricants and tool materials.......The present paper gives an overview of more than 10 years work by the author’s research group through participation in national as well as international framework programmes on developing and testing environmentally friendly lubricants and tool materials and coatings inhibiting galling. Partners...... in the programmes come from Germany, United Kingdom, Finland, Poland, Slovenia, Spain and Denmark. They represent lubricant developers, testing experts and industrial end users as well as numerical modelling experts simulating fundamental lubrication mechanisms and computing basic process parameters. The author...

  5. Ethylene hydrogenation over catalysts formed by oxidation of intermetallic compounds

    International Nuclear Information System (INIS)

    Imamura, H.; Wallace, W.E.


    The intermetallic compounds (LaNi 5 , CeNi 5 , PrNi 5 , ThNi 5 , ThFe 5 , and ThCo 5 ) readily react with oxygen. Examination of the oxidized materials by using x-ray diffraction showed that they consisted of a mixture of transition metal and rare earth oxide (or ThO 2 ). The transition metals exhibited particle sizes ranging from 90 to 350A, as estimated by x-ray diffraction line broadening. These mixtures exhibited high catalytic activity for the hydrogenation of ethylene compared to oxide-supported catalysts prepared by the conventional impregnation method, with turnover frequencies higher for the former materials by an order of magnitude. The oxidation process is a novel means of producing very active supported catalysts

  6. Forming processes and mechanics of sheet metal forming

    NARCIS (Netherlands)

    Burchitz, I.A.


    The report is dealing with the numerical analysis of forming processes. Forming processes is the large group of manufacturing processes used to obtain various product shapes by means of plastic deformations. The report is organized as follows. An overview of the deformation processes and the

  7. Compound forming extractants, solvating solvents and inert solvents IUPAC chemical data series

    CERN Document Server

    Marcus, Y; Kertes, A S


    Equilibrium Constants of Liquid-Liquid Distribution Reactions, Part III: Compound Forming Extractants, Solvating Solvents, and Inert Solvents focuses on the compilation of equilibrium constants of various compounds, such as acids, ions, salts, and aqueous solutions. The manuscript presents tables that show the distribution reactions of carboxylic and sulfonic acid extractants and their dimerization and other reactions in the organic phase and extraction reactions of metal ions from aqueous solutions. The book also states that the inorganic anions in these solutions are irrelevant, since they d

  8. Thin films of metal-organic compounds and metal nanoparticle ...

    Indian Academy of Sciences (India)

    Thin films based on two very different metal-organic systems are developed and some nonlinear optical ... capability of the nanoparticle-embedded polymer film is demonstrated. Keywords. Polar crystal; uniaxial ... systems promising candidates for a wide range of electronic, magnetic and optical applications. However ...

  9. Near net shape forming unsing semi-solid metal forming

    CSIR Research Space (South Africa)

    Govender, G


    Full Text Available is supplied in specific lengths , which means there would be additional scrap created by off cuts. • During reheating oxidation of the billet surface occurs therefore dies have to be designed to remove oxides during the forming process. • During... Absorption Process consistency 2005 Advantages of Using The SSM Forming Methods • High wall thicknesses and different wall thicknesses can be designed • Low gas porosity due to laminar filling and good airing • Low solidification porosity due...

  10. Crystal field in rare-earth metals and intermetallic compounds

    International Nuclear Information System (INIS)

    Ray, D.K.


    Reasons for the success of the crystal-field model for the rare-earth metals and intermetallic compounds are discussed. A review of some of the available experimental results is made with emphasis on cubic intermetallic compounds. Various sources of the origin of the crystal field in these metals are discussed in the background of the recent APW picture of the conduction electrons. The importance of the non-spherical part of the muffin-tin potential on the single-ion anisotropy is stressed. (author)

  11. Physical properties of some noble metal compounds from PAW-DFT ...

    African Journals Online (AJOL)

    The heats of formation, shear modulus, fracture toughness, density and melting points of compounds formed between some noble metals and aluminum, scandium, hafnium and zirconium were evaluated by the ab initio quantum mechanical projector augmented wave (PAW) calculation methods, using the Density ...

  12. Diagrams of the variations in the free energy of formation of metallic compounds (1960)

    International Nuclear Information System (INIS)

    Darras, R.; Loriers, H.


    The variations in the standard free energy ΔG produced during the formation of the principal simple metallic compounds have been calculated as a function of the temperature from recently published data, and are presented in convenient diagram form. Their usefulness in metallurgy is illustrated by some possible applications. (author) [fr

  13. Operation of a capacitor bank for plasma metal forming

    Indian Academy of Sciences (India) (Pulse Expt.)

    Abstract. Previously metal forming has been done using electromagnet in pulsed power mode, better known as magneform [1]. Here we will be presenting a different technique for metal forming. We are using water as a medium for this process. By discharging the stored electrical energy of the capacitor bank in water, we ...

  14. Review of friction modeling in metal forming processes

    DEFF Research Database (Denmark)

    Nielsen, C.V.; Bay, N.


    Abstract In metal forming processes, friction between tool and workpiece is an important parameter influencing the material flow, surface quality and tool life. Theoretical models of friction in metal forming are based on analysis of the real contact area in tool-workpiece interfaces. Several res...

  15. Overview of friction modelling in metal forming processes

    DEFF Research Database (Denmark)

    Nielsen, Chris Valentin; Bay, Niels Oluf


    In metal forming processes, friction between tool and workpiece is an important parameter influencing the material flow, surface quality and tool life. Theoretical models of friction in metal forming are based on analysis of the real contact area in tool-workpiece interfaces. Several research gro...

  16. Proficiency test for heavy metals in compound feed

    NARCIS (Netherlands)

    Pereboom, D.P.K.H.; Elbers, I.J.W.; Jong, de J.; Lee, van der M.K.; Nijs, de W.C.M.


    The here described proficiency test for heavy metals in compound feed was organised by RIKILT, Wageningen UR in accordance with ISO 17043. RIKILT Wageningen UR has an ISO/IEC 17043 accreditation for proficiency tests of residues in products of animal origin. However, this specific test is not part

  17. Covalent bonds against magnetism in transition metal compounds. (United States)

    Streltsov, Sergey V; Khomskii, Daniel I


    Magnetism in transition metal compounds is usually considered starting from a description of isolated ions, as exact as possible, and treating their (exchange) interaction at a later stage. We show that this standard approach may break down in many cases, especially in 4d and 5d compounds. We argue that there is an important intersite effect-an orbital-selective formation of covalent metal-metal bonds that leads to an "exclusion" of corresponding electrons from the magnetic subsystem, and thus strongly affects magnetic properties of the system. This effect is especially prominent for noninteger electron number, when it results in suppression of the famous double exchange, the main mechanism of ferromagnetism in transition metal compounds. We study this mechanism analytically and numerically and show that it explains magnetic properties of not only several 4d-5d materials, including Nb2O2F3 and Ba5AlIr2O11, but can also be operative in 3d transition metal oxides, e.g., in CrO2 under pressure. We also discuss the role of spin-orbit coupling on the competition between covalency and magnetism. Our results demonstrate that strong intersite coupling may invalidate the standard single-site starting point for considering magnetism, and can lead to a qualitatively new behavior.

  18. Trends and Visions in Metal Forming Tribology

    DEFF Research Database (Denmark)

    Bay, Niels


    of structured work piece and tool surfaces to facilitate micro-hydro-dynamic lubrication. Increased knowledge on skin-pass rolling to establish structured sheet surfaces and new automatic polishing equipment to manufacture tailored tool surfaces are important means to improve tribo-conditions in severe forming...... operations, which otherwise would require the use of environmentally hazardous lubricant systems. A methodology for prediction of limits of lubrication of new tribo-system for sheet forming production based on numerical modelling and off-line testing in dedicated simulative tribo-tests is proposed....

  19. Extreme extensibility of copper foil under compound forming conditions. (United States)

    Yu, Qingbo; Liu, Xianghua; Tang, Delin


    A copper foil with an extreme extensibility up to 43,684% was obtained without any intermediate annealing by means of asynchronous rolling with high tension. It was found that under the combination of compression, shearing and tension, the copper foil represents a wonderful phenomenon. As the reduction increases, the specimen hardness increases up to a peak value 138 HV0.05 when the foil thickness rolled to around 100 μm, and then it decreases down to 78 HV0.05 when the foil thickness rolled to the final size 19 μm. It tells us that the strain-softening effect occurs when the foil thickness is rolled down to a threshold level. The experimental results bring us some fresh ideas different with the traditional understanding on the strain-hardening mechanism of metals, which provides an experimental basis to establish the forming mechanism of the thin foil.

  20. Multi-scale friction modeling for sheet metal forming

    NARCIS (Netherlands)

    Hol, J.


    Finite element (FE) formability analyses are everyday practice in the metal-forming industry to reduce costs and lead time of new metal products. Although the predictive capabilities of FE software codes have improved significantly over the years, unfortunately, the experimental trial-and-error

  1. Metal Cationization Extractive Electrospray Ionization Mass Spectrometry of Compounds Containing Multiple Oxygens (United States)

    Swanson, Kenneth D.; Spencer, Sandra E.; Glish, Gary L.


    Extractive electrospray ionization is an ambient ionization technique that allows real-time sampling of liquid samples, including organic aerosols. Similar to electrospray ionization, the composition of the electrospray solvent used in extractive electrospray ionization can easily be altered to form metal cationized molecules during ionization simply by adding a metal salt to the electrospray solvent. An increase in sensitivity is observed for some molecules that are lithium, sodium, or silver cationized compared with the protonated molecule formed in extractive electrospray ionization with an acid additive. Tandem mass spectrometry of metal cationized molecules can also significantly improve the ability to identify a compound. Tandem mass spectrometry of lithium and silver cationized molecules can result in an increase in the number and uniqueness of dissociation pathways relative to [M + H]+. These results highlight the potential for extractive electrospray ionization with metal cationization in analyzing complex aerosol mixtures. [Figure not available: see fulltext.

  2. Environmentally Benign Tribo-systems for Metal Forming

    DEFF Research Database (Denmark)

    Bay, Niels; Azushima, A.; Groche, P.


    The growing awareness of environmental issues and the requirements to establish solutions diminishing the impact on working environment as well as external environment has initiated ever increasing efforts to develop new, environmentally benign tribological systems for metal forming. The present ...

  3. A comparison between optimisation algorithms for metal forming processes

    NARCIS (Netherlands)

    Bonte, M.H.A.; Do, D.T.D.; Fourment, L.; van den Boogaard, Antonius H.; Huetink, Han; Juster, N.; Rosochowski, A.


    Coupling optimisation algorithms to Finite Element (FEM) simulations is a very promisingway to achieve optimal metal forming processes. However, many optimisation algorithms exist and it is notclear which of these algorithms to use. This paper compares an efficient Metamodel Assisted

  4. Alkaline-earth metal compounds. Oddities and applications

    International Nuclear Information System (INIS)

    Harder, Sjoerd


    This book contains the following six topics: heavy alkaline-earth metal organometallic and metal organic chemistry: synthetic methods and properties (Ana Torvisco, Karin Ruhlandt-Senge); Heavier group 2 Grignard reagents of the type aryl-ae(l) n -x post-Grignard reagents (Matthias Westerhausen, Jens Langer, Sven Krieck, Reinald Fischer, Helmar Goerls, Mathias Koehler); stable molecular magnesium(I) dimers: A fundamentally appealing yet synthetically versatile compound class (Cameron Jones, Andreas Stasch); Modern developments in magnesium reagent chemistry for synthesis (Robert E. Mulvey, Stuart D. Robertson); Alkaline-earth metal complexes in homogeneous polymerization catalysis (Jean-Francois Carpentier, Yann Sarazin); homogeneous catalysis with organometallic complexes of group 2 (Mark R. Crimmin, Michael S. Hill); Chiral Ca, Sr and Ba-catalyzed asymmetric direct-type aldol, Michael, and Mannich and related reactions (Tetsu Tsubogo, Yasuhiro Yamashita, Shu- Kobayashi).

  5. Axial stress corrosion cracking forming method to metal tube

    International Nuclear Information System (INIS)

    Araki, Kumiko


    Generally, it is more difficult in a metal tube, to intentionally cause a stress corrosion cracking in axial direction than in circumferential direction. In the present invention, a bevel is formed on a metal tube and welding is conducted in circumferential direction along the bevel, and welding is conducted in axial direction partially to the portion welded in circumferential direction. Namely, a bevel is formed in circumferential direction to an abutting portion of thick-walled metal tubes with each other, welding is conducted in circumferential direction along the bevel, and welding is conducted in axial direction partially to a portion welded in circumferential direction. With such procedures, since tensile stress in the circumferential direction is increased partially at a portion welded in axial direction, stress corrosion cracking is caused in axial direction at the portion. Then, stress corrosion cracking in axial direction can thus be formed on the thick-walled metal tube. (N.H.)

  6. Automobile sheet metal part production with incremental sheet forming

    Directory of Open Access Journals (Sweden)

    İsmail DURGUN


    Full Text Available Nowadays, effect of global warming is increasing drastically so it leads to increased interest on energy efficiency and sustainable production methods. As a result of adverse conditions, national and international project platforms, OEMs (Original Equipment Manufacturers, SMEs (Small and Mid-size Manufacturers perform many studies or improve existing methodologies in scope of advanced manufacturing techniques. In this study, advanced manufacturing and sustainable production method "Incremental Sheet Metal Forming (ISF" was used for sheet metal forming process. A vehicle fender was manufactured with or without die by using different toolpath strategies and die sets. At the end of the study, Results have been investigated under the influence of method and parameters used.Keywords: Template incremental sheet metal, Metal forming

  7. 184 Compounding in Igala: Defining Criteria, Forms and Functions ...

    African Journals Online (AJOL)

    Ike Odimegwu

    linguistic generalizations. In Ígálà, in particular, not much attention has been devoted to describing compounding. The present study therefore investigates compounding in Igala, a. West Benue-Congo language spoken in north central Nigeria. Defining compoundhood and distinguishing compound words in Igala, the study ...

  8. Present status of production and utilization of rare earth metals and their compounds

    International Nuclear Information System (INIS)

    Al'perina, E.M.; Tsygankova, G.V.


    The status of raw material sources and production of rare earth metals and their compounds abroad is considered. Prices for rare earth raw materials, metals and their compounds are discussed. Special attention is paid to consumption of rare earth metals and their compounds and to perspectives of consumption growth

  9. Selective retention of basic compounds by metal aquo-ion affinity chromatography. (United States)

    Asakawa, Yoshiki; Yamamoto, Eiichi; Asakawa, Naoki


    A novel metal aquo-ion affinity chromatography has been developed for the analysis of basic compounds using heat-treated silica gel containing hydrated metal cations (metal aquo-ions) as the packing material. The packing materials of the metal aquo-ion affinity chromatography were prepared by the immobilization of a single metal component such as Fe(III), Al(III), Ag(I), and Ni(II) on silica gel followed by extensive heat treatment. The immobilized metals form aquo-ions to present cation-exchange ability for basic analytes and the cation-exchange ability for basic analytes depends on pKa of the immobilized metal species. In the present study, to evaluate the retention characteristics of metal aquo-ion affinity chromatography, the on-line solid-phase extraction of drugs was investigated. Obtained data clearly evidence the selective retention capability of metal aquo-ion affinity chromatography for basic analytes with sufficient capacity. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. A System of Test Methods for Sheet Metal Forming Tribology

    DEFF Research Database (Denmark)

    Bay, Niels; Olsson, David Dam; Andreasen, Jan Lasson


    Sheet metal forming of tribologically difficult materials such as stainless steel, Al-alloys and Ti-alloys or forming in tribologically difficult operations like ironing, punching or deep drawing of thick plate requires often use of environmentally hazardous lubricants such as chlorinated paraffin...

  11. Accounting for material scatter in sheet metal forming simulations

    NARCIS (Netherlands)

    Wiebenga, J.H.; Atzema, E.H.; Atzema, E.H.; Boterman, R.; Abspoel, M.; van den Boogaard, Antonius H.; Hora, P.


    Robust design of forming processes is gaining attention throughout the industry. To analyze the robustness of a sheet metal forming process using Finite Element (FE) simulations, an accurate input in terms of parameter variation is required. This paper presents a pragmatic, accurate and economic

  12. Precision analysis in billet preparation for micro bulk metal forming

    DEFF Research Database (Denmark)

    Mahshid, Rasoul; Hansen, Hans N.


    The purpose of this research is to fabricate billets for an automated transfer press for micro forming. High performance transfer presses are wellknown in conventional metal forming and distinguished from their automation and mass production. The press used in this research is a vertical mechanical...... analysis of the precision of the billets prepared by the tool....

  13. Redox-stimulated motion and bistability in metal complexes and organometallic compounds. (United States)

    Lomoth, Reiner


    Control over reversible changes to molecular structure forms the basis for artificial molecular machines that could eventually lead to the development of molecule-based nanotechnology. Particular applications in information storage and processing could emerge where the structural rearrangements give rise to bistability and molecular hysteresis effects. Oxidation-state-dependent coordination and bonding preferences in transition metal complexes and organometallic compounds provide a versatile approach to the control of molecular motions by redox input, but so far, few structural motifs have been applied in redox-actuated molecular machines. Further progress toward molecule-based nanoscale devices might be accomplished with molecular components derived from a wider range of structural themes and forms of molecular motion. Examples of redox-stimulated rearrangements in metal complexes and organometallic compounds are described that have been employed in molecular machines or could be considered for the design of new functional molecules.

  14. studies on transition metal complexes of herbicidal compounds. ii

    African Journals Online (AJOL)


    donor and it forms binuclear octahedral metal complexes, possessing alkoxide bridging. Cobalt(II) complex exhibits thermochromism. Antimicrobial studies on ..... coordination. N1 or N3 may be involved in this process (Figure 1) [18-20]. (iii) Positive shifts in ν(C-O) and ν(N-H) are strong indications of the participation of the.

  15. Method of forming a thin unbacked metal foil (United States)

    Duchane, David V.; Barthell, Barry L.


    In a method of forming a thin (foil having a desired curviplanar shape, a soluble polymeric film, preferably comprising polyvinyl alcohol, is formed on a supporting structure having a shape that defines the desired shape of the foil product. A layer of metal foil is deposited onto one side of the soluble film, preferably by vacuum vapor deposition. The metallized film is then immersed in a suitable solvent to dissolve the film and thereby leave the metal foil as an unbacked metal foil element mounted on the supporting structure. Aluminum foils less than 0.2 .mu.m (2,000 .ANG.) thick and having an areal density of less than 54 .mu.g/cm.sup.2 have been obtained.

  16. Structural disorder in metallic glass-forming liquids. (United States)

    Pan, Shao-Peng; Feng, Shi-Dong; Wang, Li-Min; Qiao, Jun-Wei; Niu, Xiao-Feng; Dong, Bang-Shao; Wang, Wei-Min; Qin, Jing-Yu


    We investigated structural disorder by a new structural parameter, quasi-nearest atom (QNA), in atomistic configurations of eight metallic glass-forming systems generated through molecular dynamics simulations at various temperatures. Structural analysis reveals that the scaled distribution of the number of QNA appears to be an universal property of metallic liquids and the spatial distribution of the number of QNA displays to be clearly heterogeneous. Furthermore, the new parameter can be directly correlated with potential energy and structural relaxation at the atomic level. Some straightforward relationships between QNA and other properties (per-atom potential energy and α-relaxation time) are introduced to reflect structure-property relationship in metallic liquids. We believe that the new structural parameter can well reflect structure disorder in metallic liquids and play an important role in understanding various properties in metallic liquids.

  17. Die Deformation Measurement System during Sheet Metal Forming (United States)

    Funada, J.; Takahashi, S.; Fukiharu, H.


    In order to reduce affection to the earth environment, it is necessary to lighten the vehicles. For this purpose, high tensile steels are applied. Because of high strength, high forming force is required for producing automotive sheet metal parts. In this situation, since the dies are elastic, they are deformed during forming parts. For reducing die developing period, sheet metal forming simulation is widely applied. In the numerical simulation, rigid dies are usually used for shortening computing time. It means that the forming conditions in the actual forming and the simulation are different. It will make large errors in the results between actual forming and simulation. It can be said that if contact pressure between dies and a sheet metal in the simulation can be reproduced in the actual forming, the differences of forming results between them can also been reduced. The basic idea is to estimate die shape which can produce the same distribution as computed from simulation with rigid dies. In this study, die deformation analyses with Finite Element Method as basic technologies are evaluated. For example, simple shape and actual dies elastic contact problems were investigated. The contact width between simple shape dies was investigated. The computed solutions were in good agreement with experimental results. The one case of the actual dies in two cases was also investigated. Bending force was applied to the blank holder with a mechanical press machine. The methodology shown with applying inductive displacement sensor for measuring die deformation during applying force was also proposed.

  18. Scale effects in metal-forming friction and lubrication

    DEFF Research Database (Denmark)

    Nielsen, Peter Søe; Paldan, Nikolas Aulin; Calaon, Matteo


    Downscaling of metal-forming operations from macro-to microscale implies significant changes caused by size effects. Among these, the friction increases as reported by researchers using indirect test methods such as the ring-compression test and double-cup-extrusion test. In this study, a new test...... equipment is developed for studies of the size effect in metal-forming friction in the range from macro-to microscale. Investigations confirm a significant friction increase when downscaling. Visual inspection of the workpieces shows this to be explained by the amount of open and closed lubricant pockets....

  19. Deposited Micro Porous Layer as Lubricant Carrier in Metal Forming

    DEFF Research Database (Denmark)

    Arentoft, Mogens; Bay, Niels; Tang, Peter Torben


    A new porous coating for carrying lubricant in metal forming processes is developed. The coating is established by simultaneous electrochemical deposition of two pure metals. One of them is subsequently etched away leaving a porous surface layer. Lubricant can be trapped in the pores acting...... as lubricant reservoirs. Conventional friction tests for cold forming; ring compression and double cup extrusion tests are carried out with Molykote DX paste and mineral oil as lubricant. Both lubricants act as intended for the ring compressions test whereas only the low viscosity oil perform successfully...

  20. Electrochemical Corrosion Studies for Modeling Metallic Waste Form Release Rates

    Energy Technology Data Exchange (ETDEWEB)

    Poineau, Frederic [Univ. of Nevada, Las Vegas, NV (United States); Tamalis, Dimitri [Florida Memorial Univ., Miami Gardens, FL (United States)


    The isotope 99Tc is an important fission product generated from nuclear power production. Because of its long half-life (t1/2 = 2.13 ∙ 105 years) and beta-radiotoxicity (β⁻ = 292 keV), it is a major concern in the long-term management of spent nuclear fuel. In the spent nuclear fuel, Tc is present as an alloy with Mo, Ru, Rh, and Pd called the epsilon-phase, the relative amount of which increases with fuel burn-up. In some separation schemes for spent nuclear fuel, Tc would be separated from the spent fuel and disposed of in a durable waste form. Technetium waste forms under consideration include metallic alloys, oxide ceramics and borosilicate glass. In the development of a metallic waste form, after separation from the spent fuel, Tc would be converted to the metal, incorporated into an alloy and the resulting waste form stored in a repository. Metallic alloys under consideration include Tc–Zr alloys, Tc–stainless steel alloys and Tc–Inconel alloys (Inconel is an alloy of Ni, Cr and iron which is resistant to corrosion). To predict the long-term behavior of the metallic Tc waste form, understanding the corrosion properties of Tc metal and Tc alloys in various chemical environments is needed, but efforts to model the behavior of Tc metallic alloys are limited. One parameter that should also be considered in predicting the long-term behavior of the Tc waste form is the ingrowth of stable Ru that occurs from the radioactive decay of 99Tc (99Tc → 99Ru + β⁻). After a geological period of time, significant amounts of Ru will be present in the Tc and may affect its corrosion properties. Studying the effect of Ru on the corrosion behavior of Tc is also of importance. In this context, we studied the electrochemical behavior of Tc metal, Tc-Ni alloys (to model Tc-Inconel alloy) and Tc-Ru alloys in acidic media. The study of Tc-U alloys has also been performed in order to better understand the

  1. Experimental evaluation of coating delamination in vinyl coated metal forming

    International Nuclear Information System (INIS)

    Son, Young Ki; Lee, Chan Joo; Kim, Byung Min; Lee, Jung Min; Byoen, Sang Doek; Lee, Soen Bong


    In this paper, a new evaluation and prediction method for coating delamination during sheet metal forming is presented. On the basis of the forming limit diagram (FLD), the current study evaluates the delamination of PET coating by using a cross cut specimen, dome test, and rectangular cup drawing test. Dome test specimens were subjected to biaxial, plane strain, and uniaxial deformation modes. Rectangular cup drawing test specimens were subjected to the deep drawing deformation mode, and compression deformation mode. A vinyl coated metal (VCM) sheet consists of three layers of polymer on the sheet metals: a protective film, a PET layer and a PVC layer. The areas with coating delamination were identified, and the results of the evaluation were plotted according to major and minor strain values, depicting coating delamination. The constructed delamination limit diagram (DLD) can be used to determine the forming limit of VCM during the complex press forming process. ARGUS (GOM) was employed to identify the strain value and deformation mode of the delaminated surface after the press forming. After identifying the areas of delamination, the DLD of the PET coating can be constructed in a format similar to that of the FLD. The forming limit of the VCM sheet can be evaluated using the superimposition of the delamination limit strain of the coating onto the FLD of VCM sheet. The experimental results showed that the proposed test method will support the sheet metal forming process design for VCM sheets. The assessment method presented in this study can be used to determine the delamination limit strain under plastic deformation of other polymer coated metals. The experimental results suggested that the proposed testing method is effective in evaluating delamination for specific applications

  2. Gas inflow and metallicity drops in star-forming galaxies (United States)

    Ceverino, Daniel; Sánchez Almeida, Jorge; Muñoz Tuñón, Casiana; Dekel, Avishai; Elmegreen, Bruce G.; Elmegreen, Debra M.; Primack, Joel


    Gas inflow feeds galaxies with low-metallicity gas from the cosmic web, sustaining star formation across the Hubble time. We make a connection between these inflows and metallicity inhomogeneities in star-forming galaxies, by using synthetic narrow-band images of the Hα emission line from zoom-in AMR cosmological simulations of galaxies with stellar masses of M* ≃ 109 M⊙ at redshifts z = 2-7. In ˜50 per cent of the cases at redshifts lower than 4, the gas inflow gives rise to star-forming, Hα-bright, off-centre clumps. Most of these clumps have gas metallicities, weighted by Hα luminosity, lower than the metallicity in the surrounding interstellar medium by ˜0.3 dex, consistent with observations of chemical inhomogeneities at high and low redshifts. Due to metal mixing by shear and turbulence, these metallicity drops are dissolved in a few disc dynamical times. Therefore, they can be considered as evidence for rapid gas accretion coming from cosmological inflow of pristine gas.

  3. Secondary electron emission from metals and semi-conductor compounds

    International Nuclear Information System (INIS)

    Ono, Susumu; Kanaya, Koichi


    Attempt was made to present the sufficient solution of the secondary electron yield of metals and semiconductor compounds except insulators, applying the free electron scattering theory to the absorption of secondary electrons generated within a solid target. The paper is divided into the sections describing absorption coefficient and escape depth, quantitative characteristics of secondary yield, angular distribution of secondary electron emission, effect of incident angle to secondary yield, secondary electron yield transmitted, and lateral distribution of secondary electron emission, besides introduction and conclusion. The conclusions are as follows. Based on the exponential power law for screened atomic potential, secondary electron emission due to both primary and backscattered electrons penetrating into metallic elements and semi-conductive compounds is expressed in terms of the ionization loss in the first collision for escaping secondary electrons. The maximum yield and the corresponding primary energy can both consistently be derived as the functions of three parameters: atomic number, first ionization energy and backscattering coefficient. The yield-energy curve as a function of the incident energy and the backscattering coefficient is in good agreement with the experimental results. The energy dependence of the yield in thin films and the lateral distribution of secondary yield are derived as the functions of the backscattering coefficient and the primary energy. (Wakatsuki, Y.)

  4. Algae form brominated organic compounds in surface waters

    Energy Technology Data Exchange (ETDEWEB)

    Huetteroth, A.; Putschew, A.; Jekel, M. [Tech. Univ. Berlin (Germany)


    Monitoring of organic halogen compounds, measured as adsorbable organic bromine (AOBr) revealed seasonal high concentrations of organic bromine compounds in a surface water (Lake Tegel, Berlin, Germany). Usually, in late summer, concentrations are up to five times higher than during the rest of the year. The AOBr of the lake inflows (throughout the year less then 6 {mu}g/L) were always lower then those in the lake, which indicates a production of AOBr in the lake. A correlation of the AOBr and chlorophyll-a concentration (1) in the lake provides first evidence for the influence of phototrophic organisms. The knowledge of the natural production of organohalogens is relatively recent. Up to now there are more then 3800 identified natural organohalogen compounds that have been detected in marine plants, animals, and bacteria and also in terrestrial plants, fungi, lichen, bacteria, insects, some higher animals, and humans. Halogenated organic compounds are commonly considered to be of anthropogenic origin; derived from e.g. pharmaceuticals, herbicides, fungicides, insecticides, flame retardants, intermediates in organic synthesis and solvents. Additionally they are also produced as by-products during industrial processes and by waste water and drinking water disinfection. Organohalogen compounds may be toxic, persistent and/or carcinogenic. In order to understand the source and environmental relevance of naturally produced organobromine compounds in surface waters, the mechanism of the formation was investigated using batch tests with lake water and algae cultures.

  5. Capabilities of Using Fem in Sheet-Metal Forming

    Directory of Open Access Journals (Sweden)

    Korga S.


    Full Text Available The aim of this study was to determine and select boundary conditions of modeling and FEM simulation for plastic processing on the example of sheet-metal forming. For sheet-metal deformation analysis, Deform 3D has been used. The study presents research methods for real and virtual conditions. There are also described common features and these differentiating obtained results. Research of conducted process of sheet-metal forming allows to determine the effectiveness of computer research methods. The finite-element method can be used as an effective tool for the study of plastic processing phenomena considering various operating conditions of individual elements provided the appropriate tools for FEM analysis.

  6. Studies on micro plasto hydrodymic lubrication in metal forming

    DEFF Research Database (Denmark)

    Bay, Niels; Bech, Jakob Ilsted; Andreasen, Jan Lasson


    The influence of work piece surface topography on friction and lubrication and final surface quality in metal forming operations is well known and has been pointed out by many researchers, see Schey (1983) and Bay and Wanheim (1990). This is especially the case when liquid lubrication is applied...... characterization models the potential entrapment of a lubricant in closed reservoirs is used as a parameter to predetermine the formability of a sheet metal, Steinhoff et al. (1996), Geiger et al. (1997) and Schmoeckel et al. (1997). In experimental studies on friction in metal forming applying the strip drawing...... test, Kudo et al. (1976 and 1982) discovered that the friction stress increased with the product of lubricant viscosity and drawing speed in the mixed lubrication regime. Mizuno and Okamoto (1982) noticed the same phenomenon in compression-sliding experiments, and proposed the explanation...

  7. Wrinkling in Sheet metal Forming: Experimental Testing vs. numerical Analysis

    NARCIS (Netherlands)

    Selman, A.; Atzema, Eisso H.; Meinders, Vincent T.; van den Boogaard, Antonius H.; Huetink, Han


    Following a number of publications on numerical prediction of wrinkling in thin sheet metal forming, the present part of our work is devoted to the comparison of numerical results with those obtained through experimental testing. A number of hemispherical product samples have been used with various

  8. Multi-stage metal forming: Variation and transformation

    NARCIS (Netherlands)

    Post, J.; Klaseboer, G.; Stinstra, E.; van Amstel, T.; Huetink, Han


    During precision forming of metal parts made of metastable austenitic stainless steels, the relationship between the scatter on the initial parameters like the strip thickness, yield stress, etc. on the product accuracy need to be known. This becomes complex if the material is instable, i.e.

  9. Operation of a capacitor bank for plasma metal forming

    Indian Academy of Sciences (India) (Pulse Expt.)

    range of workpiece to the desired shapes. The advantage of this method over conventional method is that it uses low power (negligible running cost). It does not require any post assembly cleaning degreasing and is hence environmentally 'friendly'. Keywords. Metal forming; capacitor bank; spark gap. PACS Nos 84.60.

  10. A comparison between optimisation algorithms for metal forming processes

    NARCIS (Netherlands)

    Bonte, M.H.A.; Do, T.T.; Fourment, L.; van den Boogaard, Antonius H.; Huetink, Han; Habbal, A.


    Coupling optimisation algorithms to Finite Element (FEM) simulations is a very promising way to achieve optimal metal forming processes. However, many optimisation algorithms exist and it is not clear which of these algorithms to use. This paper compares an efficient Metamodel Assisted Evolutionary

  11. Adaptive numerical analysis of wrinkling in sheet metal forming

    NARCIS (Netherlands)

    Selman, A.; Meinders, Vincent T.; van den Boogaard, Antonius H.; Huetink, Han


    Hutchinson approach has been successfully used by a number of researchers in thin sheet metal forming processes for wrinkling prediction. However, Hutchinson approach is limited to regions of the sheet that are free of any contact. Therefore, a new wrinkling indicator that can be used in the contact

  12. Epsilon metal waste form for immobilization of noble metals from used nuclear fuel (United States)

    Crum, Jarrod V.; Strachan, Denis; Rohatgi, Aashish; Zumhoff, Mac


    Epsilon metal (ɛ-metal), an alloy of Mo, Pd, Rh, Ru, and Tc, is being developed as a waste form to treat and immobilize the undissolved solids and dissolved noble metals from aqueous reprocessing of commercial used nuclear fuel. Epsilon metal is an attractive waste form for several reasons: increased durability relative to borosilicate glass, it can be fabricated without additives (100% waste loading), and in addition it also benefits borosilicate glass waste loading by eliminating noble metals from the glass, thus the processing problems related to their insolubility in glass. This work focused on the processing aspects of the epsilon metal waste form development. Epsilon metal is comprised of refractory metals resulting in high alloying temperatures, expected to be 1500-2000 °C, making it a non-trivial phase to fabricate by traditional methods. Three commercially available advanced technologies were identified: spark-plasma sintering, microwave sintering, and hot isostatic pressing, and investigated as potential methods to fabricate this waste form. Results of these investigations are reported and compared in terms of bulk density, phase assemblage (X-ray diffraction and elemental analysis), and microstructure (scanning electron microscopy).

  13. Some problems of synthesis of coordination compounds - the molecular predecessors of metal sulfides

    International Nuclear Information System (INIS)

    Larionov, S.V.


    Processes of metal sulfide preparations which require preliminary synthesis of coordination compounds o the metals (Cd, In, etc.) with organic sulfur-containing ligands have been considered. The promising trends in the synthesis are as follows: synthesis of chelate compounds and salts with rationally selected anions; synthesis of different-ligand compounds; synthesis of precursors for complex sulfides preparation. 14 refs

  14. Investigations in anhydrous liquid ammonia. Reaction of group 2, 4, 5, 11 metal and actinoids compounds

    International Nuclear Information System (INIS)

    Woidy, Patrick


    compounds led to the characterization of pentaammine complexes of the dioxidouranium cation which also was shown to form di-, tetra- or octanuclear networks via oxygen bridges. In the tetra- and octanuclear compounds, penta- and hexavalent uranyl cations seem to be present in one compound. The reactions of TiCl 3 and UF 4 and the reaction of Cs[UO 2 (NO 3 ) 3 ] and CuF 2 , yielded the new compounds [UF(NH 3 ) 8 ]Cl 3 . 3,5 NH 3 and Cs[UO 2 F 3 (NH 3 ) 2 ], respectively. Both compounds demonstrated on the one hand the possibility of the exchange of halides and on the other hand the ability to accept fluoride ions. Additionally, a new method for the synthesis of uranyl chloride is presented. Experiments regarding the solubility of metal halides of group 2, 4, and 5 of the periodic table yielded the ammonia complexes of [Ca(NH 3 ) 8 ]X 2 (X = Br and I), [Ti(NH 3 ) 8 ]Cl 3 . 6 NH 3 , and mer-[VF 3 (NH 3 ) 3 ]. Instead of the expected tetragonal antiprism for the eightfold coordinated Ca 2+ ion, a coordination polyhedron best described as a twofold capped trigonal prism and for the Ti 3+ ion an untypical eightfold coordination can be observed. Characterization of the novel compounds was carried out by single crystal and powder X-ray diffraction, infrared and Raman spectroscopy, thermogravimetry and mass spectrometry.

  15. Correlated effective field theory in transition metal compounds

    International Nuclear Information System (INIS)

    Mukhopadhyay, Subhasis; Chatterjee, Ibha


    temperature, stoichiometric composition. The magnetic properties of these compounds can be studied very well with the CEF theory. The physics of the insulating phase should definitely play an important role in these oxides which show metallic and superconducting behaviour as a function of doping in the parent compounds which are Mott insulators

  16. Electrostatic Selectivity of Volatile Organic Compounds Using Electrostatically Formed Nanowire Sensor. (United States)

    Mahapatra, Niharendu; Ben-Cohen, Avi; Vaknin, Yonathan; Henning, Alex; Hayon, Joseph; Shimanovich, Klimentiy; Greenspan, Hayit; Rosenwaks, Yossi


    For the past several decades, there is growing demand for the development of low-power gas sensing technology for the selective detection of volatile organic compounds (VOCs), important for monitoring safety, pollution, and healthcare. Here we report the selective detection of homologous alcohols and different functional groups containing VOCs using the electrostatically formed nanowire (EFN) sensor without any surface modification of the device. Selectivity toward specific VOC is achieved by training machine-learning based classifiers using the calculated changes in the threshold voltage and the drain-source on current, obtained from systematically controlled biasing of the surrounding gates (junction and back gates) of the field-effect transistors (FET). This work paves the way for a Si complementary metal-oxide-semiconductor (CMOS)-based FET device as an electrostatically selective sensor suitable for mass production and low-power sensing technology.

  17. U-based metallic glasses with superior glass forming ability (United States)

    Xu, Hongyang; Ke, Haibo; Huang, Huogen; Zhang, Pengguo; Pu, Zhen; Zhang, Pei; Liu, Tianwei


    By using Al as the third and B as the fourth but minor alloying elements for the U66.7Co33.3 basic metallic glass, a series of U-Co-Al(-B) alloys were designed. The quaternary U-Co-Al-B alloys exhibit significantly improved glass-forming ability (GFA) than previously reported U-based metallic glasses. Low fragility (∼24) is found for these new U-based metallic glasses. The improvement in GFA would result from denser atomic packing in the undercooled liquids due to the presence of small B atoms. Some U-Co-Al(-B) glasses showed corrosion resistance comparable to that of U64Co34Al2 glass, known for premium anti-corrosive performance among the unveiled U-based glasses.

  18. Anomalously metal-rich fluids form hydrothermal ore deposits. (United States)

    Wilkinson, Jamie J; Stoffell, Barry; Wilkinson, Clara C; Jeffries, Teresa E; Appold, Martin S


    Hydrothermal ore deposits form when metals, often as sulfides, precipitate in abundance from aqueous solutions in Earth's crust. Much of our knowledge of the fluids involved comes from studies of fluid inclusions trapped in silicates or carbonates that are believed to represent aliquots of the same solutions that precipitated the ores. We used laser ablation inductively coupled plasma mass spectrometry to test this paradigm by analysis of fluid inclusions in sphalerite from two contrasting zinc-lead ore systems. Metal contents in these inclusions are up to two orders of magnitude greater than those in quartz-hosted inclusions and are much higher than previously thought, suggesting that ore formation is linked to influx of anomalously metal-rich fluids into systems dominated by barren fluids for much of their life.


    International Nuclear Information System (INIS)

    Williamson, M.; Mickalonis, J.; Fisher, D.; Sindelar, R.


    Alloy waste form development under the Waste Forms Campaign of the DOE-NE Fuel Cycle Research and Development program includes the process development and characterization of an alloy system to incorporate metal species from the waste streams generated during nuclear fuel recycling. This report describes the tests and results from the FY10 activities to further investigate an Fe-based waste form that uses 300-series stainless steel as the base alloy in an induction furnace melt process to incorporate the waste species from a closed nuclear fuel recycle separations scheme. This report is focused on the initial activities to investigate the formation of oxyhydroxide layer(s) that would be expected to develop on the Fe-based waste form as it corrodes under aqueous repository conditions. Corrosion tests were used to evaluate the stability of the layer(s) that can act as a passivation layer against further corrosion and would affect waste form durability in a disposal environment.

  20. Formability models for warm sheet metal forming analysis (United States)

    Jiang, Sen

    Several closed form models for the prediction of strain space sheet metal formability as a function of temperature and strain rate are proposed. The proposed models require only failure strain information from the uniaxial tension test at an elevated temperature setting and failure strain information from the traditionally defined strain space forming limit diagram at room temperature, thereby featuring the advantage of offering a full forming limit description without having to carry out expensive experimental studies for multiple modes of deformation under the elevated temperature. The Power law, Voce, and Johnson-Cook hardening models are considered along with the yield criterions of Hill's 48 and Logan-Hosford yield criteria. Acceptable correlations between the theory and experiment are reported for all the models under a plane strain condition. Among all the proposed models, the model featuring Johnson-Cook hardening model and Logan-Hosford yield behavior (LHJC model) was shown to best correlate with experiment. The sensitivity of the model with respect to various forming parameters is discussed. This work is significant to those aiming to incorporate closed-form formability models directly into numerical simulation programs for the purpose of design and analysis of products manufactured through the warm sheet metal forming process. An improvement based upon Swift's diffuse necking theory, is suggested in order to enhance the reliability of the model for biaxial stretch conditions. Theory relating to this improvement is provided in Appendix B.


    Energy Technology Data Exchange (ETDEWEB)

    Kiridena, Vijitha [Ford Scientific Research Lab., Dearborn, MI (United States); Verma, Ravi [Boeing Research and Technology (BR& T), Seattle, WA (United States); Gutowski, Timothy [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States); Roth, John [Pennsylvania State Univ., University Park, PA (United States)


    The objective of this project is to develop a transformational RApid Freeform sheet metal Forming Technology (RAFFT) in an industrial environment, which has the potential to increase manufacturing energy efficiency up to ten times, at a fraction of the cost of conventional technologies. The RAFFT technology is a flexible and energy-efficient process that eliminates the need for having geometry-specific forming dies. The innovation lies in the idea of using the energy resource at the local deformation area which provides greater formability, process control, and process flexibility relative to traditional methods. Double-Sided Incremental Forming (DSIF), the core technology in RAFFT, is a new concept for sheet metal forming. A blank sheet is clamped around its periphery and gradually deformed into a complex 3D freeform part by two strategically aligned stylus-type tools that follow a pre-described toolpath. The two tools, one on each side of the blank, can form a part with sharp features for both concave and convex shapes. Since deformation happens locally, the forming force at any instant is significantly decreased when compared to traditional methods. The key advantages of DSIF are its high process flexibility, high energy-efficiency, low capital investment, and the elimination of the need for massive amounts of die casting and machining. Additionally, the enhanced formability and process flexibility of DSIF can open up design spaces and result in greater weight savings.

  2. Atomic layer deposition of metal tellurides and selenides using alkylsilyl compounds of tellurium and selenium. (United States)

    Pore, Viljami; Hatanpää, Timo; Ritala, Mikko; Leskelä, Markku


    Atomic layer deposition (ALD) of metal selenide and telluride thin films has been limited because of a lack of precursors that would at the same time be safe and exhibit high reactivity as required in ALD. Yet there are many important metal selenide and telluride thin film materials whose deposition by ALD might be beneficial, for example, CuInSe2 for solar cells and Ge2Sb2Te5 for phase-change random-access memories. Especially in the latter case highly conformal deposition offered by ALD is essential for high storage density. By now, ALD of germanium antimony telluride (GST) has been attempted only using plasma-assisted processes owing to the lack of appropriate tellurium precursors. In this paper we make a breakthrough in the development of new ALD precursors for tellurium and selenium. Compounds with a general formula (R3Si)2Te and (R3Si)2Se react with various metal halides forming the corresponding metal tellurides and selenides. As an example, we show that Sb2Te3, GeTe, and GST films can be deposited by ALD using (Et3Si)2Te, SbCl3, and GeCl2 x C4H8O2 compounds as precursors. All three precursors exhibit a typical saturative ALD growth behavior and GST films prepared at 90 degrees C show excellent conformality on a high aspect-ratio trench structure.

  3. Testing of environmentally friendly lubricants for sheet metal forming

    DEFF Research Database (Denmark)

    Bay, Niels; Olsson, David Dam; Andreasen, Jan Lasson


    the authors have especially been involved in the development of a system of test methods for sheet metal forming and in testing of friction and limits of lubrication of new, environmentally friendly lubricants. An overview of the developed tests is presented together with selected results....... Kingdom, Finland, Poland, Slovenia, Spain and Denmark. Partners in the programmes represent lubricant developers, testing experts and industrial end users as well as numerical modelling experts simulating fundamental lubrication mechanisms and computing basic process parameters. In these programmes...

  4. Liquid lubrication in sheet metal forming at mesoscopic scale

    DEFF Research Database (Denmark)

    Hubert, C.; Dubar, L.; Bay, Niels


    The lubricant entrapment and escape phenomena in metal forming are studied experimentally as well as numerically. Experiments are carried out in strip reduction of aluminium sheet applying a transparent die to study the fluid flow between mesoscopic cavities. The numerical strategy is based...... on a weak fluid/structure coupling involving the Finite Element Method and analytical calculations. It allows to quantify the final shape of the lubricant pockets...

  5. Basics of Sterile Compounding: Biopharmaceutics of Injectable Dosage Forms. (United States)

    Akers, Michael J


    Biopharmaceutics studies the relationship between the drug product and what happens after the product is administered. Since the majority of injectables are administered by the intravenous route, thus avoiding the need for drug absorption, not many articles are published compared to other routes of drug administration. However, other routes of administration for drug injection are becoming more frequent because of greater commercial availability of sustained- and controlled-release drug delivery systems. This article reviews basic principles of drug absorption, distribution, metabolism, and elimination of injectable drugs and certain physicochemical and physiological factors affecting injectable drug biopharmaceutics. Copyright© by International Journal of Pharmaceutical Compounding, Inc.

  6. Testing of Lubricant Performance in Sheet Metal Forming

    DEFF Research Database (Denmark)

    Bay, Niels; Olsson, David Dam; Friis, Kasper Leth


    Increasing focus on environmental issues in industrial production has urged a number of sheet metal forming companies to look for new tribo-systems in order to substitute hazardous lubricants such as chlorinated paraffin oils. The problems are especially pronounced, when forming tribologically...... and testing environmentally friendly lubricants and tool materials and coatings inhibiting galling. Partners in the programmes come from Germany, United Kingdom, Finland, Poland, Slovenia, Spain and Denmark. They represent lubricant developers, testing experts and industrial end users as well as numerical...

  7. Metal-free carbon-carbon bond-forming reductive coupling between boronic acids and tosylhydrazones. (United States)

    Barluenga, José; Tomás-Gamasa, María; Aznar, Fernando; Valdés, Carlos


    The formation of carbon-carbon bonds is a fundamental transformation in organic synthesis. In spite of the myriad methods available, advantageous methodologies in terms of selectivity, availability of starting materials, operational simplicity, functional-group tolerance, environmental sustainability and economy are in constant demand. In this context, the development of new cross-coupling reactions that use catalysts based on inexpensive and non-toxic metals is attracting increasing attention. Similarly, efficient processes that do not require a metal catalyst are of extraordinary interest. Here, we report a new and efficient metal-free carbon-carbon bond-forming coupling between tosylhydrazones and boronic acids. This reaction is very general and functional-group tolerant. As the required tosylhydrazones are easily generated from carbonyl compounds, it can be seen as a reductive coupling of carbonyls, a process of high synthetic relevance that requires several steps using other methodologies.

  8. Heavy metals processing near-net-forming summary progress report

    Energy Technology Data Exchange (ETDEWEB)

    Watson, L.D. [Custom Spray Technologies, Inc., Rigby, ID (United States); Thompson, J.E. [Martin Marietta Energy Systems, Inc., Oak Ridge, TN (United States)


    This study utilized a converging-diverging nozzle to spray-form an alloy having a weight percent composition of 49.6% iron, 49.6% tungsten, and 0.8% carbon into samples for analysis. The alloy was a surrogate that displayed metallurgical characteristics similar to the alloys used in the heavy metals processing industry. US DOE facilities are evaluating advanced technologies which can simplify component fabrication, reduce handling steps, and minimize final machining. The goal of producing net-shaped components can be approached from several directions. In spray forming, molten metal is converted by a nozzle into a plume of fine droplets which quickly cool in flight and solidify against a substrate. The near-final dimension product that is formed receives additional benefits from rapid solidification. This single-step processing approach would aid the heavy metals industry by streamlining fabrication, improving production yields, and minimizing the generation of processing wastes. This Program effort provided a large selection of as-sprayed specimens. These samples were sprayed with gas-to-metal mass ratios ranging from 0.8:1 to 4:1. Samples targeted for analysis were produced from different spray conditions. Metallography on some samples revealed areas that were fully dense and homogeneous at 5,000X. These areas averaged grain sizes of 1 micron diameter. Other samples when viewed at 2,000X were highly segregated in the 10 micron diameter range. Deposit efficiencies of greater than 90% were demonstrated using the untailored spray system. Discharge gases were analyzed and two categories of particles were identified. One category of particle had a chemical composition characteristic of the alloy being sprayed and the second type of particle had a chemical composition characteristic of the ceramics used in the spray system component fabrication. Particles ranged in size from 0.07 to 3 microns in diameter. 8 refs., 67 figs., 20 tabs.

  9. Novel Half-Metallic and Spin-Gapless Heusler Compounds (United States)

    Jin, Yunlong

    This thesis is devoted to experimental studies of Heusler compounds CoFeCrAl, CoFeCrX (X = Si, Ge) and Mn2PtSn. These Heusler alloys present an interesting class of ferromagnetic materials for spintronic applications since they are predicted to be spin gapless semiconductors and have half-metallic properties with 100 % spin polarization at the Fermi level. In this thesis, the structural, magnetic, spin-polarization and electron- transport properties of the fabricated alloys were studied. CoFeCrAl thin films deposited on MgO exhibit nearly perfect epitaxy and a high degree of L21 Heusler order. All considered types of chemical disorder destroy the spin-gapless semiconductivity of Y-ordered CoFeCrAl, but B2 disorder and A2-type Cr-Fe disorder conserve the half-metallicity of the alloy. The transport spin polarization at the Fermi level is higher than 68%. Epitaxial thin films of inverse tetragonal Mn2PtSn were synthesized and show lattice constants a = 0.449 nm, and b = 0.615 nm. Magnetization measurements revealed an in-plane anisotropy energy of 10 Merg/cm3. CoFeCrSi and CoFeCrGe Heusler alloys crystallize in cubic L21 structures with a small site disorder. The CoFeCrSi alloy exhibited a high Curie temperature (TC = 790 K). Cubic CoFeCrGe decomposed into other compounds near 402 °C (675 K). A new tetragonal Co53.4Fe30.4Cr8.6Ge 7.6 phase with lattice parameters a = 0.760 nm, c = 0.284 nm was studied with a series of tilted electron- diffraction measurements in this work. The (Co, Fe)-rich phase was found to embedded in the matrix of a Cr-rich phase. The results show promise for the implementation of CoFeCrX (X = Al, Si, Ge) and Mn2PtSn in future spintronics devices.

  10. From Steady-State To Cyclic Metal Forming Processes

    International Nuclear Information System (INIS)

    Montmitonnet, Pierre


    Continuous processes often exhibit a high proportion of steady state, and have been modeled with steady-state formulations for thirty years, resulting in very CPU-time efficient computations. On the other hand, incremental forming processes generally remain a challenge for FEM software, because of the local nature of deformation compared with the size of the part to be formed, and of the large number of deformation steps needed. Among them however, certain semi-continuous metal forming processes can be characterized as periodic, or cyclic. In this case, an efficient computational strategy can be derived from the ideas behind the steady-state models. This will be illustrated with the example of pilgering, a seamless tube cold rolling process

  11. Bulk forming of industrial micro components in conventional metals and bulk metallic glasses

    DEFF Research Database (Denmark)

    Arentoft, Mogens; Paldan, Nikolas Aulin; Eriksen, Rasmus Solmer


    For production of micro components in large numbers, forging is an interesting and challenging process. The conventional metals like silver, steel and aluminum often require multi-step processes, but high productivity and increased strength justify the investment. As an alternative, bulk metallic...... glasses will at elevated temperatures behave like a highly viscous liquid, which can easily form even complicated geometries in 1 step. The strengths and limitations of forming the 2 materials are analyzed for a micro 3D component in a silver alloy and an Mg-Cu-Y BMG. ©2007 American Institute of Physics...

  12. Synthesis and characterization of graphite-metal fluoride intercalation compounds

    Energy Technology Data Exchange (ETDEWEB)

    McQuillan, B.W.


    The compound C/sub x/AsF/sub 5/ was prepared and characterized by x-ray diffraction and x-ray absorption, which show the presence of As(III) and As(V), and the As-F bond distances are consistent with AsF/sub 3/ and AsF/sup -//sub 6/, C/sup +//sub 8/AsF/sup -//sub 6/ and C/sup +//sub 8/OsF/sup -//sub 6/ were synthesized. The C/sub x/AsF/sub 6/ and numerous standard arsenic-flourine compounds were studied by x-ray absorption. Magnetic susceptibility of C/sup +//sub 8/OsF/sup -//sub 6/ confirms the high degree of oxidation in this compound. X-ray absorption studies were begun to determine the species present within the graphite when BrF/sub 3/ or GeF/sub 4/ + F/sub 2/ are added. In the BrF/sub 3/ case, Br/sub 2/ is evolved and only Br(III) is present in the graphite. The binary phase diagram XeF/sub 2/:Xe/sup +//sub 5/AsF/sup -//sub 6/ was investigated by melting point determination and Raman spectroscopy. This mixture near 1.3:1 forms a kinetically stable glass at room temperature and is molten at 50/sup 0/C. Several new species or phases are observed in the Raman spectra. These species have been assigned tentative structures.

  13. Potential value of phosphate compounds in enhancing immobilization and reducing bioavailability of mixed heavy metal contaminants in shooting range soil. (United States)

    Seshadri, B; Bolan, N S; Choppala, G; Kunhikrishnan, A; Sanderson, P; Wang, H; Currie, L D; Tsang, Daniel C W; Ok, Y S; Kim, G


    Shooting range soils contain mixed heavy metal contaminants including lead (Pb), cadmium (Cd), and zinc (Zn). Phosphate (P) compounds have been used to immobilize these metals, particularly Pb, thereby reducing their bioavailability. However, research on immobilization of Pb's co-contaminants showed the relative importance of soluble and insoluble P compounds, which is critical in evaluating the overall success of in situ stabilization practice in the sustainable remediation of mixed heavy metal contaminated soils. Soluble synthetic P fertilizer (diammonium phosphate; DAP) and reactive (Sechura; SPR) and unreactive (Christmas Island; CPR) natural phosphate rocks (PR) were tested for Cd, Pb and Zn immobilization and later their mobility and bioavailability in a shooting range soil. The addition of P compounds resulted in the immobilization of Cd, Pb and Zn by 1.56-76.2%, 3.21-83.56%, and 2.31-74.6%, respectively. The reactive SPR significantly reduced Cd, Pb and Zn leaching while soluble DAP increased their leachate concentrations. The SPR reduced the bioaccumulation of Cd, Pb and Zn in earthworms by 7.13-23.4% and 14.3-54.6% in comparison with earthworms in the DAP and control treatment, respectively. Bioaccessible Cd, Pb and Zn concentrations as determined using a simplified bioaccessibility extraction test showed higher long-term stability of P-immobilized Pb and Zn than Cd. The differential effect of P-induced immobilization between P compounds and metals is due to the variation in the solubility characteristics of P compounds and nature of metal phosphate compounds formed. Therefore, Pb and Zn immobilization by P compounds is an effective long-term remediation strategy for mixed heavy metal contaminated soils. Copyright © 2017 Elsevier Ltd. All rights reserved.

  14. Metal protein attenuating compounds for the treatment of Alzheimer's dementia. (United States)

    Sampson, Elizabeth L; Jenagaratnam, Lydia; McShane, Rupert


    Alzheimer's dementia (AD) may be caused by the formation of extracellular senile plaques comprised of beta-amyloid (Aß). In vitro and mouse model studies have demonstrated that metal protein attenuating compounds (MPACs) promote the solubilisation and clearance of Aß. To evaluate the efficacy of metal protein attenuating compounds (MPACs) for the treatment of cognitive impairment due to Alzheimer's dementia. We searched ALOIS, the Cochrane Dementia and Cognitive Improvement Group Specialized Register, on 29 July 2010 using the terms: Clioquinol OR PBT1 OR PBT2 OR "metal protein" OR MPACS OR MPAC. Randomised double-blind trials in which treatment with an MPAC was administered to participants with Alzheimer's dementia in a parallel group comparison with placebo were included. Three review authors (RM, LJ, ELS) independently assessed the quality of trials according to the Cochrane Handbook for Systematic Reviews of Interventions.The primary outcome measure of interest was cognitive function (as measured by psychometric tests). The secondary outcome measures of interest were in the following areas: quality of life, functional performance, effect on carer, biomarkers, safety and adverse effects, and death. Two MPAC trials were identified. One trial compared clioquinol (PBT1) with placebo in 36 patients and 32 had sufficient data for per protocol analysis. There was no statistically significant difference in cognition (as measured on the Alzheimer's Disease Assessment Scale - Cognition (ADAS-Cog)) between the active treatment and placebo groups at 36 weeks. The difference in mean change from baseline ADAS-Cog score in the clioquinol arm compared with the placebo arm at weeks 24 and 36 was a difference of 7.37 (95% confidence interval (CI) 1.51 to 13.24) and 6.36 (95% CI -0.50 to 13.23), respectively.There was no significant impact on non-cognitive symptoms or clinical global impression. One participant in the active treatment group developed neurological symptoms

  15. A deformation mechanism of hard metal surrounded by soft metal during roll forming (United States)

    Yu, Hailiang; Tieu, A. Kiet; Lu, Cheng; Liu, Xiong; Godbole, Ajit; Li, Huijun; Kong, Charlie; Qin, Qinghua


    It is interesting to imagine what would happen when a mixture of soft-boiled eggs and stones is deformed together. A foil made of pure Ti is stronger than that made of Cu. When a composite Cu/Ti foil deforms, the harder Ti will penetrate into the softer Cu in the convex shapes according to previously reported results. In this paper, we describe the fabrication of multilayer Cu/Ti foils by the roll bonding technique and report our observations. The experimental results lead us to propose a new deformation mechanism for a hard metal surrounded by a soft metal during rolling of a laminated foil, particularly when the thickness of hard metal foil (Ti, 25 μm) is much less than that of the soft metal foil (Cu, 300 μm). Transmission Electron Microscope (TEM) imaging results show that the hard metal penetrates into the soft metal in the form of concave protrusions. Finite element simulations of the rolling process of a Cu/Ti/Cu composite foil are described. Finally, we focus on an analysis of the deformation mechanism of Ti foils and its effects on grain refinement, and propose a grain refinement mechanism from the inside to the outside of the laminates during rolling.

  16. Rare earth metal boron carbide MBC compounds containing monodimensional branched zigzag chains of non-metal atoms: Theoretical aspects

    International Nuclear Information System (INIS)

    Wiitkar, F.; Kahlal, S.; Halet, J.F.; Saillard, J.Y.


    The authors apply extended Hueckel calculations to solving the electronic structure of rare earth metal boron carbides. These compounds contain boron-carbon zigzag chains the structure of which is dictated by the ionic nature of the interaction between the chains and the rare earth metal. The authors report a relationship between formal charge of the BC units and structural orientation of the chains

  17. A Study of Deposition Coatings Formed by Electroformed Metallic Materials


    Hayashi, Shoji; Sugiyama, Shuta; Shimura, Kojiro; Tobayama, Go; Togashi, Toshio


    Major joining methods of dental casting metal include brazing and laser welding. However, brazing cannot be applied for electroformed metals since heat treatment could affect the fit, and, therefore, laser welding is used for such metals. New methods of joining metals that do not impair the characteristics of electroformed metals should be developed. When new coating is performed on the surface of the base metal, surface treatment is usually performed before re-coating. The effect of surface ...

  18. Porous silicon based anode material formed using metal reduction (United States)

    Anguchamy, Yogesh Kumar; Masarapu, Charan; Deng, Haixia; Han, Yongbong; Venkatachalam, Subramanian; Kumar, Sujeet; Lopez, Herman A.


    A porous silicon based material comprising porous crystalline elemental silicon formed by reducing silicon dioxide with a reducing metal in a heating process followed by acid etching is used to construct negative electrode used in lithium ion batteries. Gradual temperature heating ramp(s) with optional temperature steps can be used to perform the heating process. The porous silicon formed has a high surface area from about 10 m.sup.2/g to about 200 m.sup.2/g and is substantially free of carbon. The negative electrode formed can have a discharge specific capacity of at least 1800 mAh/g at rate of C/3 discharged from 1.5V to 0.005V against lithium with in some embodiments loading levels ranging from about 1.4 mg/cm.sup.2 to about 3.5 mg/cm.sup.2. In some embodiments, the porous silicon can be coated with a carbon coating or blended with carbon nanofibers or other conductive carbon material.

  19. Fine Coining of Bulk Metal Formed Parts in Digital Environment

    International Nuclear Information System (INIS)

    Pepelnjak, T.; Kuzman, K.; Krusic, V.


    At present the production of bulk metal formed parts in the automotive industry must increasingly fulfil demands for narrow tolerance fields. The final goal of the million parts production series is oriented towards zero defect production. This is possible by achieving production tolerances which are even tighter than the prescribed ones. Different approaches are used to meet this demanding objective affected by many process parameters. Fine coining as a final forming operation is one of the processes which enables the production of good manufacturing tolerances and high process stability. The paper presents the analyses of the production of the inner race and a digital evaluation of manufacturing tolerances caused by different material parameters of the workpiece. Digital optimisation of the fine coining with FEM simulations was performed in two phases. Firstly, fine coining of the inner racer in a digital environment was comparatively analysed with the experimental work in order to verify the accuracy and reliability of digitally calculated data. Secondly, based on the geometrical data of a digitally fine coined part, tool redesign was proposed in order to tighten production tolerances and increase the process stability of the near-net-shaped cold formed part

  20. Surface modification by metal ion implantation forming metallic nanoparticles in an insulating matrix

    International Nuclear Information System (INIS)

    Salvadori, M.C.; Teixeira, F.S.; Sgubin, L.G.; Cattani, M.; Brown, I.G.


    Highlights: • Metal nanoparticles can be produced through metallic ion implantation in insulating substrate, where the implanted metal self-assembles into nanoparticles. • The nanoparticles nucleate near the maximum of the implantation depth profile, that can be estimated by computer simulation using the TRIDYN. • Nanocomposites, obtained by this way, can be produced in different insulator materials. More specifically we have studied Au/PMMA (polymethylmethacrylate), Pt/PMMA, Ti/alumina and Au/alumina systems. • The nanocomposites were characterized by measuring the resistivity of the composite layer as function of the dose implanted, reaching the percolation threshold. • Excellent agreement was found between the experimental results and the predictions of the theory. - Abstract: There is special interest in the incorporation of metallic nanoparticles in a surrounding dielectric matrix for obtaining composites with desirable characteristics such as for surface plasmon resonance, which can be used in photonics and sensing, and controlled surface electrical conductivity. We have investigated nanocomposites produced by metal ion implantation into insulating substrates, where the implanted metal self-assembles into nanoparticles. The nanoparticles nucleate near the maximum of the implantation depth profile (projected range), which can be estimated by computer simulation using the TRIDYN code. TRIDYN is a Monte Carlo simulation program based on the TRIM (Transport and Range of Ions in Matter) code that takes into account compositional changes in the substrate due to two factors: previously implanted dopant atoms, and sputtering of the substrate surface. Our study show that the nanoparticles form a bidimentional array buried a few nanometers below the substrate surface. We have studied Au/PMMA (polymethylmethacrylate), Pt/PMMA, Ti/alumina and Au/alumina systems. Transmission electron microscopy of the implanted samples show that metallic nanoparticles form in

  1. Relation of forms of compounds of heavy natural radionuclides in soils

    International Nuclear Information System (INIS)

    Arkhipov, N.P.; Fedorova, T.A.; Fevraleva, L.T.


    Results of studying forms of 238 U, 232 Th, 226 Ra, 210 Po, 210 Pb compounds in nonfertilized soils (under control) and in soils fertilized with ammophos containing increased amount of the mentioned radionuclides are given. The study was performed in main-year field experiment with sandy ashen gray soil and leached chernozemic soil. It is shown that a main share of radionuclides in nonfertilized soils is presened with tightly bound compounds and compounds bound with sesquioxide compounds. After 5 years labelled natural radionuclides introduced into the ammophos composition are in a more mobile state as compared with radionuclides in nonfertilized soil and they are presented with acid-soluble and bound with humus compound forms. Systematical application of fertilizers during along-term period results in the concentration increase of heavy natural radionuclides in soil

  2. Bioavailability of heavy metals in soil: impact on microbial biodegradation of organic compounds and possible improvement strategies. (United States)

    Olaniran, Ademola O; Balgobind, Adhika; Pillay, Balakrishna


    Co-contamination of the environment with toxic chlorinated organic and heavy metal pollutants is one of the major problems facing industrialized nations today. Heavy metals may inhibit biodegradation of chlorinated organics by interacting with enzymes directly involved in biodegradation or those involved in general metabolism. Predictions of metal toxicity effects on organic pollutant biodegradation in co-contaminated soil and water environments is difficult since heavy metals may be present in a variety of chemical and physical forms. Recent advances in bioremediation of co-contaminated environments have focussed on the use of metal-resistant bacteria (cell and gene bioaugmentation), treatment amendments, clay minerals and chelating agents to reduce bioavailable heavy metal concentrations. Phytoremediation has also shown promise as an emerging alternative clean-up technology for co-contaminated environments. However, despite various investigations, in both aerobic and anaerobic systems, demonstrating that metal toxicity hampers the biodegradation of the organic component, a paucity of information exists in this area of research. Therefore, in this review, we discuss the problems associated with the degradation of chlorinated organics in co-contaminated environments, owing to metal toxicity and shed light on possible improvement strategies for effective bioremediation of sites co-contaminated with chlorinated organic compounds and heavy metals.

  3. Bioavailability of Heavy Metals in Soil: Impact on Microbial Biodegradation of Organic Compounds and Possible Improvement Strategies

    Directory of Open Access Journals (Sweden)

    Balakrishna Pillay


    Full Text Available Co-contamination of the environment with toxic chlorinated organic and heavy metal pollutants is one of the major problems facing industrialized nations today. Heavy metals may inhibit biodegradation of chlorinated organics by interacting with enzymes directly involved in biodegradation or those involved in general metabolism. Predictions of metal toxicity effects on organic pollutant biodegradation in co-contaminated soil and water environments is difficult since heavy metals may be present in a variety of chemical and physical forms. Recent advances in bioremediation of co-contaminated environments have focussed on the use of metal-resistant bacteria (cell and gene bioaugmentation, treatment amendments, clay minerals and chelating agents to reduce bioavailable heavy metal concentrations. Phytoremediation has also shown promise as an emerging alternative clean-up technology for co-contaminated environments. However, despite various investigations, in both aerobic and anaerobic systems, demonstrating that metal toxicity hampers the biodegradation of the organic component, a paucity of information exists in this area of research. Therefore, in this review, we discuss the problems associated with the degradation of chlorinated organics in co-contaminated environments, owing to metal toxicity and shed light on possible improvement strategies for effective bioremediation of sites co-contaminated with chlorinated organic compounds and heavy metals.

  4. Bioavailability of Heavy Metals in Soil: Impact on Microbial Biodegradation of Organic Compounds and Possible Improvement Strategies (United States)

    Olaniran, Ademola O.; Balgobind, Adhika; Pillay, Balakrishna


    Co-contamination of the environment with toxic chlorinated organic and heavy metal pollutants is one of the major problems facing industrialized nations today. Heavy metals may inhibit biodegradation of chlorinated organics by interacting with enzymes directly involved in biodegradation or those involved in general metabolism. Predictions of metal toxicity effects on organic pollutant biodegradation in co-contaminated soil and water environments is difficult since heavy metals may be present in a variety of chemical and physical forms. Recent advances in bioremediation of co-contaminated environments have focussed on the use of metal-resistant bacteria (cell and gene bioaugmentation), treatment amendments, clay minerals and chelating agents to reduce bioavailable heavy metal concentrations. Phytoremediation has also shown promise as an emerging alternative clean-up technology for co-contaminated environments. However, despite various investigations, in both aerobic and anaerobic systems, demonstrating that metal toxicity hampers the biodegradation of the organic component, a paucity of information exists in this area of research. Therefore, in this review, we discuss the problems associated with the degradation of chlorinated organics in co-contaminated environments, owing to metal toxicity and shed light on possible improvement strategies for effective bioremediation of sites co-contaminated with chlorinated organic compounds and heavy metals. PMID:23676353

  5. Catalytic olefin polymerization with early transition metal compounds

    NARCIS (Netherlands)

    Eshuis, Johan Jan Willem


    The catalysis of organic reactions by soluble metal complexes has become a major tool in synthesis, both in the laboratory and in the chemical industry. Processes catalyzed by transition metal complexes include carbonylation, olefin polymerization, olefin addition, olefin oxidation and alkane and

  6. Cross-linking proteins with bimetallic tetracarboxylate compounds of transition metals (United States)

    Kostic, N.M.; Chen, J.


    Stable cross-linked complexes of transition-metal tetracarboxylates and proteins are formed. The preferred transition-metal is rhodium. The protein may be collagen or an enzyme such as a proteolytic enzyme. No Drawings

  7. Application of humic compounds for remediation of soils contaminated with heavy metals: the benefits and risks (United States)

    Motuzova, Galina; Barsova, Natalia; Stepanov, Andrey; Kiseleva, Violetta; Kolchanova, Ksenia; Starkova, Irina; Karpukhin, Mikhail


    found to contain only 3-9% of copper. The content of free Cu2+ ions in the sample extract was negligible. The samples used for field experiments were tested in laboratory to estimate their sorption capacity for Cu. For this purpose, 300 g of substrate (loam and mixed organic substrate) with addition of water (control) and humic preparation (same dose as in the field experiment) were kept in the laboratory for 1 week. Soil samples were then dried and brought into equilibrium with the solution of copper sulfate at concentration of 50 mg/l. The concentration of copper in the solution in equilibrium with HC was 2.5-4 times higher than in the control variant; absorption of copper by solid phase decreased by 5-6%. Results of the laboratory study were in good agreement with the results of the field experiment. Addition of HC increased the content of soluble organic matter and copper complexation by an order of magnitude and thus reduced the activity of copper ions in the liquid phase that was treated as a possible remediation effect of the humic compound for plants and biota. However the increased total metal content mainly in a migration-capable form (negatively charged complexes with organic matter) may increase the risk of contaminating ground waters with heavy metals. Therefore, application of the artificial humic compounds for remediation of soils contaminated with heavy metals requires monitoring and further development of means to prevent their migration.

  8. Structure and bonding in metal-rich compounds: pnictides, chalcides and halides

    International Nuclear Information System (INIS)

    Franzen, H.F.


    The subject is reviewed under the following headings: introduction (compounds included in the review; purpose of the review); MX compounds with M = transition metal and X = O,N,S or P; sulfides and selenides of the transition metals; transition-metal phosphides; alkali oxides; transition-metal oxides and nitrides with X/M < 1; metal-rich halides; conclusion. The references number 238. Compounds of the following principal elements of nuclear interest are included in the tables and text: Am, Ce, Cs, Eu, Gd, Hf, La, Mo, Np, Nb, Pu, Pr, Pa, Re, Ru, Sc, Ta, Tb, Th, W, U, V, Y, Zr. The information in the tables is presented under: structure type, space group, lattice parameters and remarks. (U.K.)

  9. Form Four Students' Misconceptions in Electrolysis of Molten Compounds and Aqueous Solutions (United States)

    Bong, Anita Yung Li; Lee, Tien Tien


    The purpose of this study is to identify the Form Four students' misconceptions in the electrolysis of molten compounds and aqueous solutions. The respondents were 60 Form Four students from two secondary schools in Sibu, Sarawak. The two instruments used in this study were an open-ended electrochemistry assessment and interview protocol. This…

  10. A Study of Deposition Coatings Formed by Electroformed Metallic Materials.

    Directory of Open Access Journals (Sweden)

    Shoji Hayashi

    Full Text Available Major joining methods of dental casting metal include brazing and laser welding. However, brazing cannot be applied for electroformed metals since heat treatment could affect the fit, and, therefore, laser welding is used for such metals. New methods of joining metals that do not impair the characteristics of electroformed metals should be developed. When new coating is performed on the surface of the base metal, surface treatment is usually performed before re-coating. The effect of surface treatment is clinically evaluated by peeling and flex tests. However, these testing methods are not ideal for deposition coating strength measurement of electroformed metals. There have been no studies on the deposition coating strength and methods to test electroformed metals. We developed a new deposition coating strength test for electroformed metals. The influence of the negative electrolytic method, which is one of the electrochemical surface treatments, on the strength of the deposition coating of electroformed metals was investigated, and the following conclusions were drawn: 1. This process makes it possible to remove residual deposits on the electrodeposited metal surface layer. 2. Cathode electrolysis is a simple and safe method that is capable of improving the surface treatment by adjustments to the current supply method and current intensity. 3. Electrochemical treatment can improve the deposition coating strength compared to the physical or chemical treatment methods. 4. Electro-deposition coating is an innovative technique for the deposition coating of electroformed metal.


    Energy Technology Data Exchange (ETDEWEB)

    Hobbs, D.


    Sodium titanates are ion-exchange materials that effectively bind a variety of metal ions over a wide pH range. Sodium titanates alone have no known adverse biological effects but metal-exchanged titanates (or metal titanates) can deliver metal ions to mammalian cells to alter cell processes in vitro. In this work, we test a hypothesis that metal-titanate compounds inhibit bacterial growth; demonstration of this principle is one prerequisite to developing metal-based, titanate-delivered antibacterial agents. Focusing initially on oral diseases, we exposed five species of oral bacteria to titanates for 24 h, with or without loading of Au(III), Pd(II), Pt(II), and Pt(IV), and measuring bacterial growth in planktonic assays through increases in optical density. In each experiment, bacterial growth was compared with control cultures of titanates or bacteria alone. We observed no suppression of bacterial growth by the sodium titanates alone, but significant (p < 0.05, two-sided t-tests) suppression was observed with metal-titanate compounds, particularly Au(III)-titanates, but with other metal titanates as well. Growth inhibition ranged from 15 to 100% depending on the metal ion and bacterial species involved. Furthermore, in specific cases, the titanates inhibited bacterial growth 5- to 375-fold versus metal ions alone, suggesting that titanates enhanced metal-bacteria interactions. This work supports further development of metal titanates as a novel class of antibacterials.

  12. Geometrical structure factors of the crystal-field coefficients in ionic and metallic cubic compounds

    International Nuclear Information System (INIS)

    Adam, S.; Adam, G.; Corciovei, A.


    The crystal-field Hamiltonian for cubic compounds is brought into the standard form of the crystal-field theory by a general symmetrization technique which uses point group considerations only. The obtained crystal-field coefficients are expressed as products between those given by Hutchings and some geometrical structure factors, which include the relative contribution of all the neighbouring ions to the crystal-field. Assuming point charges in vacuum, numerical values are reported for the geometrical structure factors of several cubic structures and significant departures from Hutchings' results are found in some cases. Then, the screening effect of the conduction electrons in cubic metallic structures is investigated supposing a screened Coulomb interionic potential. (author)

  13. Ring-closure reactions of 1,2-diaza-4,5-benzoheptatrienyl metal compounds: experiment and theory. (United States)

    Kleine, Tillmann; Bergander, Klaus; Fröhlich, Roland; Wibbeling, Birgit; Würthwein, Ernst-Ulrich


    2-Alkenylbenzylidene hydrazones 5a-m, which are accessible in good to excellent yields in a four-step synthesis, are converted into 1,2-diaza-4,5-benzoheptatrienyl metal compounds 1a-m by treatment with KO-t-Bu as base. These metal compounds undergo the various types of reactions in good yields and exclusively depending on the nature of substituents R(1) and R(3). Thus, metal compounds 1a-c carrying alkyl substituents R(1) and R(3) form 3H-benzodiazepines 6a-c after electrophilic quench of the intermediate cyclic anion 7 in a 7-endo-trig electrocyclic reaction with a möbius aromatic transition structure 1(-)-TS. Similarly, a benzothienyl derivative 5n is converted into diazepine 6d. Potassium compounds 1d-h, which are N-methyl and aryl substituted at R(3), form 1,2-dihydrophthalazines 8a-e in a predominantly charge-controlled 6-exo-trig cyclization reaction. In contrast, aryl-aryl-substituted systems 5i-m did not lead to cyclic products upon deprotonation, but the intermediate open-chain metal compounds 1i-m were trapped by acid chlorides at N1 to yield the hydrazides 10a-e. We interpret thermodynamics and kinetics of these reactions in the context of the Baldwin rules on the basis of quantum chemical calculations and discuss the transition structures considering the results of NICS and NBO-charge calculations. Examples of the products 6, 8, and 10 could be characterized by X-ray diffraction.

  14. 50 years of superbases made from organolithium compounds and heavier alkali metal alkoxides

    Czech Academy of Sciences Publication Activity Database

    Lochmann, Lubomír; Janata, Miroslav


    Roč. 12, č. 5 (2014), s. 537-548 ISSN 1895-1066 R&D Projects: GA ČR GAP106/12/0844 Institutional support: RVO:61389013 Keywords : superbases * heavier alkali metal compounds * lithium-heavier alkali metal interchange Subject RIV: CD - Macromolecular Chemistry Impact factor: 1.329, year: 2013

  15. Modeling corrosion and constituent release from a metal waste form

    International Nuclear Information System (INIS)

    Bauer, T. H.; Fink, J. K.; Abraham, D. P.; Johnson, I.; Johnson, S. G.; Wigeland, R. A.


    Several ANL ongoing experimental programs have measured metal waste form (MWF) corrosion and constituent release. Analysis of this data has initiated development of a consistent and quantitative phenomenology of uniform aqueous MWF corrosion. The effort so far has produced a preliminary fission product and actinide release model based on measured corrosion rates and calibrated by immersion test data for a 90 C J-13 and concentrated J-13 solution environment over 1-2 year exposure times. Ongoing immersion tests of irradiated and unirradiated MWF samples using more aggressive test conditions and improved tracking of actinides will serve to further validate, modify, and expand the application base of the preliminary model-including effects of other corrosion mechanisms. Sample examination using both mechanical and spectrographic techniques will better define both the nature and durability of the protective barrier layer. It is particularly important to assess whether the observations made with J-13 solution at 900 C persist under more aggressive conditions. For example, all the multiplicative factors in Table 1 implicitly assume the presence of protective barriers. Under sufficiently aggressive test conditions, such protective barriers may very well be altered or even eliminated

  16. Extraction of metals using supercritical fluid and chelate forming ligand

    International Nuclear Information System (INIS)

    Wai, C.M.; Laintz, K.E.


    A method of extracting metalloid and metal species from a solid or liquid material by exposing the material to a supercritical fluid solvent containing a chelating agent is described. The chelating agent forms chelates that are soluble in the supercritical fluid to allow removal of the species from the material. In preferred embodiments, the extraction solvent is supercritical carbon dioxide and the chelating agent is a fluorinated β-diketone. In especially preferred embodiments the extraction solvent is supercritical carbon dioxide, and the chelating agent comprises a fluorinated β-diketone and a trialkyl phosphate, or a fluorinated β-diketone and a trialkylphosphine oxide. Although a trialkyl phosphate can extract lanthanides and actinides from acidic solutions, a binary mixture comprising a fluorinated β-diketone and a trialkyl phosphate or a trialkylphosphine oxide tends to enhance the extraction efficiencies for actinides and lanthanides. The method provides an environmentally benign process for removing contaminants from industrial waste without using acids or biologically harmful solvents. The method is particularly useful for extracting actinides and lanthanides from acidic solutions. The chelate and supercritical fluid can be regenerated, and the contaminant species recovered, to provide an economic, efficient process. 7 figs

  17. Extraction of metal ions by melts of chelate-forming reagents

    International Nuclear Information System (INIS)

    Lobanov, F.I.; Leonov, V.A.; Stefanov, A.V.; Gibalo, I.M.


    Extraction has been studied of some ions of 4B and 5B subgroup metals (Zr,Hf,Nb and Ta) with the use of melts of chelate-forming reagents (8-oxyquinoline, benzoylacetone, dibenzoylmethane) depending on various factors: hydrogen ion concentration, metal ion, reagent, masking compounds and the ratio between phases. It has been established that in the case of extraction with a melt of 8-oxyquinoline under optimum extraction conditions (pH=5-6) zirconium, hafnium, niobium, and tantalum are extracted quantitatively (to 1.10 -8 g-at/l); extraction with melts of benzoylacetone and dibenzoylmethane yields zirconium, hafnium, and niobium in amounts to nx10 -6 g-at/l. The study of the effect of complexing compounds has shown that tartaric acid does not affect the extraction of Zr,Hf,Nb and Ta; oxalic acid inhibits the extraction of Hf and Ta and does not affect the extraction of Nb. Citric acid does not affect the extraction of Hf, Nb, Ta and somewhat decreases the extraction of Zr

  18. Composition and topology of activity cliff clusters formed by bioactive compounds. (United States)

    Stumpfe, Dagmar; Dimova, Dilyana; Bajorath, Jürgen


    The assessment of activity cliffs has thus far mostly focused on compound pairs, although the majority of activity cliffs are not formed in isolation but in a coordinated manner involving multiple active compounds and cliffs. However, the composition of coordinated activity cliff configurations and their topologies are unknown. Therefore, we have identified all activity cliff configurations formed by currently available bioactive compounds and analyzed them in network representations where activity cliff configurations occur as clusters. The composition, topology, frequency of occurrence, and target distribution of activity cliff clusters have been determined. A limited number of large cliff clusters with unique topologies were identified that were centers of activity cliff formation. These clusters originated from a small number of target sets. However, most clusters were of small to moderate size. Three basic topologies were sufficient to describe recurrent activity cliff cluster motifs/topologies. For example, frequently occurring clusters with star topology determined the scale-free character of the global activity cliff network and represented a characteristic activity cliff configuration. Large clusters with complex topology were often found to contain different combinations of basic topologies. Our study provides a first view of activity cliff configurations formed by currently available bioactive compounds and of the recurrent topologies of activity cliff clusters. Activity cliff clusters of defined topology can be selected, and from compounds forming the clusters, SAR information can be obtained. The SAR information of activity cliff clusters sharing a/one specific activity and topology can be compared.

  19. Technologies for Extracting Valuable Metals and Compounds from Geothermal Fluids

    Energy Technology Data Exchange (ETDEWEB)

    Harrison, Stephen [SIMBOL Materials


    Executive Summary Simbol Materials studied various methods of extracting valuable minerals from geothermal brines in the Imperial Valley of California, focusing on the extraction of lithium, manganese, zinc and potassium. New methods were explored for managing the potential impact of silica fouling on mineral extraction equipment, and for converting silica management by-products into commercial products.` Studies at the laboratory and bench scale focused on manganese, zinc and potassium extraction and the conversion of silica management by-products into valuable commercial products. The processes for extracting lithium and producing lithium carbonate and lithium hydroxide products were developed at the laboratory scale and scaled up to pilot-scale. Several sorbents designed to extract lithium as lithium chloride from geothermal brine were developed at the laboratory scale and subsequently scaled-up for testing in the lithium extraction pilot plant. Lithium The results of the lithium studies generated the confidence for Simbol to scale its process to commercial operation. The key steps of the process were demonstrated during its development at pilot scale: 1. Silica management. 2. Lithium extraction. 3. Purification. 4. Concentration. 5. Conversion into lithium hydroxide and lithium carbonate products. Results show that greater than 95% of the lithium can be extracted from geothermal brine as lithium chloride, and that the chemical yield in converting lithium chloride to lithium hydroxide and lithium carbonate products is greater than 90%. The product purity produced from the process is consistent with battery grade lithium carbonate and lithium hydroxide. Manganese and zinc Processes for the extraction of zinc and manganese from geothermal brine were developed. It was shown that they could be converted into zinc metal and electrolytic manganese dioxide after purification. These processes were evaluated for their economic potential, and at the present time Simbol

  20. Electronic and thermodynamic properties of transition metal elements and compounds

    International Nuclear Information System (INIS)

    Haeglund, J.


    This thesis focuses on the use of band-structure calculations for studying thermodynamic properties of solids. We discuss 3d-, 4d- and 5d-transition metal carbides and nitrides. Through a detailed comparison between theoretical and experimental results, we draw conclusions on the character of the atomic bonds in these materials. We show how electronic structure calculations can be used to give accurate predictions for bonding energies. Part of the thesis is devoted to the application of the generalized gradient approximation in electronic structure calculations on transition metals. For structures with vibrational disorder, we present a method for calculating averaged phonon frequencies without using empirical information. For magnetic excitations, we show how a combined use of theoretical results and experimental data can yield information on magnetic fluctuations at high temperatures. The main results in the thesis are: Apart for an almost constant shift, theoretically calculated bonding energies for transition metal carbides and nitrides agree with experimental data or with values from analysis of thermochemical information. The electronic spectrum of transition metal carbides and nitrides can be separated into bonding, antibonding and nonbonding electronic states. The lowest enthalpy of formation for substoichiometric vanadium carbide VC 1-X at zero temperature and pressure occurs for a structure containing vacancies (x not equal to 0). The generalized gradient approximation improves theoretical calculated cohesive energies for 3d-transition metals. Magnetic phase transitions are sensitive to the description of exchange-correlation effects in electronic structure calculations. Trends in Debye temperatures can be successfully analysed in electronic structure calculations on disordered lattices. For the elements, there is a clear dependence on the crystal structure (e.g., bcc, fcc or hcp). Chromium has fluctuating local magnetic moments at temperatures well above

  1. Development of Replacements for Phoscoating Used in Forging, Extrusion and Metal Forming Processes

    Energy Technology Data Exchange (ETDEWEB)

    Kerry Barnett


    Many forging, extrusion, heading and other metal forming processes use graphite-based lubricants, phosphate coatings, and other potentially hazardous or harmful substances to improve the tribology of the metal forming process. The application of phosphate-based coatings has long been studied to determine if other synthetic ''clean'' lubricants could provide the same degree of protection afforded by phoscoatings and its formulations. So far, none meets the cost and performance objectives provided by phoscoatings as a general aid to the metal forming industry. In as much as phoscoatings and graphite have replaced lead-based lubricants, the metal forming industry has had previous experience with a legislated requirement to change processes. However, without a proactive approach to phoscoating replacement, many metal forming processes could find themselves without a cost effective tribology material necessary for the metal forming process

  2. Evaluation of some organic compounds on bloodstream forms of Trypanosoma cruzi

    Directory of Open Access Journals (Sweden)

    João S. Silva


    Full Text Available Accidental transmission of Chagas' disease to man by blood transfusion is a serious problem in Latin-America. This paper describes the testing of several synthetic, semi-synthetic, and natural compounds for their activity against blood trypomastigotes in vitro at 4-C. The compounds embody several types of chemical structures: benzoquinone, naphthoquinone, anthracenequinone, phenanthrenequinone, imidazole, piperazine, quinoline, xanthene, and simple benzenic and naphthalenic derivates. Some of them are for the first time tested against Trypanosoma cruzi. The toxic effect these compounds on this parasite was done by two quite distinct sets of experiments. In one set, the compounds were added to infected blood as ethanolic solution. In this situation the most active one was a furan-1, 2-naphthoquinone, in the same range as gentian violet, a new fact to be considered in the assessment of structure-activity relationships in this class of compounds. In other set, we tentatively evaluated the biological activity of water insoluble compounds by adding them in a pure form without solvent into infected blood. In this way some appear to be very active and it was postulated that the effectiveness of such compounds must result from interactions between them and specific blood components.

  3. Cure and mechanical properties of carboxylated nitrile rubber (XNBR) vulcanized by alkaline earth metal compounds (United States)

    Tulyapitak, Tulyapong

    Compounds of carboxylated nitrile rubber (XNBR) with alkaline metal oxides and hydroxide were prepared, and their cure and mechanical properties were investigated. Magnesium oxide (MgO) with different specific surface areas (45, 65, and 140 m2/g) was used. Increased specific surface area and concentration of MgO resulted in higher cure rate. Optimum stiffness, tensile strength, and ultimate strain required an equimolar amount of acidity and MgO. The effect of specific surface area on tensile properties was not significant. Crosslink density of XNBR-MgO vulcanizates increased with increased amounts of MgO. ATR-IR spectroscopy showed that neutralization occurs in two steps: (1) During mixing and storage, MgO reacts with carboxyl groups (RCOOH) to give RCOOMgOH. (2) Upon curing, these react bimolecularly to form RCOOMgOOCR and Mg(OH)2. Dynamic mechanical thermal analysis revealed an ionic transition at higher temperature, in addition to the glass transition. The ionic transition shifts to higher temperature with increasing MgO concentration. Like MgO-XNBR systems, cure rates of XNBR-calcium hydroxide (Ca(OH)2) and XNBR-barium oxide (BaO) compounds increased with increased content of curing agents. Curing by these two agents resulted in ionic crosslinks. To ensure optimum tensile properties, equimolar amounts of carboxyl groups and curing agents were required. Dynamic mechanical analysis revealed the ionic transition in these two systems. It shifted to higher temperature with increased amounts of curing agents. In contrast to MgO, Ca(OH)2, and BaO, calcium oxide (CaO) gave results similar to those for thermally cured samples. No ionic transition was observed in XNBR-CaO systems. Tensile strength of XNBR depended on the strength of ionic crosslinks, which was dependent on the size of the alkaline metal ions.

  4. Perspectives from ab-initio and tight-binding: Applications to transition metal compounds and superlattices (United States)

    Venkataraman, Vijay Shankar

    The experimental and theoretical study of transition metal compounds have occupied condensed matter physicists for the best part of the last century. The rich variety of physical behaviour exhibited by these compounds owes its origin to the subtle balance of the energy scales at play for the d orbitals. In this thesis, we study three different systems comprised of transition metal atoms from the third, the fourth, and the fifth group of the periodic table using a combination of ab-initio density functional theory (DFT) computations and effective tight-binding models for the electronic properties. We first consider the electronic properties of artificially fabricated perovskite superlattices of the form [(SrIrO3)m / SrTiO3] with integer m denoting the number of layers of SrIrO3. After discussing the results of experiments undertaken by our collaborators, we present the results of our DFT calculations and build tight-binding models for the m = 1 and m = 2 superlattices. The active ingredient is found to be the 5d orbitals with significant spin-orbit coupling. We then study the energies of magnetic ground states within DFT and compare and contrast our results with those obtained for the bulk Ruddlesden-Popper iridates. Together with experimental measurements, our results suggest that these superlattices are an exciting venue to probe the magnetism and metal-insulator transitions that occur from the intricate balance of the spin-orbit coupling and electron interactions, as has been reported for their bulk counterparts. Next, we consider alpha-RuCl3, a honeycomb lattice compound. We first show using DFT calculations in conjunction with experiments performed by our collaborators, how spin-orbit coupling in the 4d orbitals of Ru is essential to understand the insulating state realized in this compound. Then, in the latter half of the chapter, we study the magnetic ground states of a two-dimensional analogue of alpha-RuCl3 in weak and strong-coupling regimes obtained from

  5. Electrical resistivity of NaPb compound-forming liquid alloy using ab ...

    Indian Academy of Sciences (India)

    The study of electrical resistivity of compound-forming liquid alloy, NaPb, is presented as a function of concentration. Hard sphere diameters of Na and Pb are obtained through the interionic pair potentials evaluated using Troullier and Martins ab initio pseudopotential, which have been used to calculate the partial structure ...

  6. Molten metal reactor and method of forming hydrogen, carbon monoxide and carbon dioxide using the molten alkaline metal reactor (United States)

    Bingham, Dennis N.; Klingler, Kerry M.; Turner, Terry D.; Wilding, Bruce M.


    A molten metal reactor for converting a carbon material and steam into a gas comprising hydrogen, carbon monoxide, and carbon dioxide is disclosed. The reactor includes an interior crucible having a portion contained within an exterior crucible. The interior crucible includes an inlet and an outlet; the outlet leads to the exterior crucible and may comprise a diffuser. The exterior crucible may contain a molten alkaline metal compound. Contained between the exterior crucible and the interior crucible is at least one baffle.

  7. Carbon based secondary compounds do not provide protection against heavy metal road pollutants in epiphytic macrolichens. (United States)

    Gauslaa, Yngvar; Yemets, Olena A; Asplund, Johan; Solhaug, Knut Asbjørn


    Lichens are useful monitoring organisms for heavy metal pollution. They are high in carbon based secondary compounds (CBSCs) among which some may chelate heavy metals and thus increase metal accumulation. This study quantifies CBSCs in four epiphytic lichens transplanted for 6months on stands along transects from a highway in southern Norway to search for relationships between concentrations of heavy metals and CBSCs along a gradient in heavy metal pollutants. Viability parameters and concentrations of 21 elements including nutrients and heavy metals in these lichen samples were reported in a separate paper. Medullary CBSCs in fruticose lichens (Ramalina farinacea, Usnea dasypoga) were reduced in the most polluted sites, but not in foliose ones (Parmelia sulcata, Lobaria pulmonaria), whereas cortical CBSC did not change with distance from the road in any species. Strong positive correlations only occurred between the major medullary compound stictic acid present in L. pulmonaria and most heavy metals, consistent with a chelating role of stictic acid, but not of other studied CBSCs or in other species. However, heavy metal chelating did not protect L. pulmonaria against damage because this species experienced the strongest reduction in viability in the polluted sites. CBSCs with an accumulation potential for heavy metals should be quantified in lichen biomonitoring studies of heavy metals because they, like stictic acid, could overshadow pollutant inputs in some species rendering biomonitoring data less useful. In the two fruticose lichen species, CBSCs decreased with increasing heavy metal concentration, probably because heavy metal exposure impaired secondary metabolism. Thus, we found no support for a heavy metal protection role of any CBSCs in studied epiphytic lichens. No intraspecific relationships occurred between CBSCs versus N or C/N-ratio. Interspecifically, medullary CBSCs decreased and cortical CBSCs increased with increasing C/N-ratio. Copyright © 2015

  8. Defining a metal-based waste form for IFR pyroprocessing wastes

    International Nuclear Information System (INIS)

    McDeavitt, S.M.; Park, J.Y.; Ackerman, J.P.


    Pyrochemical electrorefining to recover actinides from metal nuclear fuel is a key element of the Integral Fast Reactor (IFR) fuel cycle. The process separates the radioactive fission products from the long-lived actinides in a molten LiCl-KCl salt, and it generates a lower waste volume with significantly less long-term toxicity as compared to spent nuclear fuel. The process waste forms include a mineral-based waste form that will contain fission products removed from an electrolyte salt and a metal-based waste form that will contain metallic fission products and the fuel cladding and process materials. Two concepts for the metal-based waste form are being investigated: (1) encapsulating the metal constituents in a Cu-Al alloy and (2) alloying the metal constituents into a uniform stainless steel-based waste form. Results are given from our recent studies of these two concepts

  9. Dietary compounds as modulators of metals and metalloids toxicity. (United States)

    Jadán-Piedra, Carlos; Chiocchetti, Gabriela Matuoka; Clemente, María Jesús; Vélez, Dinoraz; Devesa, Vicenta


    A large part of the population is exposed to metals and metalloids through the diet. Most of the in vivo studies on its toxicokinetics and toxicity are conducted by means of exposure through drinking water or by intragastric or intraperitoneal administration of aqueous standards, and therefore they do not consider the effect of the food matrix on the exposure. Numerous studies show that some components of the diet can modulate the toxicity of these food contaminants, reducing their effect on a systemic level. Part of this protective role may be due to a reduction of intestinal absorption and subsequent tissue accumulation of the toxic element, although it may also be a consequence of their ability to counteract the toxicity directly by their antioxidant and/or anti-inflammatory activity, among other factors. The present review provides a compilation of existing information about the effect that certain components of the diet have on the toxicokinetics and toxicity of the metals and metalloids of greatest toxicological importance that are present in food (arsenic, cadmium, lead, and mercury), and of their most toxic chemical species.

  10. Crystalline and amorphous rare-earth metallic compounds

    International Nuclear Information System (INIS)

    Burzo, E.


    During the last years the study of magnetic behaviour of rare-earth (or yttrium) compounds with cobalt and iron has growth of interest. This interest of justified by a large area of experimental and theoretical problems coming into being in the study of some rare-earth materials as well as in their technical applications. In the last three years a great number of new rare earth materials were studied and also new models explaining the magnetic behaviour of these systems have been used. In this paper we refer especially to some typical systems in order to analyse the magnetic behaviour of iron and cobalt and also the part played by the magnetic interactions in the values of the cobalt or iron moments. The model used will be generally the molecular field model. In the second chapter we present comparatively the structure of crystalline and amorphous compounds for further correlation with the magnetic properties. In chapter III we analyse the magnetic interactions in some crystalline and amorphous rare-earth alloys. Finally, we exemplify the ways in which we ensure better requried characteristics by the technical utilizations of these materials. These have in view the modifications of the magnetic interactions and are closely related with the analysis made in chapter III

  11. Simulation of hot forming processes of refractory metals using porous metal plasticity models

    International Nuclear Information System (INIS)

    Parteder, E.; Riedel, H.; Sun, D.-Z.


    In this work two models for predicting the densification behavior of sintered refractory metals during hot working operations are presented. It is known from experiments and cell model calculations that the pore shape change has a significant influence on the densification behavior. Therefore this effect should be included in a continuum constitutive description. The first model presented is a phenomenological extension of the Gurson model, the second one is the model of Gologanu, Leblond and Devaux, which was implemented as a user material model into the finite-element-code ABAQUS. The numerical results are compared with the density distribution of a tapered disk made of pure molybdenum after the hot forming operation. (author)

  12. Two new POMOF compounds constructed from polyoxoanions, metals and organic ligands (United States)

    Xiao, Li-Na; Zhang, Hao; Zhang, Ting-Ting; Zhang, Xiao; Cui, Xiao-Bing


    Two new POMOF compounds, namely [PMo12V2O42][Cu3(4,4'-bpy)3]·(DABCO) (1) and [PMo10V4O42][Cu2(4,4'-bpy)2][Cu(phen)2]2 (2) (DABCO = triethylenediamine, bpy = bipyridine, phen = 1,10-phenanthroline)), have been synthesized and characterized by IR, UV-Vis, XRD, elemental analysis and X-ray diffraction analysis. Crystal structure analyses reveal that compounds 1 and 2 exhibit novel 2-D layered framework structures constructed from bi-capped Keggin molybdenum-vanadium polyoxoanions, metals and organic ligands, respectively. The main difference of the two compounds is that compound 2 contains both Cu2+ and Cu+ complexes. In addition, we also investigate the catalytic properties of the two compounds, both compound 1 and 2 are excellent catalysts for the epoxidation of styrene.

  13. Bifunctional ammonium compounds as promising extragents of metals

    International Nuclear Information System (INIS)

    Rakhman'ko, E.M.; Polishchuk, S.V.; Tsvirko, G.A.; Starobinets, G.L.; Leshchev, S.M.


    Salts of dinonyl-aminoethyl-β-trinonylammonium (DNAE-β-TNA) and methylpentadecylethylenediammonium (MPDEDA) have been synthesized and studied as extractions. Extraction of CdBr 2 and CdI 2 by MPDEDA picrate in toluene and their binary mixture with chloroform, amyl-acetate and octane is investigated. It is shown that Cd is extracted by quaternary ammonium salt in the form of complex anion CdX 4 2- , where X-Br, I. The mechanism and extraction process kinetics are described. Molecular structure of the complexes formed is presented. 2 refs.; 2 figs.; 2 tabs

  14. Tunnelling of hydrogen in alkali metal intercalation compounds (United States)

    Beaufils, J. P.; Crowley, T.; Rayment, T.; Thomas, R. K.; White, J. W.

    Rotational tunnelling spectroscopy for hydrogen absorbed in the second stage graphite intercalation compounds C24M(H2)x where M = Rb and Cs, 0·5 < x < 2 is reported in the energy range 100 μeV < ΔE < 1400 μeV (0·8 cm-1 ˜ 11 cm-1). Two distinct sites, A and B, for the hydrogen uptake can be deduced from the spectra which are consistent with site symmetries A, tetrahedral; B octahedral. The spectra of HD calculated using the crystal field parameters for H2 agree well with measurements and indicate molecular motion about the molecular centre of mass rather than the bond centre. The sites can be preferentially blocked by co-absorbing deuterium or methane. The tunnelling spectra disappear in the temperature range 90 K < T < 150 K becoming broader with the simultaneous appearance of quasielastic scattering.

  15. Reaction-Forming Method for Producing Near Net-Shape Refractory Metal Carbides

    Energy Technology Data Exchange (ETDEWEB)

    Palmisiano, Marc N.; Jakubenas, Kevin J.; Baranwal, Rita


    A method for reaction forming refractory metal carbides. The method involves the fabrication of a glassy carbon preform by casting an organic, resin-based liquid mixture into a mold and subsequently heat treating it in two steps, which cures and pyrolizes the resin resulting in a porous carbon preform. By varying the amounts of the constituents in the organic, resin-based liquid mixture, control over the density of the carbon preform is obtained. Control of the density and microstructure of the carbon preform allows for determination of the microstructure and properties of the refractory metal carbide material produced. The glassy carbon preform is placed on a bed of refractory metal or refractory metal--silicon alloy. The pieces are heated above the melting point of the metal or alloy. The molten metal wicks inside the porous carbon preform and reacts, forming the refractory metal carbide or refractory metal carbide plus a minor secondary phase.

  16. Heavy metal ion extraction of crownether compounds with supercritical CO2 fluid

    International Nuclear Information System (INIS)

    Yun, Y. H.; Ko, M. S.; Kim, H. W.; Park, K. H.; Kim, H. D.


    Benzocrownether-diarylethene derivatives (5BCD, 6BCD) were synthesized and utilized to extract metal ions into supercritical CO 2 . In order to enhance the CO 2 -phillicity and the extraction capability, synthesized compounds have both perfluoro unit and benzocrown moiety and were compared with dicyclohexano 18-crown-6(DC18C6). With minimal amount of water and counter ions such as perfluorooctanesulphonic acid or perfluorooctanic acid, their metal ion(Sr 2+ , Co +2 , Na + ) extraction efficiency was investigated. 5BCD, 6BCD showed more than 50% extraction for Sr +2 , Na + ions and their extraction efficiency was better than that of DC18C6 compound

  17. Toxicity assessment of free form of heavy metals in aqueous media on earthworm Eudrillus eugeniae. (United States)

    Sharma, V; Chaudhari, P R; Satyanarayan, S


    Metals are found in free and also in combined forms. In order to get information on the effect of free forms of heavy metals on earthworms the aqueous extracts of metals were tested on earthworms both in individual form and also in combined form. Different concentrations, i.e. 1 ppm, 5 ppm, and 10 ppm, were selected arbitrarily and were used in the experiments. Metals like copper, cadmium, chromium, zinc and lead were used. Earthworms' Eudrillus eugeniae activity, i.e. their response to the toxicity of metals, was monitored continuously for 5 h. It can be concluded that free form/ionic form/dissolved form of heavy metals are more toxic for earthworms, concurrent with findings of workers who have drawn same inference during studies on aquatic organisms. Earthworms can serve as biomarkers for wastewater and sludge treatment studies as they have shown typical adverse body reactions and symptoms altogether different in reaction to each of the metals during aqueous medium studies. It can be inferred that, if earthworms are utilised for treating wastewater and sludges containing these five heavy metals, one can ascertain the presence of individual metal concentrations in the wastewaters and sludges by studying the typical body reactions of earthworms during the treatment.

  18. Thermal behaviour of nicotinic acid, sodium nicotinate and its compounds with some bivalent transition metal ions

    International Nuclear Information System (INIS)

    Nascimento, A.L.C.S. do; Caires, F.J.; Gomes, D.J.C.; Gigante, A.C.; Ionashiro, M.


    Graphical abstract: - Highlights: • The transition metal ion nicotinates were synthesized. • The TG–DTA curves provided previously unreported information about thermal behaviour. • The gaseous products released were detected by TG–DSC coupled to FTIR. - Abstract: Solid-state M(L) 2 ·nH 2 O compounds, where M stands for bivalent transition metals (Mn, Fe, Co, Ni, Cu and Zn), L is nicotinate and n = 0–4.5, have been synthesized. Characterization and thermal behaviour of these compounds were investigated employing elemental analysis based on the mass losses observed in the TG–DTA curves, complexometry, X-ray diffractometry, infrared spectroscopy (FTIR), simultaneous thermogravimetric and differential thermal analysis (TG–DTA) and TG–DSC coupled to FTIR. The thermal behaviour of nicotinic acid and its sodium salt was also investigated. For the hydrated transition metal compounds, the dehydration and thermal decomposition of the anhydrous compounds occur in a single step. For the sodium nicotinate, the final residue up to 765 °C is sodium carbonate and for the transition metal nicotinates, the final residues are Mn 3 O 4 , Fe 2 O 3 , Co 3 O 4 , NiO, CuO and ZnO. The results also provided information concerning the thermal stability, thermal decomposition and identification of the gaseous products evolved during the thermal decomposition of the compounds

  19. The investigation of germanium based compounds, transition metals and isoflavones within foods


    Dowling, Stephen


    The body of work here looks not only at how germanium was present in foods but also the ascertainment of chelation behaviour of germanium compounds and also transition metals with flavonoids. The chelation of germanium with flavonoids, or particularly isoflavones, is a completely novel area and gave some interesting results for chelation with isoflavones with transition metals, an area of research that was completely underexploited until recently. (refer to appendix 1) The Fourier Tran...

  20. Process of forming a sol-gel/metal hydride composite (United States)

    Congdon, James W [Aiken, SC


    An external gelation process is described which produces granules of metal hydride particles contained within a sol-gel matrix. The resulting granules are dimensionally stable and are useful for applications such as hydrogen separation and hydrogen purification. An additional coating technique for strengthening the granules is also provided.

  1. Plasmachemical synthesis and evaluation of the thermal conductivity of metal-oxide compounds "Molybdenum-uranium dioxide" (United States)

    Kotelnikova, Alexandra A.; Karengin, Alexander G.; Mendoza, Orlando


    The article represents possibility to apply oxidative and reducing plasma for plasma-chemical synthesis of metal-oxide compounds «Mo‒UO2» from water-salt mixtures «molybdic acid‒uranyl nitrate» and «molybdic acid‒ uranyl acetate». The composition of water-salt mixture was calculated and the conditions ensuring plasma-chemical synthesis of «Mo‒UO2» compounds were determined. Calculations were carried out at atmospheric pressure over a wide range of temperatures (300-4000 K), with the use of various plasma coolants (air, hydrogen). The heat conductivity coefficients of metal-oxide compounds «Mo‒UO2» consisting of continuous component (molybdenum matrix) are calculated. Inclusions from ceramics in the form of uranium dioxide were ordered in the matrix. Particular attention is paid to methods for calculating the coefficients of thermal conductivity of these compounds with the use of different models. Calculated results were compared with the experimental data.

  2. 40 CFR 471.40 - Applicability; description of the precious metals forming subcategory. (United States)


    ... 40 Protection of Environment 29 2010-07-01 2010-07-01 false Applicability; description of the precious metals forming subcategory. 471.40 Section 471.40 Protection of Environment ENVIRONMENTAL... POINT SOURCE CATEGORY Precious Metals Forming Subcategory § 471.40 Applicability; description of the...

  3. Mechanism of decomposition of transition metal organometallic compounds and role of intermediate particles in catalysis

    International Nuclear Information System (INIS)

    Dolgoplosk, B.A.


    In the review, containing 105 bibliographic references, ways of decomposition of transition metal organic compounds in the moment of their formation are considered. For methyl, benzyl, trimethylsililmethyl and neophilic derivatives of transition metals (Mo, W, Re, Nb, Ta, Nd, Y) α-decay, which is accompanied by the formation of carbene and carbyne particles, is the determining one. Mechanism of the chain processes of metathesis of olefines and cycloolephines under the effect of carbene complexes of transition metals is discussed. Suppositions are made on chemical nature of elementary acts in the reactions of hydrogenolisis, isomerization of carbon carcass; dehydration and hydration of hydrocarbons

  4. Glass-forming ability of compounds in marketed amorphous drug products. (United States)

    Wyttenbach, Nicole; Kuentz, Martin


    This note is about the glass-forming ability (GFA) of drugs marketed as amorphous solid dispersions or as pure amorphous compounds. A thermoanalytical method was complemented with an in silico study, which made use of molecular properties that were identified earlier as being relevant for GFA. Thus, molar volume together with effective numbers of torsional bonds and hydrogen bonding were used to map drugs that are as amorphous products on the market either as solid dispersion of without co-processed carrier as amorphous drug in a solid dosage form. Differential scanning calorimetry experiments showed that most compounds were stable glass formers (GFs) (class III) followed by so-called unstable GFs (class II) and finally, only vemurafenib was found in class I with increased crystallization propensity. The in silico results, however showed that all drugs were either clearly in the chemical space expected for GFs or they were borderline to the region that holds for high crystallization tendency. Interestingly, the pure amorphous compounds scattered in a very confined region of the molecular predictors. These findings can guide amorphous product development of future drug candidates. Based on the compound location in the given chemical space, amorphous formulation opportunities can be balanced against the risks of physical instability upon storage. Copyright © 2016 Elsevier B.V. All rights reserved.

  5. Interaction of cadmium(2) trifluoroacetate with activated aromatic compounds: a new reaction of direct metallation

    International Nuclear Information System (INIS)

    Boev, V.I.; Denisov, S.P.; Moskalenko, A.I.; Stamova, L.G.; Gulin, A.V.


    Interaction of cadmium trifluoroacetate with aniline, 4-bromo-aniline, indole and benzimidazole was studied to develop a simple method for synthesizing cadmium organic compounds by direct electrophilic metallation of aromatic compounds. It is shown that heating of the reagents in anhydrous ethanol for several hours or without a solvent at 100-120 deg C for 5-10 min with subsequent treatment of the reacting mass by sodium chloride involves formation of the relevant cadmium organic compounds. The substances prepared were characterized by the methods of element analysis, IR and 1 H NMR spectroscopy [ru


    Creutz, E.C.


    A method and apparatus are presented for the extrusion of uranium metal. Since uranium is very brittle if worked in the beta phase, it is desirable to extrude it in the gamma phase. However, in the gamma temperature range thc uranium will alloy with the metal of the extrusion dic, and is readily oxidized to a great degree. According to this patent, uranium extrusion in thc ganmma phase may be safely carried out by preheating a billet of uranium in an inert atmosphere to a trmperature between 780 C and 1100 C. The heated billet is then placed in an extrusion apparatus having dies which have been maintained at an elevated temperature for a sufficient length of time to produce an oxide film, and placing a copper disc between the uranium billet and the die.

  7. A study on compound contents for plastic injection molding products of metallic resin pigment

    Energy Technology Data Exchange (ETDEWEB)

    Park, Young Whan; Kwak, Jae Seob [Dept. of Mechanical Engineering, Pukyong National University, Busan (Korea, Republic of); Lee, Gyu Sang [Alliance Molding Engineering TeamLG Electronics Inc., Osan (Korea, Republic of)


    Injection molding process is widely used for producing most plastic products. In order to make a metal-colored plastic product especially in modern luxury home alliances, metallic pigments which are mixed to a basic resin material for injection molding are available. However, the process control for the metal-colored plastic product is extremely difficult due to non-uniform melt flow of the metallic resin pigments. To improve the process efficiency, a rapid mold cooling method by a compressed cryogenic fluid and electricity mold are also proposed to decrease undesired compound contents within a molded plastic product. In this study, a quality of the metal-colored plastic product is evaluated with process parameters; injection speed, injection pressure, and pigment contents, and an influence of the rapid cooling and heating system is demonstrated.

  8. A study on compound contents for plastic injection molding products of metallic resin pigment

    International Nuclear Information System (INIS)

    Park, Young Whan; Kwak, Jae Seob; Lee, Gyu Sang


    Injection molding process is widely used for producing most plastic products. In order to make a metal-colored plastic product especially in modern luxury home alliances, metallic pigments which are mixed to a basic resin material for injection molding are available. However, the process control for the metal-colored plastic product is extremely difficult due to non-uniform melt flow of the metallic resin pigments. To improve the process efficiency, a rapid mold cooling method by a compressed cryogenic fluid and electricity mold are also proposed to decrease undesired compound contents within a molded plastic product. In this study, a quality of the metal-colored plastic product is evaluated with process parameters; injection speed, injection pressure, and pigment contents, and an influence of the rapid cooling and heating system is demonstrated

  9. Separation of polar compounds using a flexible metal-organic framework

    NARCIS (Netherlands)

    Motkuri, R.K.; Thallapally, P.K.; Annapureddy, H.V.R.; Dang, L.X.; Krishna, R.; Nune, S.K.; Fernandez, C.A.; Liu, J.; McGrail, B.P.


    A flexible metal-organic framework constructed from a flexible linker is shown to possess the capability of separating mixtures of polar compounds (propanol isomers) by exploiting the differences in the saturation capacities of the constituents. Transient breakthrough simulations show that these

  10. Neutron scattering investigation of layer-bending modes in alkali-metal--graphite intercalation compounds

    International Nuclear Information System (INIS)

    Zabel, H.; Kamitakahara, W.A.; Nicklow, R.M.


    Phonon dispersion curves for low-frequency transverse modes propagating in the basal plane have been measured in the alkali-metal--graphite intercalation compounds KC 8 , CsC 8 , KC 24 , and RbC 24 by means of neutron spectroscopy. The acoustic branches show an almost quadratic dispersion relation at small q, characteristic of strongly layered materials. The optical branches of stage-1 compounds can be classified as either graphitelike branches showing dispersion, or as almost dispersionless alkali-metal-like modes. Macroscopic shear constants C 44 and layer-bending moduli have been obtained for the intercalation compounds by analyzing the data in terms of a simple semicontinuum model. In stage-2 compounds, a dramatic softening of the shear constant by about a factor of 8 compared with pure graphite has been observed. Low-temperature results on KC 24 indicate the opening of a frequency gap near the alkali-metal Brillouin-zone boundary, possibly due to the formation of the alkali-metal superstructure

  11. A standardized evaluation of artifacts from metallic compounds during fast MR imaging

    DEFF Research Database (Denmark)

    Murakami, Shumei; Verdonschot, Rinus G; Kataoka, Miyoshi


    OBJECTIVE: Metallic compounds present in the oral and maxillofacial regions (OMR) cause large artifacts during MR scanning. We quantitatively assessed these artifacts embedded within a phantom according to standards set by the American Society for Testing and Materials (ASTM). MATERIALS AND METHO...

  12. Metallicity inhomogeneities in local star-forming galaxies as a sign of recent metal-poor gas accretion

    International Nuclear Information System (INIS)

    Sánchez Almeida, J.; Morales-Luis, A. B.; Muñoz-Tuñón, C.; Méndez-Abreu, J.; Elmegreen, D. M.; Elmegreen, B. G.


    We measure the oxygen metallicity of the ionized gas along the major axis of seven dwarf star-forming galaxies. Two of them, SDSSJ1647+21 and SDSSJ2238+14, show ≅0.5 dex metallicity decrements in inner regions with enhanced star formation activity. This behavior is similar to the metallicity drop observed in a number of local tadpole galaxies by Sánchez Almeida et al., and was interpreted as showing early stages of assembling in disk galaxies, with the star formation sustained by external metal-poor gas accretion. The agreement with tadpoles has several implications. (1) It proves that galaxies other than the local tadpoles present the same unusual metallicity pattern. (2) Our metallicity inhomogeneities were inferred using the direct method, thus discarding systematic errors usually attributed to other methods. (3) Taken together with the tadpole data, our findings suggest a threshold around one-tenth the solar value for the metallicity drops to show up. Although galaxies with clear metallicity drops are rare, the physical mechanism responsible for them may sustain a significant part of the star formation activity in the local universe. We argue that the star formation dependence of the mass-metallicity relationship, as well as other general properties followed by most local disk galaxies, is naturally interpreted as side effects of pristine gas infall. Alternatives to the metal-poor gas accretion are examined as well.

  13. The Mammary Gland Carcinogens: The Role of Metal Compounds and Organic Solvents

    Directory of Open Access Journals (Sweden)

    Stephen Juma Mulware


    Full Text Available The increased rate of breast cancer incidences especially among postmenopausal women has been reported in recent decades. Despite the fact that women who inherited mutations in the BRCA1 and BRCA2 genes have a high risk of developing breast cancer, studies have also shown that significant exposure to certain metal compounds and organic solvents also increases the risks of mammary gland carcinogenesis. While physiological properties govern the uptake, intracellular distribution, and binding of metal compounds, their interaction with proteins seems to be the most relevant process for metal carcinogenicity than biding to DNA. The four most predominant mechanisms for metal carcinogenicity include (1 interference with cellular redox regulation and induction of oxidative stress, (2 inhibition of major DNA repair, (3 deregulation of cell proliferation, and (4 epigenetic inactivation of genes by DNA hypermethylation. On the other hand, most organic solvents are highly lipophilic and are biotransformed mainly in the liver and the kidney through a series of oxidative and reductive reactions, some of which result in bioactivation. The breast physiology, notably the parenchyma, is embedded in a fat depot capable of storing lipophilic xenobiotics. This paper reviews the role of metal compounds and organic solvents in breast cancer development.


    Directory of Open Access Journals (Sweden)

    Teguh Hari Sucipto


    Full Text Available The human immunodeficiency virus (HIV is viruses known as rotaviruses. Potential target for therapeutic is reverse transcriptase (RT, possesses an RNA dependent DNA polymerase, DNA-dependent DNA polymerase and ribonuclease H fuctions. Imidazoles have high anti-HIV inhibitory activity, some derivates of imidazole reported drugs. 8-chloro-2,3-dihydroimidazole[1,2-b] [1,4,2]benzodithiazine-5,5-dioxides and 9-chloro-2,3,4-trihydropyri-mido[1,2-b][1,4,2]benzodithi-azine-6,6-dioxides. This compounds succesfully identified anti-HIV activity. Copper is a bio-essential element and copper complexes have been extensively utilized in metal mediated DNA cleavage for the generation of activated oxygen species. It has been reported that teraaza macrocyclic copper coordination compounds have anti-HIV activities. Studies have shown that these macrocyclic complexes can react with DNA in different binding fashions and exhibit effective nuclease activities. Complex compounds are compounds in which there is an atom that acts as the central atom and trotter group of molecules that can be either neutral or charged ions. Application a metal-organic (complex compounds, especially copper metal and derivates of imidazole. So, in this study can explore new anti-HIV candidate.

  15. Oxidation kinetics of reaction products formed in uranium metal corrosion

    International Nuclear Information System (INIS)

    Totemeier, T. C.


    The oxidation behavior of uranium metal ZPPR fuel corrosion products in environments of Ar-4%O 2 and Ar-20%O 2 were studied using thermo-gravimetric analysis (TGA). These tests were performed to extend earlier work in this area specifically, to assess plate-to-plate variations in corrosion product properties and the effect of oxygen concentration on oxidation behavior. The corrosion products from two relatively severely corroded plates were similar, while the products from a relatively intact plate were not reactive. Oxygen concentration strongly affected the burning rate of reactive products, but had little effect on low-temperature oxidation rates

  16. From iron coordination compounds to metal oxide nanoparticles. (United States)

    Iacob, Mihail; Racles, Carmen; Tugui, Codrin; Stiubianu, George; Bele, Adrian; Sacarescu, Liviu; Timpu, Daniel; Cazacu, Maria


    Various types, shapes and sizes of iron oxide nanoparticles were obtained depending on the nature of the precursor, preparation method and reaction conditions. The mixed valence trinuclear iron acetate, [Fe 2 III Fe II O(CH 3 COO) 6 (H 2 O) 3 ]·2H 2 O (FeAc1), μ 3 -oxo trinuclear iron(III) acetate, [Fe 3 O(CH 3 COO) 6 (H 2 O) 3 ]NO 3 ∙4H 2 O (FeAc2), iron furoate, [Fe 3 O(C 4 H 3 OCOO) 6 (CH 3 OH) 3 ]NO 3 ∙2CH 3 OH (FeF), iron chromium furoate, FeCr 2 O(C 4 H 3 OCOO) 6 (CH 3 OH) 3 ]NO 3 ∙2CH 3 OH (FeCrF), and an iron complex with an original macromolecular ligand (FePAZ) were used as precursors for the corresponding oxide nanoparticles. Five series of nanoparticle samples were prepared employing either a classical thermal pathway (i.e., thermal decomposition in solution, solvothermal method, dry thermal decomposition/calcination) or using a nonconventional energy source (i.e., microwave or ultrasonic treatment) to convert precursors into iron oxides. The resulting materials were structurally characterized by wide-angle X-ray diffraction and Fourier transform infrared, Raman, energy-dispersive X-ray, and X-ray fluorescence spectroscopies, as well as thermogravimetric analysis. The morphology was characterized by transmission electron microscopy, atomic force microscopy and dynamic light scattering. The parameters were varied within each route to fine tune the size and shape of the formed nanoparticles.

  17. From iron coordination compounds to metal oxide nanoparticles

    Directory of Open Access Journals (Sweden)

    Mihail Iacob


    Full Text Available Various types, shapes and sizes of iron oxide nanoparticles were obtained depending on the nature of the precursor, preparation method and reaction conditions. The mixed valence trinuclear iron acetate, [Fe2IIIFeIIO(CH3COO6(H2O3]·2H2O (FeAc1, μ3-oxo trinuclear iron(III acetate, [Fe3O(CH3COO6(H2O3]NO3∙4H2O (FeAc2, iron furoate, [Fe3O(C4H3OCOO6(CH3OH3]NO3∙2CH3OH (FeF, iron chromium furoate, FeCr2O(C4H3OCOO6(CH3OH3]NO3∙2CH3OH (FeCrF, and an iron complex with an original macromolecular ligand (FePAZ were used as precursors for the corresponding oxide nanoparticles. Five series of nanoparticle samples were prepared employing either a classical thermal pathway (i.e., thermal decomposition in solution, solvothermal method, dry thermal decomposition/calcination or using a nonconventional energy source (i.e., microwave or ultrasonic treatment to convert precursors into iron oxides. The resulting materials were structurally characterized by wide-angle X-ray diffraction and Fourier transform infrared, Raman, energy-dispersive X-ray, and X-ray fluorescence spectroscopies, as well as thermogravimetric analysis. The morphology was characterized by transmission electron microscopy, atomic force microscopy and dynamic light scattering. The parameters were varied within each route to fine tune the size and shape of the formed nanoparticles.

  18. Magnetic measurements on transition metal compounds and dilute alloys in high magnetic fields

    International Nuclear Information System (INIS)

    Smit, J.J.


    A number of experiments are described which have in common the application of high magnetic fields to the study of magnetic ordering phenomena at low temperatures. A pulsed-field magnet is used, capable of producing field pulses during a time period of about 20 ms and maximum fields that are in the range of 40-50 Tesla. In some cases additional data have been taken in superconducting magnets with maximum fields up to 11 T. After a description of the experimental equipments a series of measurements on quasi linear chain anti-ferromagnets is given. Experiments are described on S=1 systems for which the spin-triplet is split up by the crystal field in such a way that the ground state is a nonmagnetic singlet. The upper doublet splits if a field is applied, and if the Zeeman energy is sufficiently strong one of the doublet levels will cross the singlet, yielding a magnetic ground state. The magnetization and the field and frequency dependence of the differential susceptibility of these systems have been studied. The crystal field splitting parameter D and the exchange J are determined. Magnetic measurements are presented on compounds in which the magnetic ions form dimeric or tetrameric clusters of spins, the intercluster interactions being very small. The aim of this investigation was to characterize the magnetic behaviour of these systems, and to obtain estimates of the antiferromagnetic superexchange interactions. Lastly, a study is reported on three prototype examples of metallic spin glasses. (Auth.)

  19. Corrosion resistant amorphous metals and methods of forming corrosion resistant amorphous metals (United States)

    Farmer, Joseph C [Tracy, CA; Wong, Frank M. G. [Livermore, CA; Haslam, Jeffery J [Livermore, CA; Yang, Nancy [Lafayette, CA; Lavernia, Enrique J [Davis, CA; Blue, Craig A [Knoxville, TN; Graeve, Olivia A [Reno, NV; Bayles, Robert [Annandale, VA; Perepezko, John H [Madison, WI; Kaufman, Larry [Brookline, MA; Schoenung, Julie [Davis, CA; Ajdelsztajn, Leo [Walnut Creek, CA


    A system for coating a surface comprises providing a source of amorphous metal, providing ceramic particles, and applying the amorphous metal and the ceramic particles to the surface by a spray. The coating comprises a composite material made of amorphous metal that contains one or more of the following elements in the specified range of composition: yttrium (.gtoreq.1 atomic %), chromium (14 to 18 atomic %), molybdenum (.gtoreq.7 atomic %), tungsten (.gtoreq.1 atomic %), boron (.ltoreq.5 atomic %), or carbon (.gtoreq.4 atomic %).

  20. Leaching characteristics of the metal waste form from the electrometallurgical treatment process: Product consistency testing

    International Nuclear Information System (INIS)

    Johnson, S. G.; Keiser, D. D.; Frank, S. M.; DiSanto, T.; Noy, M.


    Argonne National Laboratory is developing an electrometallurgical treatment for spent fuel from the experimental breeder reactor II. A product of this treatment process is a metal waste form that incorporates the stainless steel cladding hulls, zirconium from the fuel and the fission products that are noble to the process, i.e., Tc, Ru, Nb, Pd, Rh, Ag. The nominal composition of this waste form is stainless steel/15 wt% zirconium/1--4 wt% noble metal fission products/1--2 wt % U. Leaching results are presented from several tests and sample types: (1) 2 week monolithic immersion tests on actual metal waste forms produced from irradiated cladding hulls, (2) long term (>2 years) pulsed flow tests on samples containing technetium and uranium and (3) crushed sample immersion tests on cold simulated metal waste form samples. The test results will be compared and their relevance for waste form product consistency testing discussed

  1. Metastability and thermophysical properties of metallic bulk glass forming alloys

    International Nuclear Information System (INIS)

    Wunderlich, R.K.; Fecht, H.J.


    The absence of crystallization over a wide time/temperature window can be used to produce bulk metallic glass by relatively slow cooling of the melt. For a number of alloys, including several multicomponent Zr-based alloys, the relevant thermodynamic and thermomechanical properties of the metastable glassy and undercooled liquid states have been measured below and above the glass transition temperature. These measurements include specific heat, viscosity, volume, and elastic properties as a function of temperature. As a result, it becomes obvious that the maximum undercooling for these alloys is given by an isentropic condition before an enthalpic or isochoric instability is reached. Alternatively, these glasses can also be produced by mechanical alloying, thus replacing the thermal disorder by static disorder and resulting in the same thermodynamic glass state. During heating through the undercooled liquid, a nanoscale phase separation occurs for most glasses as a precursor of crystallization

  2. Graphene-Based Materials as Solid Phase Extraction Sorbent for Trace Metal Ions, Organic Compounds, and Biological Sample Preparation. (United States)

    Ibrahim, Wan Aini Wan; Nodeh, Hamid Rashidi; Sanagi, Mohd Marsin


    Graphene is a new carbon-based material that is of interest in separation science. Graphene has extraordinary properties including nano size, high surface area, thermal and chemical stability, and excellent adsorption affinity to pollutants. Its adsorption mechanisms are through non-covalent interactions (π-π stacking, electrostatic interactions, and H-bonding) for organic compounds and covalent interactions for metal ions. These properties have led to graphene-based material becoming a desirable adsorbent in a popular sample preparation technique known as solid phase extraction (SPE). Numerous studies have been published on graphene applications in recent years, but few review papers have focused on its applications in analytical chemistry. This article focuses on recent preconcentration of trace elements, organic compounds, and biological species using SPE-based graphene, graphene oxide, and their modified forms. Solid phase microextraction and micro SPE (µSPE) methods based on graphene are discussed.

  3. Addressing aquatic hazard classification for metals, metal compounds and alloys in marine systems. (United States)

    Huntsman-Mapila, P; Skeaff, J M; Pawlak, M; Beaudoin, R


    New International Maritime Organization regulations require shippers to classify all solid bulk cargo to indicate whether they are Harmful to the Marine Environment (HME). The objective of this work was to adapt the freshwater Transformation/Dissolution Protocol (T/DP) to marine water to provide a method to determine, when compared with marine Ecotoxicity Reference Values (ERVs), whether a metal-bearing substance is HME. The substances examined were: Cu2O powder; Ni metal powder; Co3O4 powder; and a Ni-Co-Fe alloy, as wire cuttings, which were the same substances examined in the freshwater T/D validation study and afforded comparisons of the reactivity, or measure of the rate and extent of metal release from the metal-bearing substances in freshwater versus marine conditions. The marine T/D method is suitable for conducting examinations of metal-bearing substances with a wide range of reactivities, from the relatively reactive Cu2O powder and the alloy to the Co3O4 powder, which was the least reactive. Crown Copyright © 2016. Published by Elsevier Ltd. All rights reserved.

  4. Tool Monitoring and Electronic Event Logging for Sheet Metal Forming Processes

    Directory of Open Access Journals (Sweden)

    Gerd Heiserich


    Full Text Available This contribution describes some innovative solutions regarding sensor systems for tool monitoring in the sheet metal industry. Autonomous and tamper-proof sensors, which are integrated in the forming tools, can detect and count the strokes carried out by a sheet metal forming press. Furthermore, an electronic event logger for documentary purposes and quality control was developed. Based on this technical solution, new business models such as leasing of sheet metal forming tools can be established for cooperation among enterprises. These models allow usage-based billing for the contractors, taking the effectively produced number of parts into account.

  5. Deposited Micro Porous Layer as Lubricant Carrier in Metal Forming

    DEFF Research Database (Denmark)

    Arentoft, Mogens; Bay, Niels; Tang, Peter Torben


    as lubricant reservoirs. Conventional friction tests for cold forming; ring compression and double cup extrusion tests are carried out with Molykote DX paste and mineral oil as lubricant. Both lubricants act as intended for the ring compressions test whereas only the low viscosity oil perform successfully...

  6. Hybrid plasmonic waveguides formed by metal coating of dielectric ridges

    DEFF Research Database (Denmark)

    Zenin, Volodymyr; Choudhury, Sajid; Saha, Soham


    Bound hybrid plasmon-polariton modes supported by waveguides, which are formed by gold coating of ridges etched into a silica substrate, are analyzed using numerical simulations and investigated experimentally using near-field microscopy at telecom wavelengths (1425-1625 nm). Drastic modifications...

  7. alpha-Dicarbonyl compounds formed by nonenzymatic browning during the dry heating of caseinate and lactose. (United States)

    Ge Pan, Geoffrey; Oliver, Christine M; Melton, Laurence D


    A method using high-performance liquid chromatography with UV and electrospray ionization mass spectrometry detection was developed for monitoring the alpha-dicarbonyl compound profiles generated from nonenzymatic browning using o-phenylenediamine (OPD) as a trapping agent. The alpha-dicarbonyl compounds were generated by the "dry" reaction of sodium caseinate and lactose heated at various relative humidities (RHs). The proportions of alpha-dicarbonyls formed were different for samples heated at low, intermediate, and high RHs. This study shows that relatively large amounts of 3-deoxypentosulose and galactosyl 2-pentosulose are produced under high RHs, while galactosyl hexosulose and 1,4-dideoxyhexosulose are elevated under low RH conditions. Both caramelization and Maillard reaction pathways contributed to the generation of alpha-dicarbonyls.

  8. Noble-metal-based catalysts supported on zeolites and macro-mesoporous metal oxide supports for the total oxidation of volatile organic compounds. (United States)

    Barakat, Tarek; Rooke, Joanna C; Tidahy, Haingomalala Lucette; Hosseini, Mahsa; Cousin, Renaud; Lamonier, Jean-François; Giraudon, Jean-Marc; De Weireld, Guy; Su, Bao-Lian; Siffert, Stéphane


    The use of porous materials to eliminate volatile organic compounds (VOCs) has proven very effective towards achieving sustainability and environmental protection goals. The activity of zeolites and macro-mesoporous metal-oxide supports in the total oxidation of VOCs has been investigated, with and without noble-metal deposition, to develop highly active catalyst systems where the formation of by-products was minimal. The first catalysts employed were zeolites, which offered a good activity in the oxidation of VOCs, but were rapidly deactivated by coke deposition. The effects of the acido-basicity and ionic exchange of these zeolites showed that a higher basicity was related to exchanged ions with lower electronegativities, resulting in better catalytic performances in the elimination of VOCs. Following on from this work, noble metals were deposited onto macro-mesoporous metal-oxide supports to form mono and bimetallic catalysts. These were then tested in the oxidation of toluene to study their catalytic performance and their deactivation process. PdAu/TiO(2) and PdAu/TiO(2) -ZrO(2) 80/20 catalysts demonstrated the best activity and life span in the oxidation of toluene and propene and offered the lowest temperatures for a 50 % conversion of VOCs and the lowest coke content after catalytic testing. Different characterization techniques were employed to explain the changes occurring in catalyst structure during the oxidation of toluene and propene. Copyright © 2011 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  9. Heavy-metal compounds in the environment of the Zagorsk pumped-storage station region

    International Nuclear Information System (INIS)

    Dmitrieva, I.L.; Zagoskin, V.A.; Boldenkov, V.S.; Brusilovskii, O.V.


    The Zagorsk pumped-storage station (ZPSS) is being constructed in a rather developed area. Pollution of the environment by compounds of metals is, in particular, a consequence. The tasks of this investigation included: the establishment of the main sources of pollution of terrestrial and aquatic ecosystems by metal compounds in the region of construction of the ZPSS; determination of the level of content of these substances in various components of the landscape; and evaluation of the effect of regulating the Kun'ya River on processes of migration and accumulation of heavy metals in aquatic ecosystems. In conformity with these tasks, a comprehensive geochemical study was performed in 1990-1991 of the drainage basin of the Kun'ya River, the results of which are presented here. Samples were collected of soil, forest litter, snow, bottom sediments, and surface waters. The investigation showed that the main sources of pollution of the aquatic environment in the ZPSS construction region by heavy-metal compounds were surface runoff from developed territories and insufficiently treated industrial wastewaters. 5 refs., 2 figs., 4 tabs

  10. Mass and metallicity scaling relations of high-redshift star-forming galaxies selected by GRBs (United States)

    Arabsalmani, M.; Møller, P.; Perley, D. A.; Freudling, W.; Fynbo, J. P. U.; Le Floc'h, E.; Zwaan, M. A.; Schulze, S.; Tanvir, N. R.; Christensen, L.; Levan, A. J.; Jakobsson, P.; Malesani, D.; Cano, Z.; Covino, S.; D'Elia, V.; Goldoni, P.; Gomboc, A.; Heintz, K. E.; Sparre, M.; de Ugarte Postigo, A.; Vergani, S. D.


    We present a comprehensive study of the relations between gas kinematics, metallicity and stellar mass in a sample of 82 gamma-ray burst (GRB)-selected galaxies using absorption and emission methods. We find the velocity widths of both emission and absorption profiles to be a proxy of stellar mass. We also investigate the velocity-metallicity correlation and its evolution with redshift. Using 33 GRB hosts with measured stellar mass and metallicity, we study the mass-metallicity relation for GRB host galaxies in a stellar mass range of 108.2-1011.1 M⊙ and a redshift range of z ∼ 0.3-3.4. The GRB-selected galaxies appear to track the mass-metallicity relation of star-forming galaxies but with an offset of 0.15 towards lower metallicities. This offset is comparable with the average error bar on the metallicity measurements of the GRB sample and also the scatter on the mass-metallicity relation of the general population. It is hard to decide whether this relatively small offset is due to systematic effects or the intrinsic nature of GRB hosts. We also investigate the possibility of using absorption-line metallicity measurements of GRB hosts to study the mass-metallicity relation at high redshifts. Our analysis shows that the metallicity measurements from absorption methods can significantly differ from emission metallicities and assuming identical measurements from the two methods may result in erroneous conclusions.

  11. Metallicity inhomogeneities in local star-forming galaxies as sign of recent metal-poor gas accretion


    Almeida, J. Sanchez; Morales-Luis, A. B.; Munoz-Tunon, C.; Elmegreen, D. M.; Elmegreen, B. G.; Mendez-Abreu, J.


    This work was partly funded by the Spanish Ministry for Science, project AYA 2010-21887-C04-04. J.M.A. acknowledges support from the European Research Council Starting Grant (SEDmorph; P.I. V. Wild). We measure the oxygen metallicity of the ionized gas along the major axis of seven dwarf star-forming galaxies. Two of them, SDSSJ1647+21 and SDSSJ2238+14, show ≃0.5 dex metallicity decrements in inner regions with enhanced star formation activity. This behavior is similar to the metallicity d...

  12. Ring and Volcano Structures Formed by a Metal Dipyrromethene Complex

    Energy Technology Data Exchange (ETDEWEB)

    Son, Seung Bae; Hahn, Jae Ryang [Chonbuk National Univ., Jeonju (Korea, Republic of); Miao, Qing; Shin, Jiyoung; Dolphin, David [Univ. of British Columbia, Columbia (Canada)


    Dichloromethane liquid droplets containing a cobalt dipyrromethene trimer deposited on a graphite surface were found to form coffee ring, toroid ring, or volcano dot structures due to the redistribution of the solute during solvent evaporation. The shapes and size distributions of the ring structures depended on the drying temperature. The shape differences were attributed to the fact that the solvent evaporation rate controlled the self-assembly process that yielded the coffee stain and pinhole structures.

  13. Developmental toxicity from exposure to various forms of mercury compounds in medaka fish (Oryzias latipes embryos

    Directory of Open Access Journals (Sweden)

    Wu Dong


    Full Text Available This study examined developmental toxicity of different mercury compounds, including some used in traditional medicines. Medaka (Oryzias latipes embryos were exposed to 0.001–10 µM concentrations of MeHg, HgCl2, α-HgS (Zhu Sha, and β-HgS (Zuotai from stage 10 (6–7 hpf to 10 days post fertilization (dpf. Of the forms of mercury in this study, the organic form (MeHg proved the most toxic followed by inorganic mercury (HgCl2, both producing embryo developmental toxicity. Altered phenotypes included pericardial edema with elongated or tube heart, reduction of eye pigmentation, and failure of swim bladder inflation. Both α-HgS and β-HgS were less toxic than MeHg and HgCl2. Total RNA was extracted from survivors three days after exposure to MeHg (0.1 µM, HgCl2 (1 µM, α-HgS (10 µM, or β-HgS (10 µM to examine toxicity-related gene expression. MeHg and HgCl2 markedly induced metallothionein (MT and heme oxygenase-1 (Ho-1, while α-HgS and β-HgS failed to induce either gene. Chemical forms of mercury compounds proved to be a major determinant in their developmental toxicity.

  14. Bioconversion of lutein by Enterobacter hormaechei to form a new compound, 8-methyl-α-ionone. (United States)

    Zhong, Guifang; Wang, Fangfang; Sun, Jianhong; Ye, Jianbin; Mao, Duobin; Ma, Ke; Yang, Xuepeng


    To investigate the final product of the bioconversion of lutein by a novel lutein-degrading bacterium, Enterobacter hormaechei A20, and the kinetics of the process. A new product, 8-methyl-α-ionone, was resolved by GC-MS. The compound was further identified by NMR. A conversion yield of 90% was achieved by E. hormaechei in 36 h with 10 g lutein l -1 . This is the first report of the bioconversion of lutein to form 8-methyl-α-ionone. A degradation pathway is proposed.

  15. 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.


    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

  16. Solving optimisation problems in metal forming using Finite Element simulation and metamodelling techniques

    NARCIS (Netherlands)

    Bonte, M.H.A.; van den Boogaard, Antonius H.; Huetink, Han


    During the last decades, Finite Element (FEM) simulations of metal forming processes have become important tools for designing feasible production processes. In more recent years, several authors recognised the potential of coupling FEM simulations to mathematical optimisation algorithms to design

  17. Modelling, screening, and solving of optimisation problems: Application to industrial metal forming processes

    NARCIS (Netherlands)

    Bonte, M.H.A.; van den Boogaard, Antonius H.; Veldman, E.


    Coupling Finite Element (FEM) simulations to mathematical optimisation techniques provides a high potential to improve industrial metal forming processes. In order to optimise these processes, all kind of optimisation problems need to be mathematically modelled and subsequently solved using an

  18. The Relationship between Bulk and Mobile Forms of Heavy Metals in Soils of Kursk (United States)

    Nevedrov, N. P.; Protsenko, E. P.; Glebova, I. V.


    The contamination of Kursk urboecotopes by heavy metals (Pb, Cd, Zn, Cu, Ni) is considered. The relationships between the contents of bulk and mobile forms of heavy metal ions have been examined. The results of monitoring studies attest to a tendency for the accumulation of both bulk and mobile forms of heavy metals in the humus-accumulative horizon, except for bulk cadmium and mobile nickel. Linear and nonlinear regression models of the bulk contents of Pb, Cd, Zn, and Ni as dependent on the contents of their mobile forms have been developed. These models allow us to calculate the bulk content of heavy metal ions in the soils of urboecotopes using simpler methods of the extraction and laboratory determination of their mobile forms.

  19. Efficient Robust Optimization of Metal Forming Processes using a Sequential Metamodel Based Strategy

    NARCIS (Netherlands)

    Wiebenga, J.H.; Klaseboer, G.; van den Boogaard, Antonius H.; Chung, J.


    The coupling of Finite Element (FE) simulations to mathematical optimization techniques has contributed significantly to product improvements and cost reductions in the metal forming industries. The next challenge is to bridge the gap between deterministic optimization techniques and the industrial

  20. Process and equipment qualification of the ceramic and metal waste forms for spent fuel treatment

    International Nuclear Information System (INIS)

    Marsden, Ken; Knight, Collin; Bateman, Kenneth; Westphal, Brian; Lind, Paul


    The electrometallurgical process for treating sodium-bonded spent metallic fuel at the Materials and Fuels Complex of the Idaho National Laboratory separates actinides and partitions fission products into two waste forms. The first is the metal waste form, which is primarily composed of stainless steel from the fuel cladding. This stainless steel is alloyed with 15w% zirconium to produce a very corrosion-resistant metal which binds noble metal fission products and residual actinides. The second is the ceramic waste form which stabilizes fission product-loaded chloride salts in a sodalite and glass composite. These two waste forms will be packaged together for disposal at the Yucca Mountain repository. Two production-scale metal waste furnaces have been constructed. The first is in a large argon-atmosphere glovebox and has been used for equipment qualification, process development, and process qualification - the demonstration of process reliability for production of the DOE-qualified metal waste form. The second furnace will be transferred into a hot cell for production of metal waste. Prototype production-scale ceramic waste equipment has been constructed or procured; some equipment has been qualified with fission product-loaded salt in the hot cell. Qualification of the remaining equipment with surrogate materials is underway. (author)

  1. Failure mechanisms in single-point incremental forming of metals

    DEFF Research Database (Denmark)

    Silva, Maria B.; Nielsen, Peter Søe; Bay, Niels


    The last years saw the development of two different views on how failure develops in single-point incremental forming (SPIF). Today, researchers are split between those claiming that fracture is always preceded by necking and those considering that fracture occurs with suppression of necking. Eac...... and involves independent determination of formability limits by necking and fracture using tensile and hydraulic bulge tests in conjunction with SPIF of benchmark shapes under laboratory conditions.......The last years saw the development of two different views on how failure develops in single-point incremental forming (SPIF). Today, researchers are split between those claiming that fracture is always preceded by necking and those considering that fracture occurs with suppression of necking. Each...... on formability limits and development of fracture. The unified view conciliates the aforementioned different explanations on the role of necking in fracture and is consistent with the experimental observations that have been reported in the past years. The work is performed on aluminium AA1050-H111 sheets...

  2. Modeling the degradation of a metallic waste form intended for geologic disposal

    International Nuclear Information System (INIS)

    Bauer, T.H.; Morris, E.E.


    Nuclear reactors operating with metallic fuels have led to development of robust metallic waste forms intended to immobilize hazardous constituents in oxidizing environments. Release data from a wide range of tests where small waste form samples have been immersed in a variety of oxidizing solutions have been analyzed and fit to a mechanistically-derived 'logarithmic growth' form for waste form degradation. A bounding model is described which plausibly extrapolates these fits to long-term degradation in a geologic repository. The resulting empirically-fit degradation model includes dependence on solution pH, temperature, and chloride concentration as well as plausible estimates of statistical uncertainty. (authors)

  3. Distinct atomic structures of the Ni-Nb metallic glasses formed by ion beam mixing

    International Nuclear Information System (INIS)

    Tai, K. P.; Wang, L. T.; Liu, B. X.


    Four Ni-Nb metallic glasses are obtained by ion beam mixing and their compositions are measured to be Ni 77 Nb 23 , Ni 55 Nb 45 , Ni 31 Nb 69 , and Ni 15 Nb 85 , respectively, suggesting that a composition range of 23-85 at. % of Nb is favored for metallic glass formation in the Ni-Nb system. Interestingly, diffraction analyses show that the structure of the Nb-based Ni 31 Nb 69 metallic glass is distinctly different from the structure of the Nb-based Ni 15 Nb 85 metallic glass, as the respective amorphous halos are located at 2θ≅38 and 39 deg. To explore an atomic scale description of the Ni-Nb metallic glasses, an n-body Ni-Nb potential is first constructed with an aid of the ab initio calculations and then applied to perform the molecular dynamics simulation. Simulation results determine not only the intrinsic glass forming range of the Ni-Nb system to be within 20-85 at. % of Nb, but also the exact atomic positions in the Ni-Nb metallic glasses. Through a statistical analysis of the determined atomic positions, a new dominant local packing unit is found in the Ni 15 Nb 85 metallic glass, i.e., an icositetrahedron with a coordination number to be around 14, while in Ni 31 Nb 69 metallic glasses, the dominant local packing unit is an icosahedron with a coordination number to be around 12, which has been reported for the other metallic glasses. In fact, with increasing the irradiation dose, the Ni 31 Nb 69 metallic glasses are formed through an intermediate state of face-centered-cubic-solid solution, whereas the Ni 15 Nb 85 metallic glass is through an intermediate state of body-centered-cubic-solid solution, suggesting that the structures of the constituent metals play an important role in governing the structural characteristics of the resultant metallic glasses

  4. Gas chromatographic analysis of reactive carbonyl compounds formed from lipids upon UV-irradiation

    International Nuclear Information System (INIS)

    Dennis, K.J.; Shibamoto, T.


    Peroxidation of lipids produces carbonyl compounds; some of these, e.g., malonaldehyde and 4-hydroxynonenal, are genotoxic because of their reactivity with biological nucleophiles. Analysis of the reactive carbonyl compounds is often difficult. The methylhydrazine method developed for malonaldehyde analysis was applied to simultaneously measure the products formed from linoleic acid, linolenic acid, arachidonic acid, and squalene upon ultraviolet-irradiation (UV-irradiation). The photoreaction products, saturated monocarbonyl, alpha,beta-unsaturated carbonyls, and beta-dicarbonyls, were derivatized with methylhydrazine to give hydrazones, pyrazolines, and pyrazoles, respectively. The derivatives were analyzed by gas chromatography and gas chromatography-mass spectrometry. Lipid peroxidation products identified included formaldehyde, acetaldehyde, acrolein, malonaldehyde, n-hexanal, and 4-hydroxy-2-nonenal. Malonaldehyde levels formed upon 4 hr of irradiation were 0.06 micrograms/mg from squalene, 2.4 micrograms/mg from linolenic acid, and 5.7 micrograms/mg from arachidonic acid. Significant levels of acrolein (2.5 micrograms/mg) and 4-hydroxy-2-nonenal (0.17 micrograms/mg) were also produced from arachidonic acid upon 4 hr irradiation

  5. Trivalent metal ions based on inorganic compounds with in vitro inhibitory activity of matrix metalloproteinase 13. (United States)

    Wen, Hanyu; Qin, Yuan; Zhong, Weilong; Li, Cong; Liu, Xiang; Shen, Yehua


    Collagenase-3 (MMP-13) inhibitors have attracted considerable attention in recent years and have been developed as a therapeutic target for a variety of diseases, including cancer. Matrix metalloproteinases (MMPs) can be inhibited by a multitude of compounds, including hydroxamic acids. Studies have shown that materials and compounds containing trivalent metal ions, particularly potassium hexacyanoferrate (III) (K3[Fe(CN)6]), exhibit cdMMP-13 inhibitory potential with a half maximal inhibitory concentration (IC50) of 1.3μM. The target protein was obtained by refolding the recombinant histidine-tagged cdMMP-13 using size exclusion chromatography (SEC). The secondary structures of the refolded cdMMP-13 with or without metal ions were further analyzed via circular dichroism and the results indicate that upon binding with metal ions, an altered structure with increased domain stability was obtained. Furthermore, isothermal titration calorimetry (ITC) experiments demonstrated that K3[Fe(CN)6]is able to bind to MMP-13 and endothelial cell tube formation tests provide further evidence for this interaction to exhibit anti-angiogenesis potential. To the best of our knowledge, no previous report of an inorganic compound featuring a MMP-13 inhibitory activity has ever been reported in the literature. Our results demonstrate that K3[Fe(CN)6] is useful as a new effective and specific inhibitor for cdMMP-13 which may be of great potential for future drug screening applications. Copyright © 2016. Published by Elsevier Inc.

  6. Mixed valence transition metal 2D-oxides: Comparison between delafossite and crednerite compounds (United States)

    Martin, Christine; Poienar, Maria


    Transition metal oxides offer large opportunities to study relationships between structures and properties. Indeed these compounds crystallize in numerous frameworks corresponding to different dimensionalities and, accordingly, show a huge variety of properties (as high Tc superconductivity, colossal magnetoresistivity, multiferroicity..). The control of the oxidation state of the transition metal, via the monitoring of the oxygen content, is of prime importance to understand and optimize the properties, due to the strong coupling that exists between the lattice and the charges and spins of the transition metals. In this large playground for chemists, we reinvestigated several 2D-compounds derived from delafossite structure. Considering this paper as a very short review, we report here the results obtained on CuMO2 compounds (with M = Cr, Mn or Mn+Cu) by using a combination of techniques, as X-ray, neutrons and/or electrons diffraction on poly-crystals for structural characterisations that are correlated with electrical and/or magnetic properties. The complementarity of studies is also addressed by the synthesis and characterization of single crystals in addition to poly-crystals. Moreover the comparison of the structures of similar Cr and Mn based oxides highlights the crucial role of the Jahn-Teller effect of trivalent manganese to lift the degeneracy, which is responsible of the magnetic frustration in CuCrO2.

  7. From non-disposable to disposable, treatment of pyrophoric or gas forming waste forms for disposal - Thermal treatment of pyrophoric or gas-forming metals

    International Nuclear Information System (INIS)

    Oesterberg, Carl; Lindberg, Maria


    In order to dispose of waste in either a deep geological disposal or in a shallower repository there are several demands that the waste and its package must fulfil, one is that it is not to react with oxygen or the waste package or backfill in the repository, i.e. concrete or grout. The waste forms that do not fulfil this particular criterion must be treated in some way to render the waste non-reactive. One of these waste are metallic uranium. Metallic uranium is not only an issue originating from the nuclear industry, as old types of fuel, it is also present in, for example, transport flasks and as samples used in schools, which all has to be disposed of sooner or later. Another waste that arise is magnesium doped with thorium, originating from the aviation, aerospace and missile industry. These alloys are now being replaced with others without thorium so they are in need of handling and possibly treatment before disposal. Magnesium metal is also pyrophoric, in particular in molten or powder form. In order to evaluate thermally treating these metals in a very controlled environment, such as a pyrolysis vessel, experimental work has been performed. The aim of the thermal treatment is to oxidise the metals and obtain an oxide with low leachability. Inactive trials were performed, first using small amount of magnesium tape followed by using Cerium instead of uranium, to check the ability of controlling the process. After the process had been deemed safe the next step was to test the process first with metallic uranium and thereafter with magnesium thorium alloy. The first results show that the oxidation process can be totally controlled and safe. The results show that the metals are oxidised and no longer reactive and can in principle be disposed of. The test will continue and further results will be reported. (authors)

  8. Cytochrome P450-mediated activation of the fragrance compound geraniol forms potent contact allergens

    International Nuclear Information System (INIS)

    Hagvall, Lina; Baron, Jens Malte; Boerje, Anna; Weidolf, Lars; Merk, Hans; Karlberg, Ann-Therese


    Contact sensitization is caused by low molecular weight compounds which penetrate the skin and bind to protein. In many cases, these compounds are activated to reactive species, either by autoxidation on exposure to air or by metabolic activation in the skin. Geraniol, a widely used fragrance chemical, is considered to be a weak allergen, although its chemical structure does not indicate it to be a contact sensitizer. We have shown that geraniol autoxidizes and forms allergenic oxidation products. In the literature, it is suggested but not shown that geraniol could be metabolically activated to geranial. Previously, a skin-like CYP cocktail consisting of cutaneous CYP isoenzymes, was developed as a model system to study cutaneous metabolism. In the present study, we used this system to investigate CYP-mediated activation of geraniol. In incubations with the skin-like CYP cocktail, geranial, neral, 2,3-epoxygeraniol, 6,7-epoxygeraniol and 6,7-epoxygeranial were identified. Geranial was the main metabolite formed followed by 6,7-epoxygeraniol. The allergenic activities of the identified metabolites were determined in the murine local lymph node assay (LLNA). Geranial, neral and 6,7-epoxygeraniol were shown to be moderate sensitizers, and 6,7-epoxygeranial a strong sensitizer. Of the isoenzymes studied, CYP2B6, CYP1A1 and CYP3A5 showed high activities. It is likely that CYP1A1 and CYP3A5 are mainly responsible for the metabolic activation of geraniol in the skin, as they are expressed constitutively at significantly higher levels than CYP2B6. Thus, geraniol is activated through both autoxidation and metabolism. The allergens geranial and neral are formed via both oxidation mechanisms, thereby playing a large role in the sensitization to geraniol

  9. Analysis of trace metals and perfluorinated compounds in 43 representative tea products from South China. (United States)

    Zheng, Hai; Li, Jian-Long; Li, Hai-Hang; Hu, Guo-Cheng; Li, Hua-Shou


    Six trace metals (Cd, Pb, Cr, Cu, Zn, and Mn) and 2 perfluorinated compounds (PFCs), perfluorooctane sulfonate (PFOS) and perfluorooctanoic acid (PFOA), were analyzed in 43 representative tea products (including 18 green, 12 Oolong, and 13 black teas) from 7 main tea production provinces in China, using the atomic absorption spectrophotometer for trace metals analysis and HPLC-MS/MS for PFOS and PFOA analysis. The average contents of the 3 essential metals Mn, Cu, and Zn ions in the tea samples were 629.74, 17.75, and 37.38 mg/kg, whereas 3 toxic metals Cd, Cr, and Pb were 0.65, 1.02, and 1.92 mg/kg, respectively. The contents of heavy metals in the 3 types of tea were in the order of black tea > Oolong tea > green tea. Both PFOS and PFOA contents were low and PFOA content was higher than PFOS in the tea samples. The highest concentration of PFOA was 0.25 ng/g dry weight found in a Hunan green tea. The Principal component analysis was performed with the trace metals and PFCs to analyze the relationships of these indices. The results showed that black teas had higher trace metals and PFCs than green and Oolong teas, and the teas from Hunan and Zhejiang provinces had higher Pb and Cr than others. This paper reports trace metals, and perfluorooctane sulfonate (PFOS) and perfluorooctanoic acid (PFOA) in wide range of tea products produced in the south China area. This paper also warns the low PFOS and PFOA pollution in tea. © 2014 Institute of Food Technologists®

  10. Effect of material scatter on the plastic behavior and stretchability in sheet metal forming

    NARCIS (Netherlands)

    Wiebenga, J.H.; Atzema, E.H.; Atzema, E.H.; An, Y.G.; Vegter, H.; van den Boogaard, Antonius H.


    Robust design of forming processes is gaining attention throughout the industry. To analyze the robustness of a sheet metal forming process using Finite Element (FE) simulations, an accurate input in terms of parameter scatter is required. This paper presents a pragmatic, accurate and economic

  11. The Effect of Grinding and Polishing Procedure of Tool Steels in Sheet Metal Forming

    DEFF Research Database (Denmark)

    Lindvall, F.; Bergström, J.; Krakhmalev, P.


    The surface finish of tools in sheet metal forming has a large influence on the performance of the forming tool. Galling, concern of wear in sheet metal forming, is a severe form of adhesive wear where sheet material is transferred on to the tool surface. By polishing the tools to a fine surface ...... 40 and Vanadis 6 and up to ten different grinding and polishing treatments were tested against AISI 316 stainless steel. The tests showed that an optimum surface preparation might be found at the transition between abrasive and adhesive wear.......The surface finish of tools in sheet metal forming has a large influence on the performance of the forming tool. Galling, concern of wear in sheet metal forming, is a severe form of adhesive wear where sheet material is transferred on to the tool surface. By polishing the tools to a fine surface...... finish, material pick-up has traditionally been reduced, but some surface preparations withstand adhesive wear better. To investigate the effect on galling performance of different surface preparations lubricated tests have been performed using a strip reduction rig. Two different tool materials, Vancron...

  12. Development of an interfacial model for forming of a metal-composite material system (United States)

    Kalyanasundaram, Shankar; Compston, Paul; Mosse, Luke


    This work presents a finite element model for the stamp forming simulation of Fiber-Metal laminate system consisting of glass fiber reinforced composite material layer sandwiched between two aluminium layers. A novel interfacial model was developed to analyze the role of the interface between the metal and composite layers. A one way coupled thermo mechanical model was used to study the effect of pre heating the material system to improve the formability. Comparison between the simulation and experiments were carried out for forming of rectangular cups. The results indicate that the interfacial model is effective in predicting the forming behavior of this advanced light weight material system.

  13. Crystallization of II-VI semiconductor compounds forming long microcrystalline linear assemblies

    Directory of Open Access Journals (Sweden)

    Marcelino Becerril


    Full Text Available In this work we report the formation of long microcrystalline linear self-assemblies observed during the thin film growth of several II-VI compounds. Polycrystalline CdTe, CdS, CdCO3, and nanocrystalline CdTe:Al thin films were prepared on glass substrates by different deposition techniques. In order to observe these crystalline formations in the polycrystalline materials, the thin film growth was suspended before the grains reached to form a continuous layer. The chains of semiconductor crystals were observed among many isolated and randomly distributed grains. Since CdTe, CdTe:Al, CdS and CdCO3 are not ferroelectric and/or ferromagnetic materials, the relevant problem would be to explain what is the mechanism through which the grains are held together to form linear chains. It is well known that some nanocrystalline materials form rods and wires by means of electrostatic forces. This occurs in polar semiconductors, where it is assumed that the attraction forces between surface polar faces of the small crystals are the responsible for the chains formation. Since there are not too many mechanisms responsible for the attraction we assume that a dipolar interaction is the force that originates the formation of chain-like grain clusters. The study of this property can be useful for the understanding of nucleation processes in the growth of semiconductor thin films.

  14. Photoacidic and Photobasic Behavior of Transition Metal Compounds with Carboxylic Acid Group(s)

    Energy Technology Data Exchange (ETDEWEB)

    O’Donnell, Ryan M. [Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States; Sampaio, Renato N. [Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States; Li, Guocan [Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States; Johansson, Patrik G. [Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States; Ward, Cassandra L. [Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States; Meyer, Gerald J. [Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States


    Excited state proton transfer studies of six Ru polypyridyl compounds with carboxylic acid/carboxylate group(s) revealed that some were photoacids and some were photobases. The compounds [RuII(btfmb)2(LL)]2+, [RuII(dtb)2(LL)]2+, and [RuII(bpy)2(LL)]2+, where bpy is 2,2'-bipyridine, btfmb is 4,4'-(CF3)2-bpy, and dtb is 4,4'-((CH3)3C)2-bpy, and LL is either dcb = 4,4'-(CO2H)2-bpy or mcb = 4-(CO2H),4'-(CO2Et)-2,2'-bpy, were synthesized and characterized. The compounds exhibited intense metal-to-ligand charge-transfer (MLCT) absorption bands in the visible region and room temperature photoluminescence (PL) with long τ > 100 ns excited state lifetimes. The mcb compounds had very similar ground state pKa’s of 2.31 ± 0.07, and their characterization enabled accurate determination of the two pKa values for the commonly utilized dcb ligand, pKa1 = 2.1 ± 0.1 and pKa2 = 3.0 ± 0.2. Compounds with the btfmb ligand were photoacidic, and the other compounds were photobasic. Transient absorption spectra indicated that btfmb compounds displayed a [RuIII(btfmb–)L2]2+* localized excited state and a [RuIII(dcb–)L2]2+* formulation for all the other excited states. Time dependent PL spectral shifts provided the first kinetic data for excited state proton transfer in a transition metal compound. PL titrations, thermochemical cycles, and kinetic analysis (for the mcb compounds) provided self-consistent pKa* values. The ability to make a single ionizable group photobasic or photoacidic through ligand design was unprecedented and was understood based on the orientation of the lowest-lying MLCT excited state dipole relative to the ligand that contained the carboxylic acid group(s).

  15. Flavonoid-induced conversion of catalase to its inactive form--Compound II. (United States)

    Krych, J; Gebicki, J L; Gebicka, L


    Flavonoids (FlaOHs), plant polyphenols, are ubiquitous components of human diet and are known as antioxidants. However, their prooxidant activity has also been reported. We have recently found that FlaOHs inhibit catalase, the heme enzyme which catalyzes the decomposition of hydrogen peroxide (H2O2) into water and molecular oxygen. The catalytic cycle proceeds with the formation of the intermediate, Compound I (Cpd I), an oxoferryl porphyrin π-cation radical, the two-electron oxidation product of a heme group. Under conditions of low H2O2 fluxes and in the presence of an appropriate substrate, Cpd I can undergo one-electron reduction to inactive Compound II (Cpd II), oxoferryl derivative without radical site. Here we show that in vitro, under low fluxes of H2O2, FlaOHs reduce Cpd I to inactive Cpd II. Measurable amounts of Cpd II can be formed even in the presence of reduced nicotinamide adenine dinucleotide phosphate (NADPH) at concentration comparable with the investigated FlaOHs. Possible mechanisms of electron transfer from FlaOH molecule to the heme are discussed.

  16. Theoretical calculation on a compound formed by methyl alcohol and simmondsin

    Directory of Open Access Journals (Sweden)

    İzzet KARA


    Full Text Available Etheric oil results from the esterification reactions of oil acids with alcohols. In these reactions, one molecule water (H2O is composed of H× protons from oil acids and OH- groups which separated from alcohol. Etheric oil is commonly used in food industry, perfume industry and medicine. From this perspective, we need to know physical properties of etheric oil as well as chemical properties. In this study, the highest occupied molecular orbital (HOMO energies, the lowest unoccupied molecular orbital (LUMO energies, the electronic properties (total energy, electronegativity, chemical hardness and softness, NBO analysis and thermodynamic parameters of a compound formed by methyl alcohol and simmondsin have been performed by using Gaussian 09W program. The structural and spectroscopic data of the molecule in the ground state have been calculated by using density functional method (DFT/B3LYP with the 6-31++G(d,p basis set.

  17. The synthesis and properties of some organometallic compounds containing group IV (Ge, Sn)-group II (Zn, Cd) metal---metal bonds

    NARCIS (Netherlands)

    Des Tombe, F.J.A.; Kerk, G.J.M. van der; Creemers, H.M.J.C.; Carey, N.A.D.; Noltes, J.G.


    The reactions of triphenylgermane and triphenyltin hydride with coordinatively saturated organozinc or organocadmium compounds give organometallic complexes containing Group IV (Ge, Sn)-Group II(Zn, Cd) metal---metal bonds. The 2,2′-bipyridine complexes show solvent-dependent charge-transfer

  18. Preparation process of an yttrium (or one rare earth), one alkaline earth metal, copper and oxygen superconductive compound

    International Nuclear Information System (INIS)

    Michel, C.; Pham Ai-Qooc; Raveau, B.


    The present invention describes the fabrication at atmospheric pressure of a compound based on yttrium (or a rare earth), one alkaline earth metal, copper, and oxygen so as to get a high-tc superconductor material. 2 refs

  19. Hybrid compounds of Keggin polyoxotungstate with transition metal ion as the central atom. Synthesis, structure and properties (United States)

    Li, Xiao-Min; Chen, Ya-Guang; Shi, Tian


    The compounds (Hbipy)2[Co(bipy)2(H2O)4]2(CoW12O40)·2bipy·7H2O (1) and [Ni2(Hbipy)2(bipy)(H2O)4(H2W12O40)]·5H2O (2) (bipy = 4,4-bipyridine) were synthesized hydrothermally and characterized by elemental analysis, IR spectroscopy, TG analyses, solid ultraviolet diffuse spectroscopy and single crystal X-ray diffraction method. In 1 the complex ions, [Co(bipy)2(H2O)4]2+, construct a supramolecular layer through π-π stacking interaction. The heteropolyanions with central Co atom and supramolecular layers are linked by hydrogen bonds. In 2 a 2D structure is formed from metatungstate anions and binuclear Ni-bipy complexes through the coordination of metatungstate anions and bipy to Ni ions. Between the layers and bipyridine molecules are the hydrogen bond interactions. The formation of 1 and 2 shows that the solution acidity and metal ions influence greatly the structure of the compounds. Solid ultraviolet diffusion results indicate that the compounds 1 and 2 are potential semiconductor materials. In 1 and 2 there exists a weak antiferromagnetic interaction.

  20. Micro- and nano-spheres of low melting point metals and alloys, formed by ultrasonic cavitation. (United States)

    Friedman, H; Reich, S; Popovitz-Biro, R; von Huth, P; Halevy, I; Koltypin, Y; Gedanken, A; Porat, Z


    Metals and alloys of low melting points (metals into microspheres that solidify rapidly upon cooling. This method has been applied to seven pure metals (Ga, In, Sn, Bi, Pb, Zn, Hg) and two eutectic alloys of gold (Au-Ge and Au-Si). The morphology and composition of the resulting microspheres were examined by SEM and EDS. Eutectic Au-Si formed also crystalline Au nanoparticles, which were separated and studied by HRTEM. Copyright © 2012 Elsevier B.V. All rights reserved.

  1. A traveling wave ultrasonic motor with a metal/polymer-matrix material compound stator (United States)

    Li, Jinbang; Liu, Shuo; Zhou, Ningning; Yu, Aibing; Cui, Yuguo; Chen, Pengfei


    This study proposes a traveling wave ultrasonic motor with a metal/polymer-matrix material compound stator. The stator is composed of a metal ring and polymer-matrix teeth. The resonance frequency of the stator with different structural dimensions was analyzed by the finite element method. From the results, the structure parameters of the metal ring were obtained. The effects of the density and elastic modulus of the tooth material on the resonance frequency were also investigated. A viscoelastic contact model was built to explore the contact state between the compound stator and rotor. Considering the density, elastic modulus and tribological properties, the tooth material was prepared by a molding process. The load-torque and efficiency-torque characteristics of the motor with different tooth thicknesses were measured under different preloads using a preload controlled ultrasonic motor test device. The maximum no-load speed of the motor was about 85 r min-1 with a tooth thickness of 3 mm and a preload of 100 N, the maximum stall torque of the motor was about 0.5 N · m with a tooth thickness of 4 mm and a preload of 125 N, and a maximum efficiency of about 5.5% occurred with a tooth thickness of 4 mm, a preload of 100 N and a torque of 0.3 N · m. The main merits of the proposed ultrasonic motor are low cost, light weight, high processing efficiency and long life.

  2. Ion spectra of the metal vapor vacuum arc ion source with compound and alloy cathodes (United States)

    Sasaki, Jun; Brown, Ian G.


    In metal vapor vacuum arc (MEVVA) ion sources, vacuum arc plasma with cathodes of single, pure elements has been utilized for the production of metal ions. In this study, we have investigated the charge state distributions of ions produced in vacuum arc plasmas in a MEVVA ion source for the case when the cathode is an alloy or a compound material. The ion charge state spectra were analyzed by means of a time-of-flight apparatus. We have compared the ion spectra for a cathode of an alloy or a compound material with its constituent elements: TiC/TiN/TiO2/Ti/C, SiC/Si/C, WC/W/C U/UN/(UN-ZrC)/Zr/C, and brass/Zn/Cu. We find that the MEVVA produces ions of all constituent elements in the compound and the alloy cathodes. The charge state distribution of each element differs, however, from the charge state distribution obtained in the vacuum arc with a cathode made of the pure, single constituent element. Fractional values of the total ion numbers of each constituent element in the extracted beam depart from the stoichiometry of the elements in the cathode material. In an operation with a TiC cathode, we irradiated a 304 stainless-steel plate with the extracted beam. Results from glow-discharge spectroscopy (GDS) of the surface show that both titanium and carbon are implanted in the substrate after the irradiation.

  3. Development of metallic system multi-composite materials for compound environment and corrosion monitoring technology

    International Nuclear Information System (INIS)

    Kiuchi, Kiyoshi


    For the structural materials used for the pressure boundary of nuclear power plants and others, the long term durability over several decades under the compound environment, in which the action of radiation and the corrosion and erosion in the environment of use are superposed, is demanded. To its controlling factors, the secular change of materials due to irradiation ageing and the chemical and physical properties of extreme compound environment are related complicatedly. In the first period of this research, the development of the corrosion-resistant alloys with the most excellent adaptability to environments was carried out by the combination of new alloy design and alloy manufacturing technology. In the second period, in order to heighten the adaptability as the pressure boundary materials between different compound environments, the creation of metallic system multi-composite materials has been advanced. Also corrosion monitoring technique is being developed. The stainless steel for water-cooled reactors, the wear and corrosion-resistant superalloy for reactor core, the corrosion-resistant alloy and the metallic refractory material for reprocessing nitric acid reaction vessels are reported. (K.I.)

  4. Novel Bioactive Titanate Layers Formed on Ti Metal and Its Alloys by Chemical Treatments

    Directory of Open Access Journals (Sweden)

    Tadashi Kokubo


    Full Text Available Sodium titanate formed on Ti metal by NaOH and heat treatments induces apatite formation on its surface in a body environment and bonds to living bone. These treatments have been applied to porous Ti metal in artificial hip joints, and have been used clinically in Japan since 2007. Calcium titanate formed on Ti-15Zr-4Nb-4Ta alloy by NaOH, CaCl2, heat, and water treatments induces apatite formation on its surface in a body environment. Titanium oxide formed on porous Ti metal by NaOH, HCl, and heat treatments exhibits osteoinductivity as well as osteoconductivity. This is now under clinical tests for application to a spinal fusion device.

  5. Feasibility Study on Flexibly Reconfigurable Roll Forming Process for Sheet Metal and Its Implementation

    Directory of Open Access Journals (Sweden)

    Jun-Seok Yoon


    Full Text Available A multicurved sheet metal surface for a skin structure has usually been manufactured using a conventional die forming process involving the use of both a die and a press machine in accordance with the product shape. However, such processes are economically inefficient because additional production costs are incurred for the development and management of forming tools. To overcome this drawback, many alternative processes have been developed; however, these still suffer from problems due to defects such as dimples and wrinkles occurring in the sheet. In this study, a new sheet metal forming process called the flexibly reconfigurable roll forming (FRRF process is proposed as an alternative to existing processes. Unlike existing processes, FRRF can reduce additional production costs resulting from material loss and significantly reduce forming errors. Furthermore, it involves the use of a smaller apparatus. The methodology and applicable procedure of the FRRF process are described. Numerical forming simulations of representative multicurved sheet surfaces are conducted using FEM. In addition, a simple apparatus is developed for verifying the feasibility of this process, and a doubly curved metal is formed to verify the applicability of the reconfigurable roller, a critical component in this forming process.

  6. Metal Abundances of KISS Galaxies. VI. New Metallicity Relations for the KISS Sample of Star-forming Galaxies (United States)

    Hirschauer, Alec S.; Salzer, John J.; Janowiecki, Steven; Wegner, Gary A.


    We present updated metallicity relations for the spectral database of star-forming galaxies (SFGs) found in the KPNO International Spectroscopic Survey (KISS). New spectral observations of emission-line galaxies obtained from a variety of telescope facilities provide oxygen abundance information. A nearly fourfold increase in the number of KISS objects with robust metallicities relative to our previous analysis provides for an empirical abundance calibration to compute self-consistent metallicity estimates for all SFGs in the sample with adequate spectral data. In addition, a sophisticated spectral energy distribution fitting routine has provided robust calculations of stellar mass. With these new and/or improved galaxy characteristics, we have developed luminosity–metallicity (L–Z) relations, mass–metallicity (M *–Z) relations, and the so-called fundamental metallicity relation (FMR) for over 1450 galaxies from the KISS sample. This KISS M *–Z relation is presented for the first time and demonstrates markedly lower scatter than the KISS L–Z relation. We find that our relations agree reasonably well with previous publications, modulo modest offsets due to differences in the strong emission line metallicity calibrations used. We illustrate an important bias present in previous L–Z and M *–Z studies involving direct-method (T e ) abundances that may result in systematically lower slopes in these relations. Our KISS FMR shows consistency with those found in the literature, albeit with a larger scatter. This is likely a consequence of the KISS sample being biased toward galaxies with high levels of activity.

  7. Three-step metal-promoted allene-based preparation of bis(heterocyclic) cyclophanes from carbonyl compounds. (United States)

    Alcaide, Benito; Almendros, Pedro; Quirós, M Teresa; Lázaro, Carlos; Torres, M Rosario


    A straightforward metal-mediated method for the synthesis of bis(dihydrofuryl) cyclophane scaffolds from carbonyl compounds has been developed. The combination of the dihydrofuran moiety with different heterocycles such as β-lactams and sugars allows high levels of skeletal diversity. The process comprises indium-promoted one-pot carbonyl bis(allenylation) and gold- or palladium-catalyzed double cyclization in the resulting bis(allenols), followed by selective ruthenium-catalyzed macrocyclization. In some cases, the method has been successfully applied to the synthesis of the challenging Z-isomers. The E- versus Z-stereochemistry of the metathesis-formed double bonds could not be assigned taking into consideration the usual coupling constants criteria, but a diagnostic based on the chemical shifts of the two olefinic protons located at the macrocyclic double bond was established.

  8. Metal waste forms from the electrometallurgical treatment of spent nuclear fuel

    International Nuclear Information System (INIS)

    Abraham, D.P.; McDeavitt, S.M.; Park, J.


    Stainless steel-zirconium alloys are being developed for the disposal of radioactive metal isotopes isolated using an electrometallurgical treatment technique to treat spent nuclear fuel. The nominal waste forms are stainless steel-15 wt% zirconium alloy and zirconium-8 wt% stainless steel alloy. These alloys are generated in yttria crucibles by melting the starting materials at 1,600 C under an argon atmosphere. This paper discusses the microstructures, corrosion and mechanical test results, and thermophysical properties of the metal waste form alloys

  9. Power characteristics of the metal compounds formation process during the friction stir welding

    Directory of Open Access Journals (Sweden)

    Rzaev Radmir


    Full Text Available An influence of the power characteristics on the formation process of the uniform metals compound during the welding with friction stirringis being examined in this article.A dependency between the machine-tool engine power input and the instrument tilt during the FSW for the aluminum alloy AD31, copper alloy M1, titanium alloy OT4-1 and steel St-3 low-alloyed has been explored. A question of the stabilization of power consumption process while the establishment of superplastic condition of welded metal during the FSW has also been reviewed. A dependency revealed between the power characteristics, the geometry of the formation, the rotation speeds, the longitudinal displacement of the tool and its dimensions for fixed values of the parameters during the FSW.

  10. The effect of various naturally occurring metal-binding compounds on the electrochemical behavior of aluminum

    Energy Technology Data Exchange (ETDEWEB)

    Hansen, D.C.; McCafferty, E. [Naval Research lab., Washington, DC (United States)


    Naturally occurring biological molecules are of considerable interest as possible corrosion inhibitors because of increased attention on the development of environmentally compatible, nonpolluting corrosion inhibitors. A hydroxamate yeast siderophore (rhodotorulic acid), a catecholate bacterial siderophore (parabactin), an adhesive protein from the blue mussel Mytilus edulis, and two metal-binding compounds isolated from the tomato and sunflower roots, namely, chlorogenic and caffeic acid, respectively, were adsorbed from solution onto pure aluminum (99.9995%) and their effect on the critical pitting potential and polarization resistance in deaerated 0.1 M NaCl was measured. These measurements were made using anodic polarization and ac impedance spectroscopy. The catechol-containing siderophore has an inhibitive effect on the critical pitting potential of aluminum in 0.1 M NaCl and increases the polarization resistance of the metal over time. The adhesive protein from the blue mussel is also effective in inhibiting the pitting of aluminum.

  11. The metal-driven biogeochemistry of gaseous compounds in the environment

    CERN Document Server

    Kroneck, Peter MH


    MILS-14 provides a most up-to-date view of the exciting biogeochemistry of gases in our environment as driven mostly by microorganisms. These employ a machinery of sophisticated metalloenzymes, where especially transition metals (such as Fe, Ni, Cu, Mo, W) play a fundamental role, that is, in the activation, transformation and syntheses of gases like dihydrogen, methane, carbon monoxide, acetylene and those of the biological nitrogen and sulfur cycles. The Metal-Driven Biogeochemistry of Gaseous Compounds in the Environment is a vibrant research area based mainly on structural and microbial biology, inorganic biological chemistry and environmental biochemistry. All this is covered in an authoritative manner in 11 stimulating chapters, written by 26 internationally recognized experts and supported by nearly 1200 references, informative tables and about 100 illustrations (two thirds in color). MILS-14 also provides excellent information for teaching. Peter M. H. Kroneck is a bioinorganic chemist who is explorin...

  12. High-resolution x-ray absorption spectroscopy studies of metal compounds in neurodegenerative brain tissue (United States)

    Collingwood, J. F.; Mikhaylova, A.; Davidson, M. R.; Batich, C.; Streit, W. J.; Eskin, T.; Terry, J.; Barrea, R.; Underhill, R. S.; Dobson, J.


    Fluorescence mapping and microfocus X-ray absorption spectroscopy are used to detect, locate and identify iron biominerals and other inorganic metal accumulations in neurodegenerative brain tissue at sub-cellular resolution (autopsy brain tissue. Technical developments include use of microfocus diffraction to obtain structural information about biominerals in-situ, and depositing sample location grids by lithography for the location of anomalies by conventional microscopy. The combined techniques provide a breakthrough in the study of both intra- and extra-cellular iron compounds and related metals in tissue. The information to be gained from this approach has implications for future diagnosis and treatment of neurodegeneration, and for our understanding of the mechanisms involved.

  13. Precious metal compounds and recovery. Fischer-Tropsch catalysts and catalysts for hydroformylation and oxo processes

    Energy Technology Data Exchange (ETDEWEB)

    Schapp, J.; Arndt, M. [W.C. Heraeus GmbH, Hanau (Germany); Meyer, H. [Heraeus Metal Processing Inc., Santa Fe Springs, CA (United States)


    Solid-phase Fischer-Tropsch catalysts, which are used in the emerging field of interest known as ''Gas-to-Liquid'' (GTL), consist to a high percentage of cobalt. In addition, they contain on a value basis, a considerable amount of platinum group metals or rhenium as promoters. Therefore, there is an imperative need for economically feasible recycling processes triggered not only by the value of the metals in spent Fischer-Tropsch catalysts, but also by the potentially limited availability of promoters like rhenium. Heraeus, as a precious metal expert, is supporting this important technology with its profound know-how in developing tailor-made hydrometallurgical recycling processes for all kinds of catalyst systems. Besides giving an overview of state-of-the-art recovery processes, this paper will clarify the economic and environmental aspects involved. Hydroformylation and oxo processes are technologies which consume a major percentage of homogeneous catalysts worldwide. The focus lies on organometallic compounds with rhodium as the catalytic center. With significant rises of the rhodium price, many companies are being pushed to look more closely at the involved recycling terms. Accordingly, Heraeus is proud to offer its HeraCYCLE {sup registered} recovery process recently developed for homogeneous catalysts in particular. Furthermore, Heraeus manufactures the required quantities of fresh homogeneous catalysts ensuring highest quality standards. Key economic, technical, and environmental aspects of the precious metal loops will be covered by this paper. (orig.)

  14. Mechanism of dihydrogen cleavage by high-valent metal oxo compounds: experimental and computational studies. (United States)

    Collman, J P; Slaughter, L M; Eberspacher, T A; Strassner, T; Brauman, J I


    The oxidation of dihydrogen by metal tetraoxo compounds was investigated. Kinetic measurements of the oxidations of H(2) by MnO(4)(-) and RuO(4), performed by UV-vis spectroscopy, showed these reactions to be quite rapid at 25 degrees C (k(1) approximately (3-6) x 10(-2) M(-1) s(-1)). Rates measured for H(2) oxidation by MnO(4)(-) in aqueous solution (using KMnO(4)) and in chlorobenzene (using (n)Bu(4)NMnO(4)) revealed only a minor solvent effect on the reaction rate. Substantial kinetic isotope effects [(k(H)2/k(D)2 = 3.8(2) (MnO(4)(-), aq), 4.5(5) (MnO(4)(-), C(6)H(5)Cl soln), and 1.8(6) (RuO(4), CCl(4) soln)] indicated that H-H bond cleavage is rate determining and that the mechanism of dihydrogen cleavage is likely similar in aqueous and organic solutions. Third-row transition-metal oxo compounds, such as OsO(4), ReO(4)(-), and MeReO(3), were found to be completely unreactive toward H(2). Experiments were performed to probe for a catalytic hydrogen/deuterium exchange between D(2) and H(2)O as possible evidence of dihydrogen sigma-complex intermediates, but no H/D exchange was observed in the presence of various metal oxo compounds at various pH values. In addition, no inhibition of RuO(4)-catalyzed hydrocarbon oxidation by H(2) was observed. On the basis of the available evidence, a concerted mechanism for the cleavage of H(2) by metal tetraoxo compounds is proposed. Theoretical models were developed for pertinent MnO(4)(-) + H(2) transition states using density functional theory in order to differentiate between concerted [2 + 2] and [3 + 2] scissions of H(2). The density functional theory calculations strongly favor the [3 + 2] mechanism and show that the H(2) cleavage shares some mechanistic features with related hydrocarbon oxidation reactions. The calculated activation energy for the [3 + 2] pathway (DeltaH(++) = 15.4 kcal mol(-1)) is within 2 kcal mol(-1) of the experimental value.

  15. Near-net-shape manufacturing: Spray-formed metal matrix composites and tooling (United States)

    Mchugh, Kevin M.


    Spray forming is a materials processing technology in which a bulk liquid metal is converted to a spray of fine droplets and deposited onto a substrate or pattern to form a near-net-shape solid. The technology offers unique opportunities for simplifying materials processing without sacrificing, and oftentimes substantially improving, product quality. Spray forming can be performed with a wide range of metals and nonmetals, and offers property improvements resulting from rapid solidification (e.g. refined microstructures, extended solid solubilities and reduced segregation). Economic benefits result from process simplification and the elimination of unit operations. The Idaho National Engineering Laboratory is developing a unique spray-forming method, the Controlled Aspiration Process (CAP), to produce near-net-shape solids and coatings of metals, polymers, and composite materials. Results from two spray-accompanying technical and economic benefits. These programs involved spray forming aluminum strip reinforced with SiC particulate, and the production of tooling, such as injection molds and dies, using low-melting-point metals.

  16. A guide for validation of FE-Simulations in bulk metal forming

    International Nuclear Information System (INIS)

    Tekkaya, A. Erman


    Numerical analysis of metal forming processes is an everyday practice in industry. Forming loads, material flow, forming defects such as underfills, laps and even cracks, stresses in dies and punches, as well as product properties like new hardness distribution, dimensional accuracies and residual stresses are predicted by numerical analysis and used for technology generation. Most of the numerical analysis is done by the finite element method made available for engineers and technicians by numerous by powerful commercial software packages. These software packages act as black-boxes and usually hide the complicated numerical procedures and even their crucial parameters from the applier. Therefore, the question arises during the industrial applications: how accurate is the simulation and how can the results can be assessed? The aim of this paper is to provide a guideline to assess the results of metal forming simulations. Although some ideas are valid for any metal forming process, bulk forming is the process concern. The paper will address firstly the possible sources of error in a finite element analysis of bulk forming processes. Then, some useful elementary knowledge will be summarized. Various levels of validation such as result and ability validation and assessment will be discussed. Finally, interpretation of results will be treated. In this content also some suggestions will be given. (author)

  17. Incremental electrohydraulic forming - A new approach for the manufacture of structured multifunctional sheet metal blanks (United States)

    Djakow, Eugen; Springer, Robert; Homberg, Werner; Piper, Mark; Tran, Julian; Zibart, Alexander; Kenig, Eugeny


    Electrohydraulic Forming (EHF) processes permit the production of complex, sharp-edged geometries even when high-strength materials are used. Unfortunately, the forming zone is often limited as compared to other sheet metal forming processes. The use of a special industrial-robot-based tool setup and an incremental process strategy could provide a promising solution for this problem. This paper describes such an innovative approach using an electrohydraulic incremental forming machine, which can be employed to manufacture the large multifunctional and complex part geometries in steel, aluminium, magnesium and reinforced plastic that are employed in lightweight constructions or heating elements.

  18. Metal waste forms from treatment of EBR-II spent fuel

    International Nuclear Information System (INIS)

    Abraham, D. P.


    Demonstration of Argonne National Laboratory's electrometallurgical treatment of spent nuclear fuel is currently being conducted on irradiated, metallic driver fuel and blanket fuel elements from the Experimental Breeder Reactor-II (EBR-II) in Idaho. The residual metallic material from the electrometallurgical treatment process is consolidated into an ingot, the metal waste form (MWF), by employing an induction furnace in a hot cell. Scanning electron microscopy (SEM) and chemical analyses have been performed on irradiated cladding hulls from the driver fuel, and on samples from the alloy ingots. This paper presents the microstructures of the radioactive ingots and compares them with observations on simulated waste forms prepared using non-irradiated material. These simulated waste forms have the baseline composition of stainless steel - 15 wt % zirconium (SS-15Zr). Additions of noble metal elements, which serve as surrogates for fission products, and actinides are made to that baseline composition. The partitioning of noble metal and actinide elements into alloy phases and the role of zirconium for incorporating these elements is discussed in this paper

  19. Friction and lubrication modeling in sheet metal forming simulations of a Volvo XC90 inner door (United States)

    Sigvant, M.; Pilthammar, J.; Hol, J.; Wiebenga, J. H.; Chezan, T.; Carleer, B.; van den Boogaard, A. H.


    The quality of sheet metal formed parts is strongly dependent on the tribology, friction and lubrication conditions that are acting in the actual production process. Although friction is of key importance, it is currently not considered in detail in stamping simulations. This paper presents a selection of results considering friction and lubrication modeling in sheet metal forming simulations of the Volvo XC90 right rear door inner. For this purpose, the TriboForm software is used in combination with the AutoForm software. Validation of the simulation results is performed using door inner parts taken from the press line in a full-scale production run. The results demonstrate the improved prediction accuracy of stamping simulations by accounting for accurate friction and lubrication conditions, and the strong influence of friction conditions on both the part quality and the overall production stability.

  20. The effect of tooling deformation on process control in multistage metal forming (United States)

    Havinga, Jos; van den Boogaard, Ton


    Forming of high-strength steels leads to high loads within the production process. In multistage metal forming, the loads in different process stages are transferred to the other stages through elastic deformation of the stamping press. This leads to interactions between process steps, affecting the process forces in each stage and the final geometry of the product. When force measurements are used for control of the metal forming process, it is important to understand these interactions. In his work, interactions within an industrial multistage forming process are investigated. Cutting, deepdrawing, forging and bending steps are performed in the production process. Several test runs of a few thousand products each were performed to gather information about the process. Statistical methods are used to analyze the measurements. Based on the cross-correlation between the force measurements of different stages, it can be shown that the interactions between the process steps are caused by elastic deformation of the tooling and the stamping press.

  1. Periodicity effects on compound waves guided by a thin metal slab sandwiched between two periodically nonhomogeneous dielectric materials (United States)

    Chiadini, Francesco; Fiumara, Vincenzo; Scaglione, Antonio; Lakhtakia, Akhlesh


    Surface-plasmon-polariton waves can be compounded when a sufficiently thin metal layer is sandwiched between two half spaces filled with dissimilar periodically nonhomogeneous dielectric materials. We solved the boundary-value problem for compound waves guided by a layer of a homogeneous and isotropic metal sandwiched between a structurally chiral material (SCM) and a periodically multilayered isotropic dielectric (PMLID) material. We found that the periodicities of the PMLID material and the SCM are crucial to excite a multiplicity of compound guided waves arising from strong coupling between the two interfaces.

  2. Springback prediction in sheet metal forming process based on the hybrid SA

    International Nuclear Information System (INIS)

    Guo Yuqin; Jiang Hong; Wang Xiaochun; Li Fuzhu


    In terms of the intensive similarity between the sheet metal forming-springback process and that of the annealing of metals, it is suggested that the simulation of the sheet metal forming process is performed with the Nonlinear FEM and the springback prediction is implemented by solving the large-scale combinational optimum problem established on the base of the energy descending and balancing in deformed part. The BFGS-SA hybrid SA approach is proposed to solve this problem and improve the computing efficiency of the traditional SA and its capability of obtaining the global optimum solution. At the same time, the correlative annealing strategies for the SA algorithm are determined in here. By comparing the calculation results of sample part with those of experiment measurement at the specified sections, the rationality of the schedule of springback prediction used and the validity of the BFGS-SA algorithm proposed are verified

  3. Linking structure to fragility in bulk metallic glass-forming liquids

    International Nuclear Information System (INIS)

    Wei, Shuai; Stolpe, Moritz; Gross, Oliver; Gallino, Isabella; Hembree, William; Busch, Ralf; Evenson, Zach; Bednarcik, Jozef; Kruzic, Jamie J.


    Using in-situ synchrotron X-ray scattering, we show that the structural evolution of various bulk metallic glass-forming liquids can be quantitatively connected to their viscosity behavior in the supercooled liquid near T g . The structural signature of fragility is identified as the temperature dependence of local dilatation on distinct key atomic length scales. A more fragile behavior results from a more pronounced thermally induced dilatation of the structure on a length scale of about 3 to 4 atomic diameters, coupled with shallower temperature dependence of structural changes in the nearest neighbor environment. These findings shed light on the structural origin of viscous slowdown during undercooling of bulk metallic glass-forming liquids and demonstrate the promise of predicting the properties of bulk metallic glasses from the atomic scale structure

  4. Evaluation of the non-aldehyde volatile compounds formed during deep-fat frying process. (United States)

    Zhang, Qing; Wan, Chong; Wang, Chenzhi; Chen, Hong; Liu, Yaowen; Li, Suqing; Lin, Derong; Wu, Dingtao; Qin, Wen


    To investigate the non-aldehyde volatile profile resulting from deep-fat frying, volatile compounds formed during the processes of heating soybean oil (SO), frying wheat dough (WD), and frying chicken breast meat (CBM) were comparatively studied. By using gas chromatography-mass spectrometry and internal standard method, alkanes, alkenes, alkynes, alcohols, ketones, nitrogen-containing volatiles (NCVs), and other volatiles were qualitatively and relatively quantitatively detected. NCVs were detected only in CBM-fried oil samples. Some volatiles (e.g. 2-pentylfuran and 2-pentylpyridine) were observed to increase in concentration, whereas others (e.g. 4-methyl-1,4-heptadiene and 7-methyl-3,4-octadiene) were observed to first increase and then decrease in concentration as the heating or frying time increased. Reduced quantity and concentrations of volatiles were observed in the food-fried oil samples which might be related to the intensified reactions induced by food components. The detection of some harmful volatiles in considerable concentrations indicated further attention might be paid to the safety of deep-fat frying. Copyright © 2017 Elsevier Ltd. All rights reserved.

  5. Behavioural effects of compounds co-consumed in dietary forms of caffeinated plants. (United States)

    Haskell, C F; Dodd, F L; Wightman, E L; Kennedy, D O


    Research into the cognitive and mood effects of caffeine in human subjects has highlighted some fairly robust and well-accepted effects. However, the majority of these studies have focused on caffeine in isolation; whilst caffeine is normally consumed in the form of plant-derived products and extracts that invariably contain other potentially bioactive phytochemicals. The aim of the present review is to consider the possible mechanisms of action of co-occurring phytochemicals, and any epidemiological evidence suggesting that they contribute to potential health benefits ascribed to caffeine. Intervention studies to date that have been conducted to explore the effects on brain function of the non-caffeine components in caffeine-bearing plants (coffee, tea, cocoa, guaraná), either alone or in combination with caffeine, will also be summarised. Research is beginning to accumulate showing independent effects for several of the phytochemicals that co-occur with caffeine, and/or a modulation of the effects of caffeine when it is co-consumed with these naturally concomitant phytochemicals. The present review highlights that more research aimed at understanding the effects of these compounds is needed and, more importantly, the synergistic relationship that they may have with caffeine.

  6. Bonding Form Analysis of Metals and Sulfur Fractionation in Methanol-Grown Anaerobic Granular Sludge

    NARCIS (Netherlands)

    Veen, van der A.; Gonzalez Fermoso, F.; Lens, P.N.L.


    This study investigates the metal and sulfur bonding form distribution in mesophilic (30 °C, pH 7) methanol-grown anaerobic granular sludge from upflow anaerobic sludge bed reactors operating at an organic loading rate of 3.8 g CH3OH-COD/L d. This was achieved by applying a modified Tessier

  7. Multi-scale friction modeling for sheet metal forming: the mixed lubrication regime

    NARCIS (Netherlands)

    Hol, J.; Meinders, Vincent T.; Geijselaers, Hubertus J.M.; van den Boogaard, Antonius H.


    A mixed lubrication friction model is presented to accurately account for friction in sheet metal forming FE sim-ulations. The advanced friction model comprises a coupling between a hydrodynamic friction model and a boundary lubrication friction model, based on the lubricant film thickness. Mixed

  8. Friction and lubrication modeling in sheet metal forming simulations of a Volvo XC90 inner door

    NARCIS (Netherlands)

    Sigvant, M.; Pilthammar, J.; Hol, J.; Wiebenga, J.H.; Chezan, A.R.; Carleer, B.D.; Carleer, B.D.; van den Boogaard, Antonius H.


    The quality of sheet metal formed parts is strongly dependent on the tribology, friction and lubrication conditions that are acting in the actual production process. Although friction is of key importance, it is currently not considered in detail in stamping simulations. This paper presents a

  9. Wrinkling criteria in sheet metal forming for single sided contact situation and its application

    NARCIS (Netherlands)

    Nagy, Geza T.; Valkering, Kasper; Huetink, Han


    The general wrinkling theory based on the rate formulation of the principle of virtual work has been applied in a number of studies on wrinkling during sheet metal forming. No contact with the die was allowed. In this study it is shown that with the right choice of wrinkling modes, the theory can

  10. Testing and modelling of industrial tribo-systems for sheet metal forming

    DEFF Research Database (Denmark)

    Friis, Kasper Leth; Nielsen, Peter Søe; Bay, Niels


    Galling is a well-known problem in sheet metal forming of tribological difficult materials such as stainless steel. In this work new, environmentally friendly lubricants and wear resistant tool materials are tested in a laboratory environment using a strip reduction test as well as in a real prod...

  11. Methodology development for the sustainability process assessment of sheet metal forming of complex-shaped products

    International Nuclear Information System (INIS)

    Pankratov, D L; Kashapova, L R


    A methodology was developed for automated assessment of the reliability of the process of sheet metal forming process to reduce the defects in complex components manufacture. The article identifies the range of allowable values of the stamp parameters to obtain defect-free punching of spars trucks. (paper)

  12. Static friction in rubber-metal contacts with application to rubber pad forming processes

    NARCIS (Netherlands)

    Deladi, E.L.


    A static friction model suitable for rubber-metal contact is presented in this dissertation. In introduction, the motivation and the aims of the research are introduced together with the background regarding the related industrial application, which is the rubber pad forming process.

  13. Hygroscopicity of secondary organic aerosols formed by oxidation of cycloalkenes, monoterpenes, sesquiterpenes, and related compounds

    Directory of Open Access Journals (Sweden)

    V. Varutbangkul


    Full Text Available A series of experiments has been conducted in the Caltech indoor smog chamber facility to investigate the water uptake properties of aerosol formed by oxidation of various organic precursors. Secondary organic aerosol (SOA from simple and substituted cycloalkenes (C5-C8 is produced in dark ozonolysis experiments in a dry chamber (RH~5%. Biogenic SOA from monoterpenes, sesquiterpenes, and oxygenated terpenes is formed by photooxidation in a humid chamber (~50% RH. Using the hygroscopicity tandem differential mobility analyzer (HTDMA, we measure the diameter-based hygroscopic growth factor (GF of the SOA as a function of time and relative humidity. All SOA studied is found to be slightly hygroscopic, with smaller water uptake than that of typical inorganic aerosol substances. The aerosol water uptake increases with time early in the experiments for the cycloalkene SOA, but decreases with time for the sesquiterpene SOA. This behavior could indicate competing effects between the formation of more highly oxidized polar compounds (more hygroscopic, and formation of longer-chained oligomers (less hygroscopic. All SOA also exhibit a smooth water uptake with RH with no deliquescence or efflorescence. The water uptake curves are found to be fitted well with an empirical three-parameter functional form. The measured pure organic GF values at 85% RH are between 1.09–1.16 for SOA from ozonolysis of cycloalkenes, 1.01–1.04 for sesquiterpene photooxidation SOA, and 1.06–1.10 for the monoterpene and oxygenated terpene SOA. The GF of pure SOA (GForg in experiments in which inorganic seed aerosol is used is determined by assuming volume-weighted water uptake (Zdanovskii-Stokes-Robinson or 'ZSR' approach and using the size-resolved organic mass fraction measured by the Aerodyne Aerosol Mass Spectrometer. Knowing the water content associated with the inorganic fraction yields GForg values. However, for each precursor, the GForg values computed from different

  14. Metal-Organic Nanosheets Formed via Defect-Mediated Transformation of a Hafnium Metal-Organic Framework. (United States)

    Cliffe, Matthew J; Castillo-Martínez, Elizabeth; Wu, Yue; Lee, Jeongjae; Forse, Alexander C; Firth, Francesca C N; Moghadam, Peyman Z; Fairen-Jimenez, David; Gaultois, Michael W; Hill, Joshua A; Magdysyuk, Oxana V; Slater, Ben; Goodwin, Andrew L; Grey, Clare P


    We report a hafnium-containing MOF, hcp UiO-67(Hf), which is a ligand-deficient layered analogue of the face-centered cubic fcu UiO-67(Hf). hcp UiO-67 accommodates its lower ligand:metal ratio compared to fcu UiO-67 through a new structural mechanism: the formation of a condensed "double cluster" (Hf 12 O 8 (OH) 14 ), analogous to the condensation of coordination polyhedra in oxide frameworks. In oxide frameworks, variable stoichiometry can lead to more complex defect structures, e.g., crystallographic shear planes or modules with differing compositions, which can be the source of further chemical reactivity; likewise, the layered hcp UiO-67 can react further to reversibly form a two-dimensional metal-organic framework, hxl UiO-67. Both three-dimensional hcp UiO-67 and two-dimensional hxl UiO-67 can be delaminated to form metal-organic nanosheets. Delamination of hcp UiO-67 occurs through the cleavage of strong hafnium-carboxylate bonds and is effected under mild conditions, suggesting that defect-ordered MOFs could be a productive route to porous two-dimensional materials.

  15. Evidence of cross-cutting and redox reaction in Khatyrka meteorite reveals metallic-Al minerals formed in outer space. (United States)

    Lin, Chaney; Hollister, Lincoln S; MacPherson, Glenn J; Bindi, Luca; Ma, Chi; Andronicos, Christopher L; Steinhardt, Paul J


    We report on a fragment of the quasicrystal-bearing CV3 carbonaceous chondrite Khatyrka recovered from fine-grained, clay-rich sediments in the Koryak Mountains, Chukotka (Russia). We show higher melting-point silicate glass cross-cutting lower melting-point Al-Cu-Fe alloys, as well as unambiguous evidence of a reduction-oxidation reaction history between Al-Cu-Fe alloys and silicate melt. The redox reactions involve reduction of FeO and SiO 2 to Fe and Fe-Si metal, and oxidation of metallic Al to Al 2 O 3 , occurring where silicate melt was in contact with Al-Cu-Fe alloys. In the reaction zone, there are metallic Fe and Fe-Si beads, aluminous spinel rinds on the Al-Cu-Fe alloys, and Al 2 O 3 enrichment in the silicate melt surrounding the alloys. From this and other evidence, we demonstrate that Khatyrka must have experienced at least two distinct events: first, an event as early as 4.564 Ga in which the first Al-Cu-Fe alloys formed; and, second, a more recent impact-induced shock in space that led to transformations of and reactions between the alloys and the meteorite matrix. The new evidence firmly establishes that the Al-Cu-Fe alloys (including quasicrystals) formed in outer space in a complex, multi-stage process.

  16. Organocatalyzed α-Sulfenylation of carbonyl compounds using N-formly/Acyl Sulfenmides

    Energy Technology Data Exchange (ETDEWEB)

    Noh, Hyeon Wan; Lee, Chan; Jang, Hye Young [Dept. of Energy Systems Research, Ajou University, Suwon (Korea, Republic of)


    α-Sulfenylation of aldehydes and ketones using N-formyl and N-acyl sulfenamides, prepared by Cu-catalyzed aerobic coupling of amides and thiols, was achieved in the presence of cyclic secondary amine⋅HCl catalysts. To obtain various sulfur-functionalized carbonyl compounds, sulfenamides containing aromatic and aliphatic organosulfur were investigated. As carbonyl compounds, cyclic and acyclic ketones, 1,3-dicarbonyl compounds, and aldehydes were investigated, affording the desired α-sulfenylation products in good yields.

  17. Impedance study of tea with added taste compounds using conducting polymer and metal electrodes. (United States)

    Dhiman, Mopsy; Kapur, Pawan; Ganguli, Abhijit; Singla, Madan Lal


    In this study the sensing capabilities of a combination of metals and conducting polymer sensing/working electrodes for tea liquor prepared by addition of different compounds using an impedance mode in frequency range 1 Hz-100 KHz at 0.1 V potential has been carried out. Classification of six different tea liquor samples made by dissolving various compounds (black tea liquor + raw milk from milkman), (black tea liquor + sweetened clove syrup), (black tea liquor + sweetened ginger syrup), (black tea liquor + sweetened cardamom syrup), (black tea liquor + sweet chocolate syrup) and (black tea liquor + vanilla flavoured milk without sugar) using six different working electrodes in a multi electrode setup has been studied using impedance and further its PCA has been carried out. Working electrodes of Platinum (Pt), Gold (Au), Silver (Ag), Glassy Carbon (GC) and conducting polymer electrodes of Polyaniline (PANI) and Polypyrrole (PPY) grown on an ITO surface potentiostatically have been deployed in a three electrode set up. The impedance response of these tea liquor samples using number of working electrodes shows a decrease in the real and imaginary impedance values presented on nyquist plots depending upon the nature of the electrode and amount of dissolved salts present in compounds added to tea liquor/solution. The different sensing surfaces allowed a high cross-selectivity in response to the same analyte. From Principal Component Analysis (PCA) plots it was possible to classify tea liquor in 3-4 classes using conducting polymer electrodes; however tea liquors were well separated from the PCA plots employing the impedance data of both conducting polymer and metal electrodes.

  18. Leaching of heavy metals and alkylphenolic compounds from fresh and dried sewage sludge. (United States)

    Milinovic, Jelena; Vidal, Miquel; Lacorte, Silvia; Rigol, Anna


    Reusing sewage sludge as a soil fertiliser has become a common alternative to disposal. Although this practice has a few benefits, it may contribute to the medium- and long-term contamination of the trophic chain because sewage sludge may contain heavy metals and organic contaminants. As the leaching of contaminants may depend on the sludge pre-treatment, the leaching of heavy metals (Cu, Ni, Pb, Zn and Cr) and alkylphenolic compounds (APCs) (octylphenol (OP), nonylphenol (NP), nonylphenol-mono-ethoxylate (NP1EO)) was investigated in five fresh and 40 °C dried sewage sludge samples from north-eastern Spain. FT-IR analyses and full-scan GC-MS chromatograms showed that sludge drying changed the nature of organic compounds leading to changes in their solubility. Moreover, sludge drying led to a higher relative contribution of dissolved organic carbon than the particulate organic carbon in the leachates. Leaching of Pb, Zn and Cr was below 5 % in both fresh and dried sludge samples, whereas Cu and Ni leached at rates up to 12 and 43 %, respectively, in some of the dried sludge samples. The leaching yields of OP, NP and NP1EO ranged from 1.3 to 35 % for fresh samples, but they decreased from 0.8 to 3.4 % in dried samples. The decrease in the leachability of APCs observed in dried sludge samples might be attributed to the fact that these compounds are associated with particulate organic matter, with significantly lower concentration or even absent in dried sludge than in fresh sludge samples. Therefore, it is recommended to dry the sludge before its disposal.

  19. Valence-Bond Concepts in Coordination Chemistry and the Nature of Metal-Metal Bonds. (United States)

    Pauling, Linus; Herman, Zelek S.


    Discusses the valence-bond method, applying it to some coordination compounds of metals, especially those involving metal-metal bonds. Suggests that transition metals can form as many as nine covalent bonds, permitting valence-theory to be extended to transition metal compounds in a more effective way than has been possible before. (JN)

  20. Catalysis of metal-clay intercalation compound in the low temperature coal hydrogasification

    Energy Technology Data Exchange (ETDEWEB)

    Fuda, Kiyoshi; Kimura, Mitsuhiko; Miyamoto, Norimitsu; Matsunaga, Toshiaki


    Focusing the hydrogenating methanation by gaseous phase catalytic reactions of low temperature volatile components, the catalytic effects of Ni metal and the effects of carriers having sensitive effects on the catalytic activities of Ni metal were studied. Sample coals were prepared from Shin-Yubari coal, and Ni hydride-montmorillonite complex catalysts and the catalysts produced by carring Ni nitrate on alumina and burning in hydrogen gas flows were prepared. The hydrogasification were carried out in a reaction tube. As a result, the montmorillonite-Ni compounds catalysts had high catalitic effects and high conversion ratio of 90% or more in the low temperature coal gasification. The catalitic effects of carried Ni metal strongly depended on the carrier substances, and the rank of effects for the carriers was montmorillonite>zeorite>TiO/sub 2/>alpha-Al/sub 2/O/sub 3/>MgO>SiO/sub 2/=gamma-Al/sub 2/O/sub 3/. (3 figs, 3 tabs, 3 refs)

  1. EMI Shielding Performance For Varies Frequency by Metal Plating on Mold Compound

    Directory of Open Access Journals (Sweden)

    Min Fee Tai


    Full Text Available Conformal metalization on mold compound offers new possibility for IC package design to improve features such as rigidization of the flexible core, heat sink capability, 3D-circuit patterning and the electromagnetic interference (EMI shielding. With the unique processes, the fabrication technology had enabled to achieve the high reliable performance and had passed the electrical test. Following research after the reliability concern, this paper further study the shielding effectiveness of varying coating thickness with respect to laboratory simulated EMI condition, using radio frequency from 10MHz to 5.8 GHz. Different metal namely pure nickel, nickel-phosphorous and pure plated copper are studied for their effectiveness of EMI sheilding. Our first result showed over 35-40dB of shielding effectiveness is achievable on high frequency 868-5800MHz. Nevertheless on low frequency of 10MHz, the shielding effectiveness achievement is below than 25dB. To overcome the shielding need for lower frequency, we further expanded our test by choosing ferromagentic material Nicke/Ironl-alloy in combination with thick copper plating. With this new metal combination, EMI shielding effectiveness for lower frequency is improved to 40dB.

  2. New tribo-systems for sheet metal forming of advanced high strength steels and stainless steels

    DEFF Research Database (Denmark)

    Ceron, Ermanno

    The environmental issue, concerning the lubrication in sheet metal forming, has become considerably important in the past 10 years. Besides the fact that legislation is becoming more restrictive on the type of lubricant industry is allowed to use, many companies are embracing the path of social...... that the performance of the workpiece materials have to improve in order to satisfy higher strength and lower weight requirements. This however leads to challenges in the forming operation, especially when high surface expansion and elevated strain are involved. The challenge is to achieve long production run...... the reluctance of industry in the application of new solutions, due to the high trial costs. This project presents a new methodology for testing new environmentally friendly tribo-systems for sheet metal forming of advanced high strength steels and stainless steels. For the purpose, a new Universal Sheet...

  3. Yucca Mountain project canister material corrosion studies as applied to the electrometallurgical treatment metallic waste form

    International Nuclear Information System (INIS)

    Keiser, D.D.


    Yucca Mountain, Nevada is currently being evaluated as a potential site for a geologic repository. As part of the repository assessment activities, candidate materials are being tested for possible use as construction materials for waste package containers. A large portion of this testing effort is focused on determining the long range corrosion properties, in a Yucca Mountain environment, for those materials being considered. Along similar lines, Argonne National Laboratory is testing a metallic alloy waste form that also is scheduled for disposal in a geologic repository, like Yucca Mountain. Due to the fact that Argonne's waste form will require performance testing for an environment similar to what Yucca Mountain canister materials will require, this report was constructed to focus on the types of tests that have been conducted on candidate Yucca Mountain canister materials along with some of the results from these tests. Additionally, this report will discuss testing of Argonne's metal waste form in light of the Yucca Mountain activities

  4. The Effects of Nanostructure on the Hydrogen Sorption Properties of Magnesium-Based Metallic Compounds: A Review

    Directory of Open Access Journals (Sweden)

    Luca Pasquini


    Full Text Available In this review, I examine the influence of nanoscale materials features on the hydrogen-metal interaction. The small system size, the abundance of surfaces/interfaces, and the spatial distribution of phases are the key factors to understand the hydrogen sorption properties of nanomaterials. In order to describe nanoscale-specific thermodynamic changes, I present a quantitative model applicable to every hydride-forming material, independently on its composition and atomic structure. The effects of surface free energy, interface free energy, and elastic constraint, are included in a general expression for the thermodynamical bias. In the frame of this model, I critically survey theoretical and experimental results hinting at possible changes of thermodynamic parameters, and in particular, enthalpy and entropy of hydride formation, in nanostructured Mg-based metallic compounds as compared to their coarse-grained bulk counterparts. I discuss the still open controversies, such as destabilization of ultra-small clusters and enthalpy–entropy compensation. I also highlight the frequently missed points in experiments and data interpretation, such as the importance of recording full hydrogen absorption and desorption isotherms and of measuring the hysteresis. Finally, I try to address the open questions that may inspire future research, with the ambition of tailoring the properties of hydride nanomaterials through a deeper understanding of their thermodynamics.

  5. Suitability of a cytotoxicity assay for detection of potentially harmful compounds produced by freshwater bloom-forming algae. (United States)

    Sorichetti, Ryan J; McLaughlin, Jace T; Creed, Irena F; Trick, Charles G


    Detecting harmful bioactive compounds produced by bloom-forming pelagic algae is important to assess potential risks to public health. We investigated the application of a cell-based bioassay: the rainbow trout gill-w1 cytotoxicity assay (RCA) that detects changes in cell metabolism. The RCA was used to evaluate the cytotoxic effects of (1) six natural freshwater lake samples from cyanobacteria-rich lakes in central Ontario, Canada; (2) analytical standards of toxins and noxious compounds likely to be produced by the algal communities in these lakes; and (3) complex mixtures of compounds produced by cyanobacterial and chrysophyte cultures. RCA provided a measure of lake water toxicity that could not be reproduced using toxin or noxious compound standards. RCA was not sensitive to toxins and only sensitive to noxious compounds at concentrations higher than reported environmental averages (EC 50 ≥10 3 nM). Cultured algae produced bioactive compounds that had recognizable dose dependent and toxic effects as indicated by RCA. Toxicity of these bioactive compounds depended on taxa (cyanobacteria, not chrysophytes), growth stage (stationary phase more toxic than exponential phase), location (intracellular more toxic than extracellular) and iron status (cells in high-iron treatment more toxic than cells in low-iron treatment). The RCA provides a new avenue of exploration and potential for the detection of natural lake algal toxic and noxious compounds. Copyright © 2013 Elsevier B.V. All rights reserved.

  6. Atomic structure of nanoscale quasicrystal-forming Zr-noble metal binary metallic glasses

    Energy Technology Data Exchange (ETDEWEB)

    Saida, J., E-mail: [Center for Interdisciplinary Research, Tohoku University, Aramaki Aoba, Aoba-ku, Sendai 980-8578 (Japan); Itoh, K. [Graduate School of Education, Okayama University, Tsushimanaka, Kita-ku, Okayama 700-8530 (Japan); Sanada, T. [Research Department, Nissan ARC Ltd., Natsushima, Yokosuka 237-0061 (Japan); Sato, S. [Institute for Materials Research, Tohoku University, Katahira, Aoba-ku, Sendai 980-8577 (Japan); Imafuku, M. [Faculty of Engineering, Tokyo City University, Setagaya-ku, Tokyo 158-8557 (Japan); Ohnuma, M. [National Institute of Materials Science (NIMS), Sengen, Tsukuba, Ibaraki 305-0047 (Japan); Inoue, A. [WPI-AIMR, Tohoku University, Katahira, Aoba-ku, Sendai 980-8577 (Japan)


    Research highlights: > Zr{sub 70}Pd{sub 30} and Zr{sub 80}Pt{sub 20} are the quasicrystal (QC)-forming glassy alloys. > The QC phase precipitates by a cooperative motion of atoms or clusters. > Relatively perfect icosahedrons frequently exist around Zr in Zr{sub 70}Pd{sub 30}, however, distorted icosahedral-like clusters are formed around Zr and Pt in Zr{sub 80}Pt{sub 20}. > The QC phase formation originates from a different mechanism in the two alloys. - Abstract: We report the results of the local structural evaluation and mechanism of QC formation in the Zr{sub 70}Pd{sub 30} and Zr{sub 80}Pt{sub 20} glassy alloys. Voronoi analysis indicates the difference of local environment between two alloys. The perfect icosahedron frequently exists around Zr atom and major polyhedra have prism-like structure around Pd in Zr{sub 70}Pd{sub 30}. In contrast, icosahedral-like distorted polyhedra formation is favorable around Pt as well as Zr in Zr{sub 80}Pt{sub 20}. It is therefore, concluded that the quasicrystallization originates from the medium-range order based on the Zr-centered perfect icosahedron and the Pd-centered prism-like ones remain during the QC phase formation in Zr{sub 70}Pd{sub 30}. Icosahedral-like local structure around Zr and Pt might contribute together to the nucleation of QC phase in Zr{sub 80}Pt{sub 20}. This feature with a different mechanism of QC formation in the two alloys may correlate to the difference of solute concentration and the structure of stable crystalline phase after the decomposition of QC phase.

  7. Elaboration of the technology of forming a conical product of sheet metal

    Directory of Open Access Journals (Sweden)

    W. Matysiak


    Full Text Available The work presents a general knowledge about spinning draw pieces of sheets, one of multi-operational processes of spinning a sheet metal conical product without machining. The objective of the work was to elaborate both the technology of forming conical products of sheet metal and execution of technological tests as well as to determine the technological parameters for the process of spinning a conical insert. As a result of the investigations, the products with improved mechanical properties, stricter execution tolerance and low roughness have been obtained. The series of 200 prototype conical inserts for the shipbuilding industry have been made.

  8. Initial Evaluation of Processing Methods for an Epsilon Metal Waste Form

    Energy Technology Data Exchange (ETDEWEB)

    Crum, Jarrod V.; Strachan, Denis M.; Zumhoff, Mac R.


    During irradiation of nuclear fuel in a reactor, the five metals, Mo, Pd, Rh, Ru, and Tc, migrate to the fuel grain boundaries and form small metal particles of an alloy known as epsilon metal ({var_epsilon}-metal). When the fuel is dissolved in a reprocessing plant, these metal particles remain behind with a residue - the undissolved solids (UDS). Some of these same metals that comprise this alloy that have not formed the alloy are dissolved into the aqueous stream. These metals limit the waste loading for a borosilicate glass that is being developed for the reprocessing wastes. Epsilon metal is being developed as a waste form for the noble metals from a number of waste streams in the aqueous reprocessing of used nuclear fuel (UNF) - (1) the {var_epsilon}-metal from the UDS, (2) soluble Tc (ion-exchanged), and (3) soluble noble metals (TRUEX raffinate). Separate immobilization of these metals has benefits other than allowing an increase in the glass waste loading. These materials are quite resistant to dissolution (corrosion) as evidenced by the fact that they survive the chemically aggressive conditions in the fuel dissolver. Remnants of {var_epsilon}-metal particles have survived in the geologically natural reactors found in Gabon, Africa, indicating that they have sufficient durability to survive for {approx} 2.5 billion years in a reducing geologic environment. Additionally, the {var_epsilon}-metal can be made without additives and incorporate sufficient foreign material (oxides) that are also present in the UDS. Although {var_epsilon}-metal is found in fuel and Gabon as small particles ({approx}10 {micro}m in diameter) and has survived intact, an ideal waste form is one in which the surface area is minimized. Therefore, the main effort in developing {var_epsilon}-metal as a waste form is to develop a process to consolidate the particles into a monolith. Individually, these metals have high melting points (2617 C for Mo to 1552 C for Pd) and the alloy is

  9. Initial Evaluation of Processing Methods for an Epsilon Metal Waste Form

    International Nuclear Information System (INIS)

    Crum, Jarrod V.; Strachan, Denis M.; Zumhoff, Mac R.


    During irradiation of nuclear fuel in a reactor, the five metals, Mo, Pd, Rh, Ru, and Tc, migrate to the fuel grain boundaries and form small metal particles of an alloy known as epsilon metal ((var e psilon)-metal). When the fuel is dissolved in a reprocessing plant, these metal particles remain behind with a residue - the undissolved solids (UDS). Some of these same metals that comprise this alloy that have not formed the alloy are dissolved into the aqueous stream. These metals limit the waste loading for a borosilicate glass that is being developed for the reprocessing wastes. Epsilon metal is being developed as a waste form for the noble metals from a number of waste streams in the aqueous reprocessing of used nuclear fuel (UNF) - (1) the (var e psilon)-metal from the UDS, (2) soluble Tc (ion-exchanged), and (3) soluble noble metals (TRUEX raffinate). Separate immobilization of these metals has benefits other than allowing an increase in the glass waste loading. These materials are quite resistant to dissolution (corrosion) as evidenced by the fact that they survive the chemically aggressive conditions in the fuel dissolver. Remnants of (var e psilon)-metal particles have survived in the geologically natural reactors found in Gabon, Africa, indicating that they have sufficient durability to survive for ∼ 2.5 billion years in a reducing geologic environment. Additionally, the (var e psilon)-metal can be made without additives and incorporate sufficient foreign material (oxides) that are also present in the UDS. Although (var e psilon)-metal is found in fuel and Gabon as small particles (∼10 (micro)m in diameter) and has survived intact, an ideal waste form is one in which the surface area is minimized. Therefore, the main effort in developing (var e psilon)-metal as a waste form is to develop a process to consolidate the particles into a monolith. Individually, these metals have high melting points (2617 C for Mo to 1552 C for Pd) and the alloy is expected

  10. Metal presence influence on the efficiency of the organic compounds degradation caused by the electron beam irradiation

    International Nuclear Information System (INIS)

    Duarte, Celina Lopes; Oikawa, Hiroshi; Sampa, Maria Helena de Oliveira; Silveira, Carlos Gaia da; Ribeiro, Marcia Almeida; Sato, Ivone Mulako


    Actual industrial effluent from chemical, textile, pharmaceutical and painting industries has high level of organic compound, usually, together metals. The high efficiency of electron beam irradiation on removing organic compound in industrial effluent has been showed. A study to evaluate the Advanced Oxidation Process by electron beam irradiation to remove organic compound from simulated industrial effluent with two high metals concentration as Na, Cl, Ca, P, K, Si, Al, Zn, Fe, Mn, Cd, Pb, As e Hg, was carried out. The metals concentration was determined with the technique of Wavelength Dispersion X-Ray Spectrometry Fluorescence (WD-XRF). Experiments were conducted using a Radiation Dynamics Electron Beam Accelerator with 1,5 MeV energy and 37 kW power. The simulated effluent samples were irradiated in a batch system. The electron beam irradiation showed be efficient on destroying the organic compounds dichloroethane, methylisobutilketone, toluene, xylene, benzene, chloroform, tetrachloroethylene and trichloroethylene, even in presence of metals, but in this case the efficiency is decreased. To remove more than 90% of all organic compounds was necessary a 20 kGy dose for free metals samples and 50 kGy for the two simulated effluent samples. (author)

  11. A Fully-Coupled Approach for Modelling Plastic Deformation and Liquid Lubrication in Metal Forming

    DEFF Research Database (Denmark)

    Üstünyagiz, Esmeray; Christiansen, Peter; Nielsen, Chris Valentin


    flow formulation which stands on the border line between fluidand solid mechanics and allows treating the lubricants as viscous incompressible (or nearlyincompressible) fluid and the metallic materials as non-Newtonian, high viscous, incompressiblefluids. The presentation is focused on the theoretical......This paper presents a new approach for combined modelling of plastic deformation andliquid lubrication in the contact interfaces between material and tooling in metal forming includingsituations where the lubricant is functioning as a pressure carrier. The approach is an alternative toconventional...... elements with fictitious small stiffness to physical modelling based on a fullycoupled procedure in which the lubricant flow and the plastic deformation of the metallic materialare solved simultaneously. The approach takes advantage of the intrinsic velocity-pressurecharacteristics of the finite element...

  12. Off-line testing of multifunctional surfaces for metal forming applications

    DEFF Research Database (Denmark)

    Godi, A.; Grønbæk, J.; De Chiffre, L.


    In this paper, Bending-Under-Tension, an off-line test method simulating deep-drawing, is chosen for investigating the effectiveness of multifunctional (MUFU) surfaces in metal forming operations. Four different MUFU surfaces, characterized by a plateau bearing area and grooves for lubricant...... retention, are manufactured, together with two polished references. During the tests, surface texture is the only variable. The results show how MUFU surfaces perform better than the polished references, which produce severe galling, while MUFU surfaces with low bearing area display no clear evidence...... of galling. Metal-to-metal contact occurs anyway, but the strip material is pulverized and deposited onto the tool instead of cold-welding to it. The pockets create a discontinuity on the texture hindering pick-up propagation....

  13. Investigation of the Slag Forming Route When Smelting Medium-Phosphorus Hot Metal (United States)

    Lin, Tiancheng; Zhu, Mingmei; Dou, Xiaofei; Qiu, Xin; Wang, Yu; Xie, Bing

    In this study, the slag forming route of the single-slag steel melting when smelting medium phosphorus hot metal was investigated. The CaO-SiO2-FeO-MgO-MnO-P2O5 as hexahydric slag system was adopted in the converter. The effect of slag composition on liquidus was calculated by FactSage, the isogram of phosphorus distribution ratio was calculated by using the regular ion solution model, combining these two tasks, the theoretical slag forming route was obtained. Through experiments, the actual melting point ofthe corresponding components on theoretical slag forming route was obtained, in this way, the theoretical slag forming route was confirmed. Then, the theoretical slag forming route was applied to industrial test in a 210t BOF. After using the new slag formating route, the dephosphorization ratio was increased 3.6% while the auxiliary materials consumption was reduced, and the cost of steelmaking was reduced.

  14. DWPF Hydrogen Generation Study-Form of Noble Metal SRAT Testing

    Energy Technology Data Exchange (ETDEWEB)

    Bannochie, C


    The Defense Waste Processing Facility, DWPF, has requested that the Savannah River National Laboratory, SRNL, investigate the factors that contribute to hydrogen generation to determine if current conservatism in setting the DWPF processing window can be reduced. A phased program has been undertaken to increase understanding of the factors that influence hydrogen generation in the DWPF Chemical Process Cell, CPC. The hydrogen generation in the CPC is primarily due to noble metal catalyzed decomposition of formic acid with a minor contribution from radiolytic processes. Noble metals have historically been added as trim chemicals to process simulations. The present study investigated the potential conservatism that might be present from adding the catalytic species as trim chemicals to the final sludge simulant versus co-precipitating the noble metals into the insoluble sludge solids matrix. Two sludge simulants were obtained, one with co-precipitated noble metals and one without noble metals. Co-precipitated noble metals were expected to better match real waste behavior than using trimmed noble metals during CPC simulations. Portions of both sludge simulants were held at 97 C for about eight hours to qualitatively simulate the effects of long term storage on particle morphology and speciation. The two original and two heat-treated sludge simulants were then used as feeds to Sludge Receipt and Adjustment Tank, SRAT, process simulations. Testing was done at relatively high acid stoichiometries, {approx}175%, and without mercury in order to ensure significant hydrogen generation. Hydrogen generation rates were monitored during processing to assess the impact of the form of noble metals. The following observations were made on the data: (1) Co-precipitated noble metal simulant processed similarly to trimmed noble metal simulant in most respects, such as nitrite to nitrate conversion, formate destruction, and pH, but differently with respect to hydrogen generation: (A

  15. On the lightweighting of automobile engine components : forming sheet metal connecting rod (United States)

    Date, P. P.; Kasture, R. N.; Kore, A. S.


    Reducing the inertia of the reciprocating engine components can lead to significant savings on fuel. A lighter connecting rod (for the same functionality and performance) with a lower material input would be an advantage to the user (customer) and the manufacturer alike. Light materials will make the connecting rod much more expensive compared to those made from steel. Non-ferrous metals are amenable to cold forging of engine components to achieve lightweighting. Alternately, one can make a hollow connecting rod formed from steel sheet, thereby making it lighter, and with many advantages over the conventionally hot forged product. The present paper describes the process of forming a connecting rod from sheet metal. Cold forming (as opposed to high energy needs, lower tool life and the need for greater number of operations and finishing processes in hot forming) would be expected to reduce the cost of manufacture by cold forming. Work hardening during forming is also expected to enhance the in-service performance of the connecting rod.

  16. Theories, Methods and Numerical Technology of Sheet Metal Cold and Hot Forming Analysis, Simulation and Engineering Applications

    CERN Document Server

    Hu, Ping; Liu, Li-zhong; Zhu, Yi-guo


    Over the last 15 years, the application of innovative steel concepts in the automotive industry has increased steadily. Numerical simulation technology of hot forming of high-strength steel allows engineers to modify the formability of hot forming steel metals and to optimize die design schemes. Theories, Methods and Numerical Technology of Sheet Metal Cold and Hot Forming focuses on hot and cold forming theories, numerical methods, relative simulation and experiment techniques for high-strength steel forming and die design in the automobile industry. Theories, Methods and Numerical Technology of Sheet Metal Cold and Hot Forming introduces the general theories of cold forming, then expands upon advanced hot forming theories and simulation methods, including: • the forming process, • constitutive equations, • hot boundary constraint treatment, and • hot forming equipment and experiments. Various calculation methods of cold and hot forming, based on the authors’ experience in commercial CAE software f...

  17. Genetic toxicology of metal compounds: I. Induction of lambda prophage in E coli WP2/sub s/(lambda)

    Energy Technology Data Exchange (ETDEWEB)

    Rossman, T.G.; Molina, M.; Meyer, L.W.


    A number of metal compounds have been shown to be human carcinogens. Others, while not proven human carcinogens, are able to cause tumors in laboratory animals. Short-term bacterial assays for genotoxic effects have not been successful in predicting the carcinogenicity of metal compounds. The ability of some metal compounds to cause the induction of lambda prophage in E coli WP2/sub s/(lambda) is reported. By far the strongest inducing ability was observed with K/sub 2/CrO/sub 4/. With the exception of chromate, long-term exposures in a narrow, subtoxic dose range were required in order to demonstrate phage induction. A new microtiter assay for lambda prophage induction, which incorporates these features, is described. This system also was able to detect very small amounts of organic carcinogens.

  18. Unified explanation of chemical ordering, the Slater-Pauling rule, and half-metallicity in full Heusler compounds (United States)

    Faleev, Sergey V.; Ferrante, Yari; Jeong, Jaewoo; Samant, Mahesh G.; Jones, Barbara; Parkin, Stuart S. P.


    In the present work we developed an orbital coupling model for cubic full Heusler compounds that provides a unified set of rules that account for the chemical ordering, magnetic moment, and composition of the most promising candidates for half-metallicity. The origin and limitations of the rules are clearly described. To the best of our knowledge all of the several dozen half-metallic Heusler compounds known in the literature that follow the Mt=Nt-24 or Mt=Nt-28 generalized Slater-Pauling behavior satisfy the derived half-metallicity rule. Calculations performed by using density functional theory—performed for 259 compounds—confirm the validity of our model and derived rules for broad classes of Heusler compounds.

  19. Spin-Orbit Coupling Drives Femtosecond Nonadiabatic Dynamics in a Transition Metal Compound. (United States)

    Carbery, William P; Verma, Archana; Turner, Daniel B


    Transient absorption measurements conducted using broadband, 6 fs laser pulses reveal unexpected femtosecond dynamics in the [IrBr 6 ] 2- model system. Vibrational spectra and the X-ray crystal structure indicate that these dynamics are not induced by a Jahn-Teller distortion, a type of conical intersection typically associated with the spectral features of transition metal compounds. Two-dimensional electronic spectra of [IrBr 6 ] 2- contain 23 cross peaks, which necessarily arise from spin-orbit coupling. Real-valued 2D spectra support a spectroscopic basis where strong nonadiabatic coupling, ascribed to multiple conical intersections, mediates rapid energy relaxation to the lowest-energy excited state. Subsequent analysis gives rise to a more generalized description of a conical intersection as a degeneracy between two adiabatic states having the same total angular momentum.

  20. Irradiation effect on leaching behavior and form of heavy metals in fly ash of municipal solid waste incinerator

    International Nuclear Information System (INIS)

    Nam, Sangchul; Namkoong, Wan


    Highlights: ► No research has been done to examine effect of electron beam irradiation on leaching behavior of heavy metals in fly ash. ► Electron beam irradiation on fly ash had significant effect on heavy metal leaching. ► Leaching potential of heavy metals in fly ash differed among metal species tested (Pb, Zn, Cu). ► Metal forms in the ash were analyzed to explain the difference. ► The difference could be explained by metal form change. - Abstract: Fly ash from a municipal solid waste incinerator (MSWI) is commonly classified as hazardous waste. High-energy electron beam irradiation systems have gained popularity recently as a clean and promising technology to remove environmental pollutants. Irradiation effects on leaching behavior and form of heavy metals in MSWI fly ash have not been investigated in any significant detail. An electron beam accelerator was used in this research. Electron beam irradiation on fly ash significantly increased the leaching potential of heavy metals from fly ash. The amount of absorbed dose and the metal species affected leaching behavior. When electron beam irradiation intensity increased gradually up to 210 kGy, concentration of Pb and Zn in the leachate increased linearly as absorbed dose increased, while that of Cu underwent no significant change. Concentration of Pb and Zn in the leachate increased up to 15.5% (10.7 mg/kg), and 35.6% (9.6 mg/kg) respectively. However, only 4.8% (0.3 mg/kg) increase was observed in the case of Cu. The results imply that irradiation has significant effect on the leaching behavior of heavy metals in fly ash, and the effect is quite different among the metal species tested in this study. A commonly used sequential extraction analysis which can classify a metal species into five forms was conducted to examine any change in metal form in the irradiated fly ash. Notable change in metal form in fly ash was observed when fly ash was irradiated. Change in Pb form was much greater than that of

  1. EDITORIAL: New materials with high spin polarization: half-metallic Heusler compounds (United States)

    Felser, Claudia; Hillebrands, Burkard


    The development of magnetic Heusler compounds, specifically designed as materials for spintronic applications, has made tremendous progress in the very recent past [1-21]. Heusler compounds can be made as half-metals, showing a high spin polarization of the conduction electrons of up to 100% [1]. These materials are exceptionally well suited for applications in magnetic tunnel junctions acting, for example, as sensors for magnetic fields. The tunnelling magneto-resistance (TMR) effect is the relative change in the electrical resistance upon application of a small magnetic field. Tunnel junctions with a TMR effect of 580% at 4 K were reported by the group of Miyazaki and Ando [1], consisting of two Co2MnSi Heusler electrodes. High Curie temperatures were found in Co2 Heusler compounds with values up to 1120 K in Co2FeSi [2]. The latest results are for a TMR device made from the Co2FeAl0.5Si0.5 Heusler compound and working at room temperature with a TMR effect of 174% [3]. The first significant magneto-resistance effect was discovered in Co2Cr0.6Fe0.4Al (CCFA) in Mainz [4]. With the classical Heusler compound CCFA as one electrode, the record TMR effect at 4 K is 240% [5]. Positive and negative TMR values at room temperature utilizing magnetic tunnel junctions with one Heusler compound electrode render magnetic logic possible [6]. Research efforts exist, in particular, in Japan and in Germany. The status of research as of winter 2005 was compiled in a recent special volume of Journal of Physics D: Applied Physics [7-20]. Since then specific progress has been made on the issues of (i) new advanced Heusler materials, (ii) advanced characterization, and (iii) advanced devices using the new materials. In Germany, the Mainz and Kaiserslautern based Research Unit 559 `New Materials with High Spin Polarization', funded since 2004 by the Deutsche Forschungsgemeinschaft, is a basic science approach to Heusler compounds, and it addresses the first two topics in particular

  2. Preliminary study for development of low dose radiation shielding material using liquid silicon and metallic compound

    Energy Technology Data Exchange (ETDEWEB)

    Jang, Seo Goo; Lee, Sung Soo [Dept. of Medical Science, Graduate School of Soonchunhyang University, Asan (Korea, Republic of); Han, Su Chul [Div. of Medical Radiation Equipment, Korea Institute of Radiological and Medical Sciences, Seoul (Korea, Republic of); Kang, Sung Jin [SoonChunHyang University Hospital, Seoul (Korea, Republic of); Lim, Sung Wook [Graduate school of SeJong University, Seoul (Korea, Republic of)


    This study measured and compared the protective clothing using Pb used for shielding in a diagnostic X-ray energy range, and the shielding rates of X-ray fusion shielding materials using Si and TiO{sub 2}. For the experiment, a pad type shielding with a thickness of 1 mm was prepared by mixing Si-TiO{sub 2}, and the X-ray shielding rate was compared with 0.5 mmPb plate of The shielding rate of shielding of 0.5 mmPb plate 95.92%, 85.26 % based on the case of no shielding under each 60kVp, 100kVp tube voltage condition. When the shielding of Si-TiO{sub 2} pad was applied, the shielding rate equal to or greater than 0.5 mmPb plate was obtained at a thickness of 11 mm or more, and the shielding rate of 100% or more was confirmed at a thickness of 13 nn in 60kVp condition. When the shielding of Si-TiO{sub 2} pad was applied, the shielding rate equal to or greater than 0.5 mmPb plate was obtained at a thickness of 17 mm or more, and a shielding rate of 0.5 mmPb plate was observed at a thickness of 23 mm in 100kVp condition. Through the results of this study, We could confirm the possibility of manufacturing radiation protective materials that does not contain lead hazard using various metallic compound and liquid Si. This study shows that possibility of liquid Si and other metallic compound can harmonize easily. Beside, It is flexible and strong to physical stress than Pb obtained radiation protective clothes. But additional studies are needed to increase the shielding rate and reduce the weight.


    Directory of Open Access Journals (Sweden)

    Tomislav Vujinović


    Full Text Available Sheet metal forming, especially deep drawing process is influenced by many factors. Blank holding force and drawbead displacement are two of them that can be controlled during the forming process.For this purpose, an electro-hydraulic computerized sheet-metal strip sliding device has been constructed. The basic characteristic of this device is realization of variable contact pressure and drawbead height as functions of time or stripe displacement. There are both, pressure and drawbead, ten linear and nonlinear functions. Additional features consist of the ability to measure drawing force, contact pressure, drawbead displacement etc.The device overview and first results of steel sheet stripe sliding over rounded drawbead are presented in the paper.

  4. Computer controlled experimental device for investigations of tribological influences in sheet metal forming

    Directory of Open Access Journals (Sweden)

    Milan Djordjevic


    Full Text Available Sheet metal forming, especially deep drawing process, is influenced by many factors. Blank holding force and drawbead displacement are two of them that can be controlled during the forming process. For this purpose, electro-hydraulic computerized sheet-metal strip sliding device has been constructed. Basic characteristic of this device is realization of variable contact pressure and drawbead height as functions of time or stripe displacement. There are both, pressure and drawbead, ten linear and nonlinear functions. Additional features consist of the ability to measure drawing force, contact pressure, drawbead displacement etc. Presented in the paper are the device overview and the first results of steel sheet stripe sliding over rounded  drawbead.

  5. Forming limit diagrams for anisotropic metal sheets with different yield criteria

    DEFF Research Database (Denmark)

    Kuroda, M.; Tvergaard, Viggo


    For thin metal sheets subject to stretching under various in-plane tensile stress histories, localized necking is analyzed by using the M-K-model approach, and forming limit diagrams are drawn based on the critical strains for localization. The analyses account for plastic anisotropy, and predict......For thin metal sheets subject to stretching under various in-plane tensile stress histories, localized necking is analyzed by using the M-K-model approach, and forming limit diagrams are drawn based on the critical strains for localization. The analyses account for plastic anisotropy...... is inclined to the orthotropic axes. Furthermore, the effect of allowing for nonzero shear strains outside the necking band is considered. In all analyses the rotation of the orthotropic axes is accounted for, and a few studies are used to evaluate the effect of assuming the development of a plastic spin. (C...

  6. Electronic computer prediction of properties of binary refractory transition metal compounds on the base of their simplificated electronic structure

    International Nuclear Information System (INIS)

    Kutolin, S.A.; Kotyukov, V.I.


    An attempt is made to obtain calculation equations of macroscopic physico-chemical properties of transition metal refractory compounds (density, melting temperature, Debye characteristic temperature, microhardness, standard formation enthalpy, thermo-emf) using the method of the regression analysis. Apart from the compound composition the argument of the regression equation is the distribution of electron bands of d-transition metals, created by the energy electron distribution in the simplified zone structure of transition metals and approximated by Chebishev polynoms, by the position of Fermi energy on the map of distribution of electron band energy depending upon the value of quasi-impulse, multiple to the first, second and third Brillouin zone for transition metals. The maximum relative error of the regressions obtained as compared with the literary data is 15-20 rel.%

  7. Bulk glass formation and crystallization in zirconium based bulk metallic glass forming alloys

    International Nuclear Information System (INIS)

    Savalia, R.T.; Neogy, S.; Dey, G.K.; Banerjee, S.


    The microstructures of Zr based metallic glasses produced in bulk form have been described in the as-cast condition and after crystallization. Various microscopic techniques have been used to characterize the microstructures. The microstructure in the as-cast condition was found to contain isolated crystals and crystalline aggregates embedded in the amorphous matrix. Quenched-in nuclei of crystalline phases were found to be present in fully amorphous regions. These glasses after crystallization gave rise to nanocrystalline solids. (author)

  8. Detection and determination of volatile metal compounds in the atmosphere by a Mist-UV sampling system (United States)

    Ito, Masayoshi; Shooter, David

    A newly developed system (Mist-UV sampling system) to simultaneously trap and detect metal compounds in the atmosphere is described. Metals present in atmospheric samples as volatile metal compounds (VMCs), including those associated with condensation mode particles, are simultaneously oxidized by ultraviolet (UV) irradiation (low-pressure mercury lamp) and dissolved in nitric acid mist in an oxidation chamber. Air is first passed through a 0.2 μm filter and then mixed with a nitric acid mist and exposed to UV radiation after which it is passed through a nitric acid trap. After trapping, the inorganic metals resulting from the VMCs and particulates are quantitatively determined using inductively coupled plasma-mass spectrometry (ICP-MS). After development, this sampling system was applied directly to the quantitation of VMCs in ambient air in Auckland, New Zealand. The trapping efficiency of the Mist-UV sampling system was over 69% for each of the seven different metals that were detected in the atmosphere (Mg, Al, Ga, Sr, Ba, Hg and Pb). Key results obtained were: Mg concentrations were found to be higher than concentrations associated with particulate in remote air (range: 0.36-1.6 μg m -3); Al and Sr existed as VMCs unaffected by UV; UV oxidized Hg provided the total concentration of Hg detected. The characteristics of the Mist-UV sampling system suggest that it can be used as a tool to determine volatile metals, metal clusters and metals associated with particulates transport and deposition.

  9. Antibacterial and bioactive calcium titanate layers formed on Ti metal and its alloys. (United States)

    Kizuki, Takashi; Matsushita, Tomiharu; Kokubo, Tadashi


    An antibacterial and bioactive titanium (Ti)-based material was developed for use as a bone substitute under load-bearing conditions. As previously reported, Ti metal was successively subjected to NaOH, CaCl2, heat, and water treatments to form a calcium-deficient calcium titanate layer on its surface. When placed in a simulated body fluid (SBF), this bioactive Ti formed an apatite layer on its surface and tightly bonded to bones in the body. To address concerns regarding deep infection during orthopedic surgery, Ag(+) ions were incorporated on the surface of this bioactive Ti metal to impart antibacterial properties. Ti metal was first soaked in a 5 M NaOH solution to form a 1 μm-thick sodium hydrogen titanate layer on the surface and then in a 100 mM CaCl2 solution to form a calcium hydrogen titanate layer via replacement of the Na(+) ions with Ca(2+) ions. The Ti material was subsequently heated at 600 °C for 1 h to transform the calcium hydrogen titanate into calcium titanate. This heat-treated titanium metal was then soaked in 0.01-10 mM AgNO3 solutions at 80 °C for 24 h. As a result, 0.1-0.82 at.% Ag(+) ions and a small amount of H3O(+) ions were incorporated into the surface calcium titanate layers. The resultant products formed apatite on their surface in an SBF, released 0.35-3.24 ppm Ag(+) ion into the fetal bovine serum within 24 h, and exhibited a strong antibacterial effect against Staphylococcus aureus. These results suggest that the present Ti metals should exhibit strong antibacterial properties in the living body in addition to tightly bonding to the surrounding bone through the apatite layer that forms on their surfaces in the body.

  10. [Evaluation of compounding EDTA and citric acid on remediation of heavy metals contaminated soil]. (United States)

    Yin, Xue; Chen, Jia-Jun; Cai, Wen-Min


    As commonly used eluents, Na2EDTA (EDTA) and citric acid (CA) have been widely applied in remediation of soil contaminated by heavy metals. In order to evaluate the removal of arsenic, cadmium, copper, and lead in the contaminated soil collected in a chemical plant by compounding EDTA and CA, a series of stirring experiments were conducted. Furthermore, the changes in speciation distribution of heavy metals before and after washing were studied. The results showed that, adopting the optimal molar ratio of EDTA/CA (1:1), when the pH of the solution was 3, the stirring time was 30 min, the stirring rate was 150 r x min(-1) and the L/S was 5:1, the removal rates of arsenic, cadmium, copper and lead could reach 11.72%, 43.39%, 24.36% and 27.17%, respectively. And it was found that after washing, for arsenic and copper, the content of acid dissolved fraction rose which increased the percentage of available contents. Fe-Mn oxide fraction mainly contributed to the removal of copper. As for cadmium, the percentages of acid dissolved fraction, Fe-Mn oxide fraction and organic fraction also decreased. In practical projects, speciation changes would pose certain environmental risk after soil washing, which should be taken into consideration.

  11. Surface density: a new parameter in the fundamental metallicity relation of star-forming galaxies (United States)

    Hashimoto, Tetsuya; Goto, Tomotsugu; Momose, Rieko


    Star-forming galaxies display a close relation among stellar mass, metallicity, and star formation rate (or molecular-gas mass). This is known as the fundamental metallicity relation (FMR) (or molecular-gas FMR), and it has a profound implication on models of galaxy evolution. However, there still remains a significant residual scatter around the FMR. We show here that a fourth parameter, the surface density of stellar mass, reduces the dispersion around the molecular-gas FMR. In a principal component analysis of 29 physical parameters of 41 338 star-forming galaxies, the surface density of stellar mass is found to be the fourth most important parameter. The new 4D fundamental relation forms a tighter hypersurface that reduces the metallicity dispersion to 50 per cent of that of the molecular-gas FMR. We suggest that future analyses and models of galaxy evolution should consider the FMR in a 4D space that includes surface density. The dilution time-scale of gas inflow and the star-formation efficiency could explain the observational dependence on surface density of stellar mass.

  12. Forming of protective nanostructure coatings on metals and glasses and their properties investigation

    International Nuclear Information System (INIS)

    Deshkovskaya, A.; Lynkov, L.; Nagibarov, A.; Glybin, V.; Richter, E.; Pham, M.


    Transparent heat-resistant coatings of 10-30 nm thickness described by (ZrO 2 ) x •(Y 2 O 3 ) y composition are formed on the surface of metals and glasses by thermolysis technique. Produced coatings possess high adhesive strength, high corrosive and abrasive resistance. Nanocrystalline formations are revealed on samples surface, with quantity of these formations depending on basic solution concentration, formed layers number and thermal treatment mode. Ion-beam modification of obtained coatings under mixing mode enables said properties enhancing owing to zirconium oxiboride formation at substrate-coating interface as a result of ion-beam synthesis. (authors)

  13. Infrared spectra, methyl group structure and internal rotation in some methy - metal compounds (United States)

    McKean, D. C.; McQuillan, G. P.; Torto, I.; Morrisson, A. R.


    Recent and current work on spectra in the CH and CD stretching regions of methyl-metal compounds is reviewed. Free internal rotation with CH force constant variation is found in MMe 3 (M  Ga, Tl) and MMe(CO) 5 (M  Mn, Re) compounds, studied in the gas phase. From solution measurements, no such rotation occurs in CpMMe(CO) 3 (M  Cr,Mo,W) and Cp 2MMe 2 (M  Ti,Zr,Hf), in most of which each methyl group contains two types of CH bond. In each d-subgroup, ν isCH decreases with increasing atomic number, while δ sCH 3 increases. The reverse occurs from Ga to Tl. r oCH values are predicted. There is evidence for the breakdown of the ν isCH/∠HCH correlation, especially in MeTiCl 3 where several features point to an unusual structure of the methyl group.

  14. Rapid microwave-assisted preparation of binary and ternary transition metal sulfide compounds

    Energy Technology Data Exchange (ETDEWEB)

    Butala, Megan M.; Perez, Minue A.; Arnon, Shiri; Göbel, Claudia; Preefer, Molleigh B.; Seshadri, Ram


    Transition metal chalcogenides are of interest for energy applications, including energy generation in photoelectrochemical cells and as electrodes for next-generation electrochemical energy storage. Synthetic routes for such chalcogenides typically involve extended heating at elevated temperatures for multiple weeks. We demonstrate here the feasibility of rapidly preparing select sulfide compounds in a matter of minutes, rather than weeks, using microwave-assisted heating in domestic microwaves. We report the preparations of phase pure FeS2, CoS2, and solid solutions thereof from the elements with only 40 min of heating. Conventional furnace and rapid microwave preparations of CuTi2S4 both result in a majority of the targeted phase, even with the significantly shorter heating time of 40 min for microwave methods relative to 12 days using a conventional furnace. The preparations we describe for these compounds can be extended to related structures and chemistries and thus enable rapid screening of the properties and performance of various compositions of interest for electronic, optical, and electrochemical applications.

  15. Effects of Metallic Nanoparticles on Interfacial Intermetallic Compounds in Tin-Based Solders for Microelectronic Packaging (United States)

    Haseeb, A. S. M. A.; Arafat, M. M.; Tay, S. L.; Leong, Y. M.


    Tin (Sn)-based solders have established themselves as the main alternative to the traditional lead (Pb)-based solders in many applications. However, the reliability of the Sn-based solders continues to be a concern. In order to make Sn-based solders microstructurally more stable and hence more reliable, researchers are showing great interest in investigating the effects of the incorporation of different nanoparticles into them. This paper gives an overview of the influence of metallic nanoparticles on the characteristics of interfacial intermetallic compounds (IMCs) in Sn-based solder joints on copper substrates during reflow and thermal aging. Nanocomposite solders were prepared by mechanically blending nanoparticles of nickel (Ni), cobalt (Co), zinc (Zn), molybdenum (Mo), manganese (Mn) and titanium (Ti) with Sn-3.8Ag-0.7Cu and Sn-3.5Ag solder pastes. The composite solders were then reflowed and their wetting characteristics and interfacial microstructural evolution were investigated. Through the paste mixing route, Ni, Co, Zn and Mo nanoparticles alter the morphology and thickness of the IMCs in beneficial ways for the performance of solder joints. The thickness of Cu3Sn IMC is decreased with the addition of Ni, Co and Zn nanoparticles. The thickness of total IMC layer is decreased with the addition of Zn and Mo nanoparticles in the solder. The metallic nanoparticles can be divided into two groups. Ni, Co, and Zn nanoparticles undergo reactive dissolution during solder reflow, causing in situ alloying and therefore offering an alternative route of alloy additions to solders. Mo nanoparticles remain intact during reflow and impart their influence as discrete particles. Mechanisms of interactions between different types of metallic nanoparticles and solder are discussed.

  16. Serum heavy metals and hemoglobin related compounds in Saudi Arabia firefighters

    Directory of Open Access Journals (Sweden)

    Al-Malki Abdulrahman L


    Full Text Available Abstract Background Firefighters are frequently exposed to significant concentrations of hazardous materials including heavy metals, aldehydes, hydrogen chloride, dichlorofluoromethane and some particulates. Many of these materials have been implicated in the triggering of several diseases. The aim of the present study is to investigate the effect of fire smoke exposure on serum heavy metals and possible affection on iron functions compounds (total iron binding capacity, transferrin saturation percent, ferritin, unsaturated iron-binding capacity blood hemoglobin and carboxyhemoglobin,. Subjects and methods Two groups of male firefighter volunteers were included; the first included 28 firefighters from Jeddah city, while the second included 21 firefighters from Yanbu city with an overall age rang of 20–48 years. An additional group of 23 male non-firefighters volunteered from both cities as normal control subjects. Blood samples were collected from all volunteer subjects and investigated for relevant parameters. Results The results obtained showed that there were no statistically significant changes in the levels of serum heavy metals in firefighters as compared to normal control subjects. Blood carboxyhemoglobin and serum ferritin were statistically increased in Jeddah firefighters, (p Conclusion Such results might point to the need for more health protective and prophylactic measures to avoid such hazardous health effects (elevated Blood carboxyhemoglobin and serum ferritin and decreased serum TIBC and UIBC that might endanger firefighters working under dangerous conditions. Firefighters must be under regular medical follow-up through standard timetabled medical laboratory investigations to allow for early detection of any serum biochemical or blood hematological changes.

  17. The heavy metal ions (Cu2+, Zn2+, Cd+) toxic compounds influence on triticale plants growth (United States)

    Brezoczki, V. M.; Filip, G. M.


    The presence of the heavy metals toxic compounds (CuSO4 · 5H2O, ZnSO4 · 7H2O and 3CdSO4·8H2O) in water and soil can be observed by their negative effects on the germination and growth process for different vegetable (barley, oat, maize) who are used for human and animal consumption. This paper it aims the determination of germination and growth inhibition negative effects for triticale plants in the heavy metals ions presence by ecotoxicological laboratory tests. The triticale plants was chosen for their different characteristics to the other grasses respectively: a very good resistance for a wide range of diseases, an accelerated growth and a very good tolerance for aluminum ions presents in acid soils. The determinations were conducted step by step, first, we put the triticale grains in contact with the heavy metal solutions with different concentration then for 3 days we noticed the triticale germination inhibition effects and finally we noticed the growth inhibition process for triticale plants respectively in 7th and 9th day from the start of the experiment. At the end of the tests we can conclude that the triticale roots have a very great sensibility to a CuSO4 solutions compared to the effects for their stalks. A positive effect for triticale stalks we can see for low CuSO4 solution concentrations thus for 5 mg Cu/l the growth is 19,44%. A positive effect for triticale roots it can see for low ZnSO4 solution concentrations so for 5 - 15 mg Zn/l the growth is 24,4%. In the presence of the CdSO4 solution all the processes are inhibited (germination and growth for triticale plants) even for a low concentrations for this toxic.

  18. Metal electrodeposition and electron transfer studies of uranium compounds in room temperature ionic liquids

    International Nuclear Information System (INIS)

    Stoll, M.E.; Oldham, W.J.; Costa, D.A.


    electrochemical methods including cyclic and square-wave voltammetry, chronoamperometry, and bulk coulometry. Results from these studies will be presented to show the general electron transfer behavior of metal complexes in the RTIL's. As an example, Figure 2 shows the difference in chemical stability of an electrogenerated U(V) anion for two uranyl (U(VI)O 2 2+ ) complexes due to the difference in ancillary ligands about the uranyl moiety. Figure 2a shows a cyclic voltammogram (CV) for the U(VI)/U(V) couple of a uranyl complex containing a multi-dentate chelating nitrogen/oxygen ligand (inset in figure). The couple is both chemically and electrochemically reversible. The CV in Figure 2b is that of [UO 2 Cl 4 ] 2- in which the electrogenerated U(V) derivative is unstable yielding a chemically irreversible wave. For the compound giving rise to the CV in Figure 2a its electrochemical behavior in a conventional nonaqueous electrolyte medium is very similar to that obtained in the RTIL. While this result does not illustrate a distinct advantage for employing the RTIL solvent in this particular case, we believe it effectively demonstrates the ability of the RTIL to be utilized as a solvent/electrolyte medium for detailed electrochemical studies without severe limitations.

  19. Electrical resistivity of NaPb compound-forming liquid alloy using ab ...

    Indian Academy of Sciences (India)

    pseudopotentials used have been shown in figure 5. Here pseudopotential v3 for the complex has been considered as a disposable parameter and we assume that v3(q) = v1(q)+v2(q). 2 for NaPb compound which is virtual atomic approxima- tion. Electronic configuration and pseudising core radii used to generate ab initio.

  20. Fission dynamics of the compound nucleus 213 Fr formed in heavy ...

    Indian Academy of Sciences (India)

    A stochastic approach based on one-dimensional Langevin equations was used to calculate the average pre-fission multiplicities of neutrons, light charged particles and the fission probabilities for the compound nucleus 213Fr and the results are compared with the experimental data. In these calculations, a modified wall ...

  1. Biofilm-Forming Staphylococcus epidermidis Expressing Vancomycin Resistance Early after Adhesion to a Metal Surface

    Directory of Open Access Journals (Sweden)

    Toshiyuki Sakimura


    Full Text Available We investigated biofilm formation and time of vancomycin (VCM resistance expression after adhesion to a metal surface in Staphylococcus epidermidis. Biofilm-forming Staphylococcus epidermidis with a VCM MIC of 1 μg/mL was used. The bacteria were made to adhere to a stainless steel washer and treated with VCM at different times and concentrations. VCM was administered 0, 2, 4, and 8 hours after adhesion. The amount of biofilm formed was evaluated based on the biofilm coverage rates (BCRs before and after VCM administration, bacterial viability in biofilm was visually observed using the fluorescence staining method, and the viable bacterial count in biofilm was measured. The VCM concentration required to decrease BCR significantly compared with that of VCM-untreated bacteria was 4 μg/mL, even in the 0 hr group. In the 4 and 8 hr groups, VCM could not inhibit biofilm growth even at 1,024 μg/mL. In the 8 hr group, viable bacteria remained in biofilm at a count of 104 CFU even at a high VCM concentration (1,024 μg/mL. It was suggested that biofilm-forming Staphylococcus epidermidis expresses resistance to VCM early after adhesion to a metal surface. Resistance increased over time after adhesion as the biofilm formed, and strong resistance was expressed 4–8 hours after adhesion.

  2. Chemical Forms of Heavy Metals in Bottom Sediments of the Mitręga Reservoir

    Directory of Open Access Journals (Sweden)

    Dąbrowska Lidia


    Full Text Available Bottom sediments originating from the Mitręga water reservoir were studied. It was assayed, in what chemical forms heavy metals (zinc, copper, nickel, cadmium and lead occur in sediments, using the method of sequential extraction BCR. According to the geochemical criteria with respect to the content of Zn, Cu and Ni, the sediments in all measuring points were classified as uncontaminated, however because of the Cd content - as moderately contaminated. The highest Cu and Ni content was found in the sediment collected in the southern part of the reservoir, 15 and 11 mg/kg d.m, respectively. In the case of Zn, Pb and Cd, the sediment collected at the outflow of the Mitręga river was the most contaminated; metal content amounted to 136; 35; 3 mg/kg d.m., respectively. Based on the conducted fractionation of heavy metals, it was found that the potential mobility of metals, hence the possibility of secondary pollution of the reservoir open water, are arranged in the following order: Zn> Cd> Ni> Cu ~ Pb.

  3. Compound

    Indian Academy of Sciences (India)

    A: in CDCl3, B: in DMSO, a) keto-amine, b) phenol-imine form. * Solubility in CDCl3 and/ or DMSO is not enough for recording 13C NMR spectrum. Table S3. 1H and 13C NMR spectral data of Schiff bases (9 and 13).

  4. Effects of coal combustion products and metal compounds on sister chromatid exchange (SCE) in a macrophagelike cell line. (United States)

    Andersen, O


    Investigations of genotoxic effects of particles have almost exclusively been performed by organic extraction, while direct investigations in cells capable of engulfing particles have only been performed in few cases. Thus, in most studies, the eventual effects of particle-associated metal compounds have remained undiscovered. The present study attempted direct measurement of genotoxic effects of particulate coal combustion products by using the P388D(1) macrophage cell line. The capability of these cells for phagocytosis was demonstrated with insoluble particles. The sister chromatid exchange (SCE) test was used for measuring genotoxic effects of test compounds. Dimethylnitrosamine and benzo(a)pyrene did not increase SCE, indicating that the P388D(1) cell line has lost the capacity for metabolism of latent organic carcinogens, reducing the value of these cells for evaluating genotoxic effects of complex particles. Indirect evidence has been obtained that the cell line may be infected with a virus. Thus, interactions between virus and test compound may lead to erroneous results. This should be kept in mind during evaluation of the results. The effects of metals with reported carcinogenic or mutagenic effects on SCE were compared in P388D(1) cells and human lymphocytes: NaAsO(2), CdCl(2), K(2)Cr(2)O(7), CoCl(2), CH(3)HgCl and MnSO(4) increased SCE in both cell systems. Pb(CH(3)COO)(2), BeSO(4) and NiSO(4) had a weak effect on SCE in P388D(1). Pb(CH(3)COO)(2) and NiSO(4), but not BeSO(4), increased SCE in human lymphocytes. Cr(CH(3)COO)(3) increased SCE in human lymphocytes at high concentration, but was a strong inducer of increased SCE in P388D(1) cells, which take up Cr(III) by phagocytosis. This suggests that the Cr(III) ion is an ultimate carcinogenic form of chromium. Generally P388D(1) cells and human lymphocytes respond to in vitro exposure to metals in agreement with reported mutagenic/carcinogenic effects of the metals. Of four precipitated coal fly ash

  5. Quadratic solid-shell elements for nonlinear structural analysis and sheet metal forming simulation (United States)

    Wang, Peng; Chalal, Hocine; Abed-Meraim, Farid


    In this paper, two quadratic solid-shell (SHB) elements are proposed for the three-dimensional modeling of thin structures. These consist of a 20-node hexahedral solid-shell element, denoted SHB20, and its 15-node prismatic counterpart, denoted SHB15. The formulation of these elements is extended in this work to include geometric and material nonlinearities, for application to problems involving large displacements and rotations as well as plasticity. For this purpose, the SHB elements are coupled with large-strain anisotropic elasto-plastic constitutive equations for metallic materials. Although based on a purely three-dimensional approach, several modifications are introduced in the formulation of these elements to provide them with interesting shell features. In particular, a special direction is chosen to represent the thickness, along which a user-defined number of integration points are located. Furthermore, for efficiency requirements and for alleviating locking phenomena, an in-plane reduced-integration scheme is adopted. The resulting formulations are implemented into the finite element software ABAQUS/Standard and, to assess their performance, a variety of nonlinear benchmark problems are investigated. Attention is then focused on the simulation of various complex sheet metal forming processes, involving large strain, anisotropic plasticity, and double-sided contact. From all simulation results, it appears that the SHB elements represent an interesting alternative to traditional shell and solid elements, due to their versatility and capability of accurately modeling selective nonlinear benchmark problems as well as complex sheet metal forming processes.

  6. Friction and lubrication modelling in sheet metal forming simulations of the Volvo XC90 inner door (United States)

    Sigvant, M.; Pilthammar, J.; Hol, J.; Wiebenga, J. H.; Chezan, T.; Carleer, B.; van den Boogaard, A. H.


    The quality of sheet metal formed parts is strongly dependent on the friction and lubrication conditions that are acting in the actual production process. Although friction is of key importance, it is currently not considered in detail in stamping simulations. This paper presents project results considering friction and lubrication modelling in stamping simulations of the Volvo XC90 inner door. For this purpose, the TriboForm software is used in combination with the AutoForm software. Validation of the simulation results is performed based on door-inner parts taken from the press line in a full-scale production run. The project results demonstrate the improved prediction accuracy of stamping simulations.

  7. A slow atomic diffusion process in high-entropy glass-forming metallic melts (United States)

    Chen, Changjiu; Wong, Kaikin; Krishnan, Rithin P.; Embs, Jan P.; Chathoth, Suresh M.


    Quasi-elastic neutron scattering has been used to study atomic relaxation processes in high-entropy glass-forming metallic melts with different glass-forming ability (GFA). The momentum transfer dependence of mean relaxation time shows a highly collective atomic transport process in the alloy melts with the highest and lowest GFA. However, a jump diffusion process is the long-range atomic transport process in the intermediate GFA alloy melt. Nevertheless, atomic mobility close to the melting temperature of these alloy melts is quite similar, and the temperature dependence of the diffusion coefficient exhibits a non-Arrhenius behavior. The atomic mobility in these high-entropy melts is much slower than that of the best glass-forming melts at their respective melting temperatures.


    Directory of Open Access Journals (Sweden)

    Ángel Silvio Machado Rodríguez


    Full Text Available Sintering is a process of metal forming using metal powders, and it has a wide range of applications including for example, the manufacturing of parts for automotive components, home appliances, cutting tools, power tools, for the manufacturing of dental devices, among others. The process is characterized by the production of large-scale low cost parts and has a low environmental impact compared to other existing technologies, it requires less energy for processing and enables high utilization of raw materials. Also, it has the characteristic of obtaining, in most cases, the parts with final tolerances necessary for direct use by the customer, which ultimately reduces considerably the cost of production. The process is characterized by minimizing the loss of raw materials; facilitating precise control of the desired chemical composition; eliminating or reducing machining operations; providing a good surface finish; being an easy production process of automation; obtaining high purity; and ensuring exactly resistance characteristics required for each project.

  9. New Half-Metallic Materials: FeRuCrP and FeRhCrP Quaternary Heusler Compounds

    Directory of Open Access Journals (Sweden)

    Jiannan Ma


    Full Text Available The electronic structures and magnetic properties of FeRuCrP and FeRhCrP quaternary Heusler compounds with LiMgPbSb-type structures have been investigated via first-principles calculations. The calculational results show that both FeRuCrP and FeRhCrP compounds present perfect half-metallic properties: Showing large half-metallic band gaps of 0.39 eV and 0.38 eV, respectively. The total magnetic moments of FeRuCrP and FeRhCrP are 3 μB and 4 μB per formula unit, respectively. The magnetism of them mainly comes from the 3d electrons of Cr atoms and follows the Slater-Paulig behavior of Heusler compounds: Mt = Zt − 24. Furthermore, the half-metallic properties of FeRuCrP and FeRhCrP compounds can be kept in a quite large range of lattice constants (about 5.44–5.82 Å and 5.26–5.86 Å, respectively and are quite robust against tetragonal deformation (c/a ratio in the range of 0.94–1.1 and 0.97–1.1, respectively. Moreover, the large negative cohesion energy and formation energy of FeRuCrP and FeRhCrP compounds indicate that they can be synthesized experimentally.

  10. Beating Homogeneous Nucleation and Tuning Atomic Ordering in Glass-Forming Metals by Nanocalorimetry. (United States)

    Zhao, Bingge; Yang, Bin; Abyzov, Alexander S; Schmelzer, Jürn W P; Rodríguez-Viejo, Javier; Zhai, Qijie; Schick, Christoph; Gao, Yulai


    In this paper, the amorphous Ce 68 Al 10 Cu 20 Co 2 (atom %) alloy was in situ prepared by nanocalorimetry. The high cooling and heating rates accessible with this technique facilitate the suppression of crystallization on cooling and the identification of homogeneous nucleation. Different from the generally accepted notion that metallic glasses form just by avoiding crystallization, the role of nucleation and growth in the crystallization behavior of amorphous alloys is specified, allowing an access to the ideal metallic glass free of nuclei. Local atomic configurations are fundamentally significant to unravel the glass forming ability (GFA) and phase transitions in metallic glasses. For this reason, isothermal annealing near T g from 0.001 s to 25,000 s following quenching becomes the strategy to tune local atomic configurations and facilitate an amorphous alloy, a mixed glassy-nanocrystalline state, and a crystalline sample successively. On the basis of the evolution of crystallization enthalpy and overall latent heat on reheating, we quantify the underlying mechanism for the isothermal nucleation and crystallization of amorphous alloys. With Johnson-Mehl-Avrami method, it is demonstrated that the coexistence of homogeneous and heterogeneous nucleation contributes to the isothermal crystallization of glass. Heterogeneous rather than homogeneous nucleation dominates the isothermal crystallization of the undercooled liquid. For the mixed glassy-nanocrystalline structure, an extraordinary kinetic stability of the residual glass is validated, which is ascribed to the denser packed interface between amorphous phase and ordered nanocrystals. Tailoring the amorphous structure by nanocalorimetry permits new insights into unraveling GFA and the mechanism that correlates local atomic configurations and phase transitions in metallic glasses.

  11. Flexible metal-organic framework compounds: In situ studies for selective CO{sub 2} capture

    Energy Technology Data Exchange (ETDEWEB)

    Allen, A.J., E-mail: [Material Measurement Laboratory, National Institute of Standards and Technology (NIST), Gaithersburg, MD 20899-8520 (United States); Espinal, L.; Wong-Ng, W. [Material Measurement Laboratory, National Institute of Standards and Technology (NIST), Gaithersburg, MD 20899-8520 (United States); Queen, W.L. [NIST Center for Neutron Research, Gaithersburg, MD 20899-6102 (United States); The Molecular Foundry, Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA 94720 (United States); Brown, C.M. [NIST Center for Neutron Research, Gaithersburg, MD 20899-6102 (United States); Department of Chemical and Biomolecular Engineering, University of Delaware, Newark, DE 19716 (United States); Kline, S.R. [NIST Center for Neutron Research, Gaithersburg, MD 20899-6102 (United States); Kauffman, K.L. [National Energy Technology Laboratory (NETL), US Department of Energy, Pittsburgh, PA 15236 (United States); Culp, J.T. [National Energy Technology Laboratory (NETL), US Department of Energy, Pittsburgh, PA 15236 (United States); URS Corporation, South Park, PA 15219 (United States); Matranga, C. [National Energy Technology Laboratory (NETL), US Department of Energy, Pittsburgh, PA 15236 (United States)


    Results are presented that explore the dynamic structural changes occurring in two highly flexible nanocrystalline metal-organic framework (MOF) compounds during the adsorption and desorption of pure gases and binary mixtures. The Ni(1,2-bis(4-pyridyl)ethylene)[Ni(CN){sub 4}] and catena-bis(dibenzoylmethanato)-(4,4′-bipyridyl)nickel(II) chosen for this study are 3-D and 1-D porous coordination polymers (PCP) with a similar gate opening pressure response for CO{sub 2} isotherms at 303 K, but with differing degrees of flexibility for structural change to accommodate guest molecules. As such, they serve as a potential model system for evaluating the complex kinetics associated with dynamic structure changes occurring in response to gas adsorption in flexible MOF systems. Insights into the crystallographic changes occurring as the MOF pore structure expands and contracts in response to interactions with CO{sub 2}, N{sub 2}, and CO{sub 2}/N{sub 2} mixtures have been obtained from in situ small-angle neutron scattering and neutron diffraction, combined with ex situ X-ray diffraction structure measurements. The role of structure in carbon capture functionality is discussed with reference to the ongoing characterization challenges and a possible materials-by-design approach. - Graphical abstract: We present in situ small-angle neutron scattering results for two flexible metal-organic frameworks (MOFs). The figure shows that for one (NiBpene, high CO{sub 2} adsorption) the intensity of the Bragg peak for the expandable d-spacing most associated with CO{sub 2} adsorption varies approximately with the isotherm, while for the other (NiDBM-Bpy, high CO{sub 2} selectivity) the d-spacing, itself, varies with the isotherm. The cartoons show the proposed modes of structural change. - Highlights: • Dynamic structures of two flexible MOF CO{sub 2} sorbent compounds are compared in situ. • These porous solid sorbents serve as models for pure & dual gas adsorption. • Different

  12. Flexible metal-organic framework compounds: In situ studies for selective CO2 capture

    International Nuclear Information System (INIS)

    Allen, A.J.; Espinal, L.; Wong-Ng, W.; Queen, W.L.; Brown, C.M.; Kline, S.R.; Kauffman, K.L.; Culp, J.T.; Matranga, C.


    Results are presented that explore the dynamic structural changes occurring in two highly flexible nanocrystalline metal-organic framework (MOF) compounds during the adsorption and desorption of pure gases and binary mixtures. The Ni(1,2-bis(4-pyridyl)ethylene)[Ni(CN) 4 ] and catena-bis(dibenzoylmethanato)-(4,4′-bipyridyl)nickel(II) chosen for this study are 3-D and 1-D porous coordination polymers (PCP) with a similar gate opening pressure response for CO 2 isotherms at 303 K, but with differing degrees of flexibility for structural change to accommodate guest molecules. As such, they serve as a potential model system for evaluating the complex kinetics associated with dynamic structure changes occurring in response to gas adsorption in flexible MOF systems. Insights into the crystallographic changes occurring as the MOF pore structure expands and contracts in response to interactions with CO 2 , N 2 , and CO 2 /N 2 mixtures have been obtained from in situ small-angle neutron scattering and neutron diffraction, combined with ex situ X-ray diffraction structure measurements. The role of structure in carbon capture functionality is discussed with reference to the ongoing characterization challenges and a possible materials-by-design approach. - Graphical abstract: We present in situ small-angle neutron scattering results for two flexible metal-organic frameworks (MOFs). The figure shows that for one (NiBpene, high CO 2 adsorption) the intensity of the Bragg peak for the expandable d-spacing most associated with CO 2 adsorption varies approximately with the isotherm, while for the other (NiDBM-Bpy, high CO 2 selectivity) the d-spacing, itself, varies with the isotherm. The cartoons show the proposed modes of structural change. - Highlights: • Dynamic structures of two flexible MOF CO 2 sorbent compounds are compared in situ. • These porous solid sorbents serve as models for pure & dual gas adsorption. • Different degrees of structural freedom give different

  13. Comprehensive uranium thiophosphate chemistry: Framework compounds based on pseudotetrahedrally coordinated central metal atoms

    International Nuclear Information System (INIS)

    Neuhausen, Christine; Panthoefer, Martin; Tremel, Wolfgang; Hatscher, Stephan T.; Urland, Werner


    The new ternary compounds UP 2 S 6 , UP 2 S 7 , U(P 2 S 6 ) 2 , and U 3 (PS 4 ) 4 were prepared from uranium metal, phosphorus pentasulfide, and sulfur at 700 C. The crystal structures were determined by single-crystal X-ray diffraction methods. UP 2 S 6 (I) crystallizes in the ZrP 2 S 6 structure type [tetragonal, P4 2 /m, a = 6.8058(7) Aa, c = 9.7597(14) Aa, Z = 2], which consists of central uranium(IV) atoms coordinated by P 2 S 6 4- anions (staggered conformation). The anions are two-dimensional connectors for four uranium cations arranged in one plane. The structure of UP 2 S 7 (II) [orthorhombic, Fddd, a = 8.9966(15) Aa, b = 15.2869(2) Aa, c = 30.3195(5) Aa, Z = 16] is closely related to the monoclinic ZrP 2 S 7 structure type. It consists of U 4+ cations linked by P 2 S 7 4- ligands, the resulting 3D network contains large pores (diameter approx. 3.5 x 16.7 Aa). In the previously reported compound U(P 2 S 6 ) 2 (III) [I4 1 /a, a = 12.8776(9) Aa, c = 9.8367(10) Aa, Z = 2], the metal atoms are coordinated by four bidentate P 2 S 6 2- ligands. This arrangement can be considered as a pseudotetrahedral coordination of the uranium atoms by the linear ligands. Three of the resulting diamondoid frameworks are inseparably interwoven in order to optimize space filling. U 3 (PS 4 ) 4 (IV) [I4 1 /acd, a = 10.7440(9) Aa, c = 19.0969(2) Aa, Z = 2] crystallizes in a defect variant of the PrPS 4 structure type, with 50 % of the U2 sites statistically occupied with uranium atoms. The resulting stoichiometry is U 3 (PS 4 ) 4 with tetravalent uranium atoms. The structure of U 3 (PS 4 ) 4 consists of uranium atoms connected by PS 4 3- groups, each PS 4 group linking four central uranium atoms. Vibrational spectra, which were recorded for I-III, show good agreement between the obtained results and the expected values for the anionic units, while magnetic measurements confirm the presence of tetravalent uranium. (Copyright copyright 2013 WILEY-VCH Verlag GmbH and Co. KGa

  14. NMR shielding calculations across the periodic table: diamagnetic uranium compounds. 2. Ligand and metal NMR. (United States)

    Schreckenbach, Georg


    In this and a previous article (J. Phys. Chem. A 2000, 104, 8244), the range of application for relativistic density functional theory (DFT) is extended to the calculation of nuclear magnetic resonance (NMR) shieldings and chemical shifts in diamagnetic actinide compounds. Two relativistic DFT methods are used, ZORA ("zeroth-order regular approximation") and the quasirelativistic (QR) method. In the given second paper, NMR shieldings and chemical shifts are calculated and discussed for a wide range of compounds. The molecules studied comprise uranyl complexes, [UO(2)L(n)](+/-)(q); UF(6); inorganic UF(6) derivatives, UF(6-n)Cl(n), n = 0-6; and organometallic UF(6) derivatives, UF(6-n)(OCH(3))(n), n = 0-5. Uranyl complexes include [UO(2)F(4)](2-), [UO(2)Cl(4)](2-), [UO(2)(OH)(4)](2-), [UO(2)(CO(3))(3)](4-), and [UO(2)(H(2)O)(5)](2+). For the ligand NMR, moderate (e.g., (19)F NMR chemical shifts in UF(6-n)Cl(n)) to excellent agreement [e.g., (19)F chemical shift tensor in UF(6) or (1)H NMR in UF(6-n)(OCH(3))(n)] has been found between theory and experiment. The methods have been used to calculate the experimentally unknown (235)U NMR chemical shifts. A large chemical shift range of at least 21,000 ppm has been predicted for the (235)U nucleus. ZORA spin-orbit appears to be the most accurate method for predicting actinide metal chemical shifts. Trends in the (235)U NMR chemical shifts of UF(6-n)L(n) molecules are analyzed and explained in terms of the calculated electronic structure. It is argued that the energy separation and interaction between occupied and virtual orbitals with f-character are the determining factors.

  15. Breakdown of half-metallic ferromagnetism in zinc-blende II-V compounds: First-principles calculations (United States)

    Li, Yun; Yu, Jaejun


    We investigated the electronic and magnetic properties of a series of zinc-blend II-V compounds by carrying out density-functional theory calculations including spin-orbit couplings. Contrary to the case of CaN and CaP, the half-metallic characteristics of the II-V compounds such as CaBi were found to be destroyed. Our analysis of the valence-band structures of CaAs, CaSb, and CaBi revealed a critical role of the spin-orbit coupling interactions on the exchange-split band structure, thereby leading to breakdown of the half-metallic ferromagnetism for the systems with heavier group V elements in the zinc-blend II-V compounds.

  16. Yucca Mountain project canister material corrosion studies as applied to the electrometallurgical treatment metallic waste form

    Energy Technology Data Exchange (ETDEWEB)

    Keiser, D.D.


    Yucca Mountain, Nevada is currently being evaluated as a potential site for a geologic repository. As part of the repository assessment activities, candidate materials are being tested for possible use as construction materials for waste package containers. A large portion of this testing effort is focused on determining the long range corrosion properties, in a Yucca Mountain environment, for those materials being considered. Along similar lines, Argonne National Laboratory is testing a metallic alloy waste form that also is scheduled for disposal in a geologic repository, like Yucca Mountain. Due to the fact that Argonne`s waste form will require performance testing for an environment similar to what Yucca Mountain canister materials will require, this report was constructed to focus on the types of tests that have been conducted on candidate Yucca Mountain canister materials along with some of the results from these tests. Additionally, this report will discuss testing of Argonne`s metal waste form in light of the Yucca Mountain activities.

  17. A DFT study of volatile organic compounds adsorption on transition metal deposited graphene

    Energy Technology Data Exchange (ETDEWEB)

    Kunaseth, Manaschai, E-mail: [Nanoscale Simulation Laboratory, National Nanotechnology Center (NANOTEC), National Science and Technology Development Agency (NSTDA), Pathum Thani, 12120 (Thailand); Poldorn, Preeyaporn [Department of Chemistry and Center of Excellence for Innovation in Chemistry, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani, 34190 (Thailand); Junkeaw, Anchalee; Meeprasert, Jittima; Rungnim, Chompoonut; Namuangruk, Supawadee [Nanoscale Simulation Laboratory, National Nanotechnology Center (NANOTEC), National Science and Technology Development Agency (NSTDA), Pathum Thani, 12120 (Thailand); Kungwan, Nawee [Department of Chemistry, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Inntam, Chan [Department of Chemistry and Center of Excellence for Innovation in Chemistry, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani, 34190 (Thailand); Jungsuttiwong, Siriporn, E-mail: [Department of Chemistry and Center of Excellence for Innovation in Chemistry, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani, 34190 (Thailand)


    Highlights: • VOCs removal via modified carbon-based adsorbent using density functional theory. • The single-vacancy defective graphene (SDG) with metal-deposited significantly increase the adsorption efficiency. • TM-doped SDG is a suitable adsorbent material for VOC removal. • Electron in hybridized sp{sup 2}-orbitals of heteroatoms has an effect on mode of adsorption. - Abstract: Recently, elevated global emission of volatile organic compounds (VOCs) was associated to the acceleration and increasing severity of climate change worldwide. In this work, we investigated the performance of VOCs removal via modified carbon-based adsorbent using density functional theory. Here, four transition metals (TMs) including Pd, Pt, Ag, and Au were deposited onto single-vacancy defective graphene (SDG) surface to increase the adsorption efficiency. Five prototypical VOCs including benzene, furan, pyrrole, pyridine, and thiophene were used to study the adsorption capability of metal-deposited graphene adsorbent. Calculation results revealed that Pd, Pt, Au, and Ag atoms and nanoclusters bind strongly onto the SDG surface. In this study, benzene, furan and pyrrole bind in the π-interaction mode using delocalized π-electron in aromatic ring, while pyridine and thiophene favor X- interaction mode, donating lone pair electron from heteroatom. In terms of adsorption, pyridine VOC adsorption strengths to the TM-cluster doped SDG surfaces are Pt{sub 4} (−2.11 eV) > Pd{sub 4} (−2.05 eV) > Ag{sub 4} (−1.53 eV) > Au{sub 4} (−1.87 eV). Our findings indicate that TM-doped SDG is a suitable adsorbent material for VOC removal. In addition, partial density of states analysis suggests that benzene, furan, and pyrrole interactions with TM cluster are based on p-orbitals of carbon atoms, while pyridine and thiophene interactions are facilitated by hybridized sp{sup 2}-orbitals of heteroatoms. This work provides a key insight into the fundamentals of VOCs adsorption on carbon

  18. Cloaking of metal grid electrodes on Lambertian emitters by free-form refractive surfaces. (United States)

    Schumann, Martin F; Fritz, Benjamin; Eckstein, Ralph; Lemmer, Uli; Gomard, Guillaume; Wegener, Martin


    We discuss invisibility cloaking of metal grid electrodes on Lambertian light emitters by using dielectric free-form surfaces. We show that cloaking can be ideal in geometrical optics for all viewing directions if reflections at the dielectric-air interface are negligible. We also present corresponding white-light proof-of-principle experiments that demonstrate close-to-ideal cloaking for a wide range of viewing angles. Remaining imperfections are analyzed by ray-tracing calculations. The concept can potentially be used to enhance the luminance homogeneity of large-area organic light-emitting diodes.

  19. Direct testing of scale effects in metal forming friction and lubrication

    DEFF Research Database (Denmark)

    Nielsen, Peter Søe; Calaon, Matteo; Paldan, Nikolas Aulin


    Downscaling of metal forming operations from macro to micro scale implies significant changes caused by size effects, among these the friction increase, which has been reported by researchers using indirect test methods such as ring-compression test and double-cup-extrusion test. In the present...... work a new test equipment is developed for direct friction measurements in the range from macro to micro scale. Investigations confirm a significant friction increase when downscaling. Visual inspection of the work pieces show this to be explained by the amount of open and closed lubricant pockets....

  20. Tool-life prediction under multi-cycle loading during metal forming: a feasibility study


    Yuan, X; Zhou, D; Politis, DENIS; Ma, GUOJIA; Wang, L


    In the present research, the friction and wear behaviour of a hard coating were studied by using ball-on-disc tests to simulate the wear process of the coated tools for sheet metal forming process. The evolution of the friction coefficient followed a typical dual-plateau pattern, i.e. at the initial stage of sliding, the friction coefficient was relatively low, followed by a sharp increase due to the breakdown of the coatings after a certain number of cyclic dynamic loadings. This phenomenon ...

  1. Using metal nanostructures to form hydrocarbons from carbon dioxide, water and sunlight

    Directory of Open Access Journals (Sweden)

    Cong Wang


    Full Text Available Based on experimental results, we propose a mechanism that allows the use of metal nanostructures to synthesize hydrocarbons and carbohydrates from carbon dioxide, water and sunlight. When sunlight impinges on cobalt nanostructures in a glass chamber, its intensity is greatly enhanced around the tips of the nanostructures through surface plasmon excitations focusing effect, and it then photodissociates the water and carbon dioxide molecules through enhanced photon absorptions of ions around the tips of the nanostructures. The photodissociated molecules in excited states remain on the cobalt nanostructure surfaces and various hydrocarbons and carbohydrates then will be formed around the surfaces at temperatures much lower than 100 oC.

  2. Testing and modelling of industrial tribo-systems for sheet metal forming

    DEFF Research Database (Denmark)

    Friis, Kasper Leth; Nielsen, Peter Søe; Bay, Niels


    Galling is a well-known problem in sheet metal forming of tribological difficult materials such as stainless steel. In this work new, environmentally friendly lubricants and wear resistant tool materials are tested in a laboratory environment using a strip reduction test as well as in a real prod....... The backstroke force and tool surface temperature are found to be highly sensitive to the initiation of galling. Furthermore the results combined with numerical investigations indicates that the level of the interface temperature is a vital factor predicting the initiation of galling....

  3. A multi-level code for metallurgical effects in metal-forming processes

    Energy Technology Data Exchange (ETDEWEB)

    Taylor, P.A.; Silling, S.A. [Sandia National Labs., Albuquerque, NM (United States). Computational Physics and Mechanics Dept.; Hughes, D.A.; Bammann, D.J.; Chiesa, M.L. [Sandia National Labs., Livermore, CA (United States)


    The authors present the final report on a Laboratory-Directed Research and Development (LDRD) project, A Multi-level Code for Metallurgical Effects in metal-Forming Processes, performed during the fiscal years 1995 and 1996. The project focused on the development of new modeling capabilities for simulating forging and extrusion processes that typically display phenomenology occurring on two different length scales. In support of model fitting and code validation, ring compression and extrusion experiments were performed on 304L stainless steel, a material of interest in DOE nuclear weapons applications.

  4. Process simulation and experimental validation of Hot Metal Gas Forming with new press hardening steels (United States)

    Paul, A.; Reuther, F.; Neumann, S.; Albert, A.; Landgrebe, D.


    One field in the work of the Fraunhofer Institute for Machine Tools and Forming Technology IWU in Chemnitz is industry applied research in Hot Metal Gas Forming, combined with press hardening in one process step. In this paper the results of investigations on new press hardening steels from SSAB AB (Docol®1800 Bor and Docol®2000 Bor) are presented. Hot tensile tests recorded by the project partner (University of West Bohemia, Faculty of Mechanical Engineering) were used to create a material model for thermo-mechanical forming simulations. For this purpose the provided raw data were converted into flow curve approximations of the real stress-real strain-curves for both materials and afterwards integrated in a LS-DYNA simulation model of Hot Metal Gas Forming with all relevant boundary conditions and sub-stages. Preliminary experimental tests were carried out using a tool at room temperature to permit evaluation of the forming behaviour of Docol 1800 Bor and Docol 2000 Bor tubes as well as validation of the simulation model. Using this demonstrator geometry (outer diameter 57 mm, tube length 300 mm, wall thickness 1.5 mm), the intention was to perform a series of tests with different furnace temperatures (from 870 °C to 1035 °C), maximum internal pressures (up to 67 MPa) and pressure build-up rates (up to 40 MPa/s) to evaluate the formability of Docol 1800 Bor and Docol 2000 Bor. Selected demonstrator parts produced in that way were subsequently analysed by wall thickness and hardness measurements. The tests were carried out using the completely modernized Dunkes/AP&T HS3-1500 hydroforming press at the Fraunhofer IWU. In summary, creating a consistent simulation model with all relevant sub-stages was successfully established in LS-DYNA. The computation results show a high correlation with the experimental data regarding the thinning behaviour. The Hot Metal Gas Forming of the demonstrator geometry was successfully established as well. Different hardness values

  5. First-principles calculations: The elemental transition metals and their compounds

    International Nuclear Information System (INIS)

    Watson, R.E.; Fernando, G.W.; Weinert, M.; Davenport, J.W.


    If done with sufficient care, present day a priori theory yields calculated enthalpies of formation whose agreement with experiment (when such data is available) is of the order of the experimental scatter. Comparisons will be made for the Pt-Ti systems for which such data exist and for which one crystal structure involves atomics sites of low symmetry. Two other cases will be considered for which there is no direct experimental heats data. The first of these will be the structural stabilities of the 4d elemental metals. Such structural stabilities have been an issue of contention between electronic structure theorists and those who construct phase diagrams for some twenty-five years. The second involves the energetics of forming metal adlayers and artificial multilayers. The distortion energies associated with the requirement that adlayers (or multilayers) conform to some given substrate are often the controlling factors in the fabrication of multilayer materials. This contribution is best understood by invoking a combination of elemental structural promotion energies plus elastic distortions from these structures. As will be seen, the fabrication of multilayers also involves a term not normally encountered in bulk phase diagram considerations, namely the difference in surface energies of the two multilayer constituents. 22 refs., 4 figs

  6. Temperature dependence of the field-induced magnetic form factor of the intermetallic compound PrSn3

    International Nuclear Information System (INIS)

    Loong, C.; Stassis, C.; Zarestky, J.; McMasters, O.D.; Moon, R.M.


    The spatial distribution of the magnetization induced by a magnetic field of 42.5 kG in a single crystal of PrSn 3 has been studied at 100 and 20 K using polarized neutron scattering techniques. We find that at both temperatures the measured form factor is in good agreement with the theoretical 4f magnetic form factor of the Pr 3+ ion. This result is in contrast to the large deviations from the 4f magnetic form factor of Ce 3+ observed, at low temperatures, for the mixed-valence compounds CeSn 3 and CePd 3 . The localized static susceptibility of PrSn 3 at 100 and 20 K, obtained by extrapolating the measured form factor to the forward direction, agrees very well with bulk susceptibility measurements

  7. Analysis of metals in organic compounds by energy dispersive X-ray fluorescence analysis

    International Nuclear Information System (INIS)

    Anjos, Marcelino J.; Lopes, Ricardo T.; Jesus, Edgar F.O. de


    Using energy dispersive X-ray fluorescence analysis with an X-ray tube filtered with Ti. It was possible to determine the concentration of the elements at ppm level of several elements: K, Ca, Ti, Cr, Mn, Fe, Ni, Cu, Zn As, Rb, Sr, Y, Zr, and Pb in two types of organic compound enough used in the agriculture: organic compound of urban garbage (Fertilurb) and aviary bed (birds manure). The experimental setup is composed of: x-ray tube (Oxford, 30 kV, 50 μA and W anode), an ORTEC Si-Li detector, with an energy resolution of about 180 eV at 5.9 keV and an ORTEC multichannel-analyser. The X-ray beam is quasi- monochromatic by using Ti filter. The samples were prepared in pellet form with superficial density in the range of 100 mg/cm 2 . The fundamental parameter method was used in order to verify the elemental concentration. The radiation transmission method was going used to the radiation absorption effects correction in the samples. (author)

  8. Aerosol reduction/expansion synthesis (A-RES) for zero valent metal particles (United States)

    Leseman, Zayd; Luhrs, Claudia; Phillips, Jonathan; Soliman, Haytham


    Various embodiments provide methods of forming zero valent metal particles using an aerosol-reductive/expansion synthesis (A-RES) process. In one embodiment, an aerosol stream including metal precursor compound(s) and chemical agent(s) that produces reducing gases upon thermal decomposition can be introduced into a heated inert atmosphere of a RES reactor to form zero valent metal particles corresponding to metals used for the metal precursor compound(s).

  9. Occurrence Forms of Carbon, Sulfur, and Noble Metals in Deposits of the Black-Shale Formation by the Example of the Degdekan Gold-Ore Deposit (Northeastern Russia) (United States)

    Tauson, V. L.; Kravtsova, R. G.; Akimov, V. V.; Lipko, S. V.; Spiridonov, A. M.; Budyak, A. E.; Voronova, I. Yu.; Belozerova, O. Yu.; Arsentev, K. Yu.


    Pyrite crystals and ore-bearing shales of the Degdekan deposit were studied by means of XPS, SEM-EDX, EPMA, and AAS. Five peaks of carbon organic forms were identified, conforming to polymer compounds containing either double bonds of carbon or alkyne groups and compounds containing C-OH and C=O bonds, as well as, probably, small amounts of S-containing compounds and those with functional groups of carboxylic acids. Sulfate prevails over sulfite in pyrites; among the surface sulfide forms, disulfide prevails over monosulfide; the presence of polysulfide is registered. The occurrence of various chemical forms of sulfur on the surface might provide for concentrating of microelements including the noble metals (NMs) in their surface-bound forms. The regular behavior of NMs (Au, Pt, Pd, and Ru) depending on the grain sizes (specific surfaces) of pyrite crystals along with the narrow range of the ratios of structural and surface components of the concentrations of different NMs points to NM coprecipitation with pyrite during the same productive stage. No capture of NM-containing carbonaceous phases took place, which should violate the regularity of Au distribution in pyrites of the Sukhoi Log deposit.

  10. Experimental Investigation of Frictional Resistances in the Drawbead Region of the Sheet Metal Forming Processes (United States)

    Trzepiecinski, T.; Fejkiel, R.; Lemu, H. G.


    Drawbeads are used in sheet metal forming to restrain the sheet from flowing freely into die cavity, especially in the case of forming unsymmetrical drawpieces. This process is necessary to produce an optimal stamped part without wrinkles and cracks. In this paper, a special tribological simulator is used to evaluate the frictional resistances during flowing the sheet through the circular shape bead. The tests were conducted on DC04 carbon steel sheets with a sheet thickness of 0.8 mm. Experiments were carried out at different process parameters: friction conditions, specimen widths, heights and surface roughness of drawbead. The results obtained in the drawbead friction test show that the value of friction coefficient depends on the width of the sample. The character of sheet deformation during bending and reverse bending on the sheet thickness over the drawbead changes the surface topography and real contact area of sheet and tool.

  11. Carbide-forming groups IVB-VIB metals: a new territory in the periodic table for CVD growth of graphene. (United States)

    Zou, Zhiyu; Fu, Lei; Song, Xiuju; Zhang, Yanfeng; Liu, Zhongfan


    Early transition metals, especially groups IVB-VIB metals, can form stable carbides, which are known to exhibit excellent "noble-metal-like" catalytic activities. We demonstrate herein the applications of groups IVB-VIB metals in graphene growth using atmospheric pressure chemical vapor deposition technique. Similar to the extensively studied Cu, Ni, and noble metals, these transition-metal foils facilitate the catalytic growth of single- to few-layer graphene. The most attractive advantage over the existing catalysts is their perfect control of layer thickness and uniformity with highly flexible experimental conditions by in situ converting the dissolved carbons into stable carbides to fully suppress the upward segregation/precipitation effect. The growth performance of graphene on these transition metals can be well explained by the periodic physicochemical properties of elements. Our work has disclosed a new territory of catalysts in the periodic table for graphene growth and is expected to trigger more interest in graphene research.

  12. Oriented Decoration in Metal-Functionalized Ordered Mesoporous Silicas and Their Catalytic Applications in the Oxidation of Aromatic Compounds

    Directory of Open Access Journals (Sweden)

    Shijian Zhou


    Full Text Available Ordered mesoporous silicas (OMSs attract considerable attention due to their advanced structural properties. However, for the pristine silica materials, the inert property greatly inhibits their catalytic applications. Thus, to contribute to the versatile surface of OMSs, different metal active sites, including acidic/basic sites and redox sites, have been introduced into specific locations (mesoporous channels and framework of OMSs and the metal-functionalized ordered mesoporous silicas (MOMSs show great potential in the catalytic applications. In this review, we first present the categories of metal active sites. Then, the synthesized processes of MOMSs are thoroughly discussed, in which the metal active sites would be introduced with the assistance of organic groups into the specific locations of OMSs. In addition, the structural morphologies of OMSs are elaborated and the catalytic applications of MOMSs in the oxidation of aromatic compounds are illustrated in detail. Finally, the prospects for the future development in this field are proposed.

  13. Analysis of heavy metals and sulphur-rich compounds in the water moss Fontinalis antipyretica L. ex Hedw

    Energy Technology Data Exchange (ETDEWEB)

    Bruns, I. [Martin-Luther Univ. Halle Wittenberg, Fachbereich Biochemie/Biotechnologie, Halle (Germany); Siebert, A. [Martin-Luther Univ. Halle Wittenberg, Fachbereich Biochemie/Biotechnologie, Halle (Germany); Baumbach, R. [Martin-Luther Univ. Halle Wittenberg, Fachbereich Biochemie/Biotechnologie, Halle (Germany); Miersch, J. [Martin-Luther Univ. Halle Wittenberg, Fachbereich Biochemie/Biotechnologie, Halle (Germany); Guenther, D. [Institut fuer Pflanzenbiochemie, Halle (Germany); Markert, B. [Internationales Hochschulinstitut Zittau, Lehrstuhl fuer Umweltverfahrenstechnik (Germany); Krauss, G.J. [Martin-Luther Univ. Halle Wittenberg, Fachbereich Biochemie/Biotechnologie, Halle (Germany)


    The water moss Fontinalis antipyretica has been investigated to estimate heavy metal pollution in the river Elbe (middle Germany). Procedures of plant separation, digestion as well as an analytical method for ICP-MS analyses have been evaluated. Reproducibility and accuracy have been demonstrated on BCR 61 (NIST) reference material and results have been compared with AAS and AES data. The distribution of heavy metals in different plant segments of indigenous material has been analyzed. Exposition of plant material in the river Elbe have shown to correlation between the heavy metal content in plants and that of water samples. Cd and Zn concentrations found in the plant material are significantly enriched relatively to control samples. To understand the sophisticated `real system` experiments have been carried out under laboratory conditions to investigate induced sulphur-rich compounds in the presence of heavy metals using HPLC including on-line derivatization. (orig.)

  14. Research on Liquid Forming Process of Nickel Superalloys Thin Sheet Metals

    Directory of Open Access Journals (Sweden)

    Hyrcza-Michalska M.


    Full Text Available The paper presents the study of drawability of thin sheet metals made of a nickel superalloy Inconel type. The manufacturing process of axisymmetric cup – cone and a closed section profile in the form of a circular tube were designed and analyzed. In both cases, working fluid-oil was used in place of the rigid tools. The process of forming liquid is currently the only alternative method for obtaining complex shapes, coatings, and especially if we do it with high-strength materials. In the case of nickel superalloys the search for efficient methods to manufacture of the shaped shell is one of the most considerable problems in aircraft industry [1-5]. However, the automotive industries have the same problem with so-called advanced high-strength steels (AHSS. Due to this, both industrial problems have been examined and the emphasis have been put on the process of liquid forming (hydroforming. The study includes physical tests and the corresponding numerical simulations performed, using the software Eta/Dynaform 5.9. Numerical analysis of the qualitative and quantitative forecasting enables the formability of materials with complex and unusual characteristics of the mechanical properties and forming technology. It has been found that only the computer aided design based on physical and numerical modeling, makes efficient plastic processing possible using a method of hydroforming. Drawability evaluation based on the determination of the mechanical properties of complex characteristics is an indispensable element of this design in the best practice of industrial manufacturing products made of thin sheet metals.

  15. Development and Testing of Tailored Tool Surfaces for Sheet Metal Forming

    DEFF Research Database (Denmark)

    Sulaiman, Mohd Hafis Bin

    This thesis describes measures taken to minimize or substitute environmentally hazardous lubricants applied in sheet metal forming processes by less harmful lubricants or not applying lubricant at all. The breakdown of lubricant film often leads to galling, and therefore application of the hazard......This thesis describes measures taken to minimize or substitute environmentally hazardous lubricants applied in sheet metal forming processes by less harmful lubricants or not applying lubricant at all. The breakdown of lubricant film often leads to galling, and therefore application......; compressibility of lubricants, application of structured tool surfaces and application of anti-seizure tool coatings. In order to analyze the mechanisms of lubricant entrapment and escape, knowledge of the lubricant bulk modulus characterizing the compressibility of lubricant is required. Two methods were studied...... ironing production of deep drawn, stainless steel cans, Diamond-Like Carbon (DLC) coating were deposited on SRT tools. The DLC coated tools with multi-, double- and single-layer coating structures were tested under severe tribological conditions, i.e, high normal pressure and temperature. A screening test...

  16. Calculation of electromagnetic force in electromagnetic forming process of metal sheet

    International Nuclear Information System (INIS)

    Xu Da; Liu Xuesong; Fang Kun; Fang Hongyuan


    Electromagnetic forming (EMF) is a forming process that relies on the inductive electromagnetic force to deform metallic workpiece at high speed. Calculation of the electromagnetic force is essential to understand the EMF process. However, accurate calculation requires complex numerical solution, in which the coupling between the electromagnetic process and the deformation of workpiece needs be considered. In this paper, an appropriate formula has been developed to calculate the electromagnetic force in metal work-piece in the sheet EMF process. The effects of the geometric size of coil, the material properties, and the parameters of discharge circuit on electromagnetic force are taken into consideration. Through the formula, the electromagnetic force at different time and in different positions of the workpiece can be predicted. The calculated electromagnetic force and magnetic field are in good agreement with the numerical and experimental results. The accurate prediction of the electromagnetic force provides an insight into the physical process of the EMF and a powerful tool to design optimum EMF systems.

  17. Phosphinocyclodextrins as confining units for catalytic metal centres. Applications to carbon–carbon bond forming reactions

    Directory of Open Access Journals (Sweden)

    Matthieu Jouffroy


    Full Text Available The capacity of two cavity-shaped ligands, HUGPHOS-1 and HUGPHOS-2, to generate exclusively singly phosphorus-ligated complexes, in which the cyclodextrin cavity tightly wraps around the metal centre, was explored with a number of late transition metal cations. Both cyclodextrin-derived ligands were assessed in palladium-catalysed Mizoroki–Heck coupling reactions between aryl bromides and styrene on one hand, and the rhodium-catalysed asymmetric hydroformylation of styrene on the other hand. The inability of both chiral ligands to form standard bis(phosphine complexes under catalytic conditions was established by high-pressure NMR studies and shown to have a deep impact on the two carbon–carbon bond forming reactions both in terms of activity and selectivity. For example, when used as ligands in the rhodium-catalysed hydroformylation of styrene, they lead to both high isoselectivity and high enantioselectivity. In the study dealing with the Mizoroki–Heck reactions, comparative tests were carried out with WIDEPHOS, a diphosphine analogue of HUGPHOS-2.

  18. Some recent developments in sheet metal forming for production of lightweight automotive parts (United States)

    Tisza, M.; Lukács, Zs; Kovács, P.; Budai, D.


    Low cost manufacturing in the automotive industry is one of the main targets due to the ever increasing global competition among car manufacturers all over the World. Sheet metal forming is one of the most important key technologies in the automotive industry; therefore the elaboration of new, innovative low cost manufacturing processes is one of the main objectives in sheet metal forming as well. In 2015 with the initiative of the Imperial College London a research consortium was established under the umbrella Low Cost Materials Processing Technologies for Mass Production of Lightweight Vehicles. The primary aim of this project is to provide affordable low cost weight reduction in mass production of vehicles considering the entire life-cycle. In this project, 19 European Institutions (Universities and Research Institutions) from 9 European countries are participating with the above targets. The University of Miskolc is one of the members of this research Consortium. In this paper, some preliminary results with the contributions of the University of Miskolc will be introduced.

  19. Dual mechanochemical immobilization of heavy metals and decomposition of halogenated compounds in automobile shredder residue using a nano-sized metallic calcium reagent. (United States)

    Mallampati, Srinivasa Reddy; Lee, Byoung Ho; Mitoma, Yoshiharu; Simion, Cristian


    Simultaneous immobilization of heavy metals and decomposition of halogenated organic compounds in different fractions of automobile shredder residue (ASR) were achieved with a nano-sized metallic calcium through a 60-min ball milling treatment. Heavy metal (HM) immobilization and chlorinated/brominated compound (CBC) decomposition efficiencies both reached 90-100 %, after ball milling with nanometallic calcium/calcium oxide (Ca/CaO) dispersion, regardless of ASR particle size (1.0, 0.45-1.0, and 0.250 mm). Concentrations of leachable HMs substantially decreased to a level lower than the regulatory standard limits (Co and Cd 0.3 mg L -1 ; Cr 1.5 mg L -1 ; Fe, Pb, and Zn 3.0 mg L -1 ; Mn and Ni 1 mg L -1 ) proposed by the Korean hazardous waste elution standard regulatory threshold. Scanning electron microscopy with energy-dispersive X-ray spectroscopy (SEM-EDS) element maps/spectra showed that while the amounts of HMs and CBCs detectable in ASR significantly decreased, the calcium mass percentage increased. X-ray powder diffraction (XRD) patterns indicate that the main fraction of enclosed/bound materials on ASR includes Ca-associated crystalline complexes that remarkably inhibit HM desorption and simultaneously transform dangerous CBCs into harmless compounds. The use of a nanometallic Ca/CaO mixture in a mechanochemical process to treat hazardous ASR (dry conditions) is an innovative approach to remediate cross-contaminated residues with heavy metals and halogenated compounds.

  20. Content and the forms of heavy metals in bottom sediments in the zone of industrial pollution sources ,

    Directory of Open Access Journals (Sweden)

    Voytyuk Y.Y.


    Full Text Available Regularities in the distribution of heavy metals in sediments in the zone of influence of the steel industry in Mariupol are installed. The study results of the forms of occurrence of Zn, Pb, Cu, Cr, Ni are represented. Ecological and geochemical assessment of sediment contamination by heavy metals is performed. The main sources of pollution of bottom sediments are air borne emissions from industrial plants, hydrogenous pollution in industrial sewage entering the water, sewage sludge, ash dumps, slag, ore, sludge, oil spills and salt solutions. Pollution hydrogenous sediments may be significant, contaminated sediments are a source of long-term contamination of water, even after cessation of discharges into rivers untreated wastewater. The environmental condition of bottom sediments in gross content of heavy metals is little information because they do not reflect the transformation and further migration to adjacent environment. The study forms of giving objective information for ecological and geochemical evaluation. The study forms of heavy metals in the sediments carried by successive extracts. Concentrations of heavy metals in the extracts determined by atomic absorption spectrometer analysis CAS-115. It was established that a number of elements typical of exceeding their content in bottom sediments of the background values, due likely to their technogenic origin. Man-made pollution of bottom sediments. Mariupol has disrupted the natural form of the ratio of heavy metals. In the studied sediments form ion exchange increased content of heavy metals, which contributes to their migration in the aquatic environment.

  1. Development of a new biaxial testing system for generating forming limit diagrams for sheet metals under hot stamping conditions


    Shao, Z; Li, N; Lin, J; Dean, TA


    Conventional experimental approaches used to generate forming limit diagrams (FLDs) for sheet metals at different linear strain paths are not applicable to hot stamping and cold die quenching processes because cooling occurs prior to deformation and consistent values of heating rate, cooling rate, deformation temperature and strain rate are not easy to obtain. A novel biaxial testing system for use in a Gleeble testing machine has been adopted to generate forming limits of sheet metals, inclu...

  2. Synthesis, characterization and thermal behaviour of solid-state compounds of benzoates with some bivalent transition metal ions

    Directory of Open Access Journals (Sweden)

    Adriano B. Siqueira


    Full Text Available Solid-state MBz compounds, where M stands for bivalent Mn, Fe, Co, Ni, Cu and Zn and Bz is benzoate, have been synthesized. Simultaneous thermogravimetry and differential thermal analysis (TG-DTA, differential scanning calorimetry (DSC, infrared spectroscopy and complexometry were used to characterize and to study the thermal behaviour of these compounds. The procedure used in the preparation of the compounds via reaction of basic carbonates with benzoic acid is not efficient in eliminating excess acid. However the TG-DTA curves permitted to verify that the binary compounds can be obtained by thermosynthesis, because the benzoic acid can be eliminated before the thermal decomposition of these compounds. The results led to information about the composition, dehydration, thermal stability, thermal decomposition and structure of the isolated compounds. On heating, these compounds decompose in two (Mn, Co, Ni, Zn or three (Fe, Cu steps with formation of the respective oxide (Mn3O4, Fe2O3, Co3O4, NiO, CuO and ZnO as final residue. The theoretical and experimental spectroscopic studies suggest a covalent bidentate bond between ligand and metallic center.

  3. The Effect of the Use of Technological Lubricants Based on Vegetable Oils on the Process of Titanium Sheet Metal Forming

    Directory of Open Access Journals (Sweden)

    Więckowski W.


    Full Text Available The paper evaluates the drawability of titanium sheet metal Grade 2, with the focus on friction conditions that are present in the sheet metal forming process. The study aims to present the results of the examinations of the friction coefficient during a strip drawing test. The focus of the experiment was on lubricants based on vegetable oils i.e. rapeseed oil, sunflower oil and olive oil. Boric acid was used to improve the lubricating properties of vegetable oils. The results of numerical simulations of the process of forming a cover with stiffening components made of grade 2 titanium sheet metal was also presented. The numerical simulation was carried out using the FEM method with PAMStamp 2G software. The effect of conditions of friction between the sheet metal and tool parts and pressure force of the blank holder on the forming process were investigated. Numerical calculations were performed with consideration for the phenomenon of material strain hardening and anisotropy of plastic properties of the sheet metal formed. The analysis of the deformations and reduction in wall thickness of the drawn parts can be used for determination of the effect of changes in selected parameters on the process of drawn part forming. The quality of drawn parts was assessed based on the shape inaccuracy determined during simulation of forming. The inaccuracy depended on the conditions of the process and strength properties of the titanium sheet metal.

  4. Ferroic properties in bi-component perovskites: artificial superlattices and naturally forming compounds

    International Nuclear Information System (INIS)

    Saha-Dasgupta, T


    The use of four different metal cations in a bi-component perovskite ABO 3 structure with 50 : 50 substitution at A sublattice as well as B sublattice, opens up the door for materials designing, with the aim to improve ferroic properties. This can be achieved following two different routes; one using the concept of artificially grown superlattices with alternating layers of ABO 3 and A′B′O 3 perovskites in a periodic set-up and another, through synthesis of naturally grown bulk double perovskites with ordered arrangement of A and A′ cations, simultaneously with that of B and B′ cations. The tremendous progress in layered deposition techniques as well as advances in solid state chemistry methods, has made both routes equally plausible and an area of much activity. This review summarizes some of the recent progress in this field, with a special emphasis on two computational studies, (i) one on ultra-thin 1–1 superlattices built out of paraelectric and ferroelectric components, showing tunable piezoelectric properties, and (ii) another on CrOs-based double perovskites which show multiferroic behavior, achieved through layered ordering of A and A′ cations. (topical review)

  5. Production method for making rare earth compounds (United States)

    McCallum, R. William; Ellis, Timothy W.; Dennis, Kevin W.; Hofer, Robert J.; Branagan, Daniel J.


    A method of making a rare earth compound, such as a earth-transition metal permanent magnet compound, without the need for producing rare earth metal as a process step, comprises carbothermically reacting a rare earth oxide to form a rare earth carbide and heating the rare earth carbide, a compound-forming reactant (e.g. a transition metal and optional boron), and a carbide-forming element (e.g. a refractory metal) that forms a carbide that is more thermodynamically favorable than the rare earth carbide whereby the rare earth compound (e.g. Nd.sub.2 Fe.sub.14 B or LaNi.sub.5) and a carbide of the carbide-forming element are formed.

  6. Studies in group IV organometallic chemistry XIII. Organometallic compounds with five metal atoms in neopentane configuration

    NARCIS (Netherlands)

    Willemsens, L.C.; Kerk, G.J.M. van der

    The preparation of stable, crystalline compounds of the type (Ph3M)4M′ is described. They are obtainable according to the following reaction equation: (Ph3M)4M′ The compounds with M′ = Pb are obtained as follows: Lead compounds are prepared most easily; (PhsGe)4M′ could not be obtained.

  7. A review of the high temperature oxidation of uranium oxides in molten salts and in the solid state to form alkali metal uranates, and their composition and properties (United States)

    Griffiths, Trevor R.; Volkovich, Vladimir A.

    An extensive review of the literature on the high temperature reactions (both in melts and in the solid state) of uranium oxides (UO 2, U 3O 8 and UO 3) resulting in the formation of insoluble alkali metal (Li to Cs) uranates is presented. Their uranate(VI) and uranate(V) compounds are examined, together with mixed and oxygen-deficient uranates. The reactions of uranium oxides with carbonates, oxides, per- and superoxides, chlorides, sulfates, nitrates and nitrites under both oxidising and non-oxidising conditions are critically examined and systematised, and the established compositions of a range of uranate(VI) and (V) compounds formed are discussed. Alkali metal uranates(VI) are examined in detail and their structural, physical, thermodynamic and spectroscopic properties considered. Chemical properties of alkali metal uranates(VI), including various methods for their reduction, are also reported. Errors in the current theoretical treatment of uranate(VI) spectra are identified and the need to develop routes for the preparation of single crystals is stressed.

  8. Effect of component substitution on the atomic dynamics in glass-forming binary metallic melts (United States)

    Nowak, B.; Holland-Moritz, D.; Yang, F.; Voigtmann, Th.; Evenson, Z.; Hansen, T. C.; Meyer, A.


    We investigate the substitution of early transition metals (Zr, Hf, and Nb) in Ni-based binary glass-forming metallic melts and the impact on structural and dynamical properties by using a combination of neutron scattering, electrostatic levitation (ESL), and isotopic substitution. The self-diffusion coefficients measured by quasielastic neutron scattering (QENS) identify a sluggish diffusion as well as an increased activation energy by almost a factor of 2 for Hf35Ni65 compared to Zr36Ni64 . This finding can be explained by the locally higher packing density of Hf atoms in Hf35Ni65 compared to Zr atoms in Zr36Ni64 , which has been derived from interatomic distances by analyzing the measured partial structure factors. Furthermore, QENS measurements of liquid Hf35Ni65 prepared with 60Ni , which has a vanishing incoherent scattering cross section, have demonstrated that self-diffusion of Hf is slowed down compared to the concentration weighted self-diffusion of Hf and Ni. This implies a dynamical decoupling between larger Hf and smaller Ni atoms, which can be related to a saturation effect of unequal atomic nearest-neighbor pairs, that was observed recently for Ni-rich compositions in Zr-Ni metallic melts. In order to establish a structure-dynamics relation, measured partial structure factors have been used as an input for mode-coupling theory (MCT) of the glass transition to calculate self-diffusion coefficients for the different atomic components. Remarkably, MCT can reproduce the increased activation energy for Hf35Ni65 as well as the dynamical decoupling between Hf and Ni atoms.

  9. Methods of acicular ferrite forming in the weld bead metal (Brief analysis

    Directory of Open Access Journals (Sweden)

    Володимир Олександрович Лебедєв


    Full Text Available A brief analysis of the methods of acicular ferrite formation as the most preferable structural component in the weld metal has been presented. The term «acicular ferrite» is meant as a structure that forms during pearlite and martensite transformation and austenite decomposition. Acicular ferrite is a packet structure consisting of battens of bainitic ferrite, there being no cementite particles inside these battens at all. The chemical elements most effectively influencing on the formation of acicular ferrite have been considered and their combined effect as well. It has been shown in particular, that the most effective chemical element in terms of impact toughness and cost relation is manganese. Besides, the results of multipass surfacing with impulse and constant feed of low-alloy steel wire electrode have been considered. According to these results acicular ferrite forms in both cases. However, at impulse feed of the electrode wire high mechanical properties of surfacing layer were got in the first passes, the form of the acicular ferrite crystallite has been improved and volume shares of polygonal and lamellar ferrite have been reduced. An assumption has been made, according to which acicular ferrite in the surfacing layer may be obtained through superposition of mechanical low-frequency oscillation on the welding torch or on the welding pool instead of periodic thermal effect due to electrode wire periodic feed

  10. Semi-solid metal forming of beryllium-reinforced aluminum alloys

    International Nuclear Information System (INIS)

    Haws, W.; Lane, L.; Marder, J.; Nicholas, N.


    A Powder Metallurgy (PM) based, Semi-Solid Metal (SSM) forming process has been developed to produce low cost near-net shapes of beryllium-reinforced aluminum alloys. Beryllium acts as a reinforcing additive to the aluminum, in which there is nearly no mutual solid solubility. The modulus of elasticity of the alloy dramatically increases, while the density and thermal expansion coefficient decrease with increasing beryllium content. The material is suitable for complex thermal management and vibration resistance applications, as well as for airborne components which are density and stiffness sensitive. The forming process involves heating a blank of the material to a temperature at which the aluminum is semi-solid and the beryllium is solid. The semi-solid blank is then injected without turbulence into a permanent mold. High quality, near net shape components can be produced which are functionally superior to those produced by other permanent mold processes. Dimensional accuracy is equivalent to or better than that obtained in high pressure die casting. Cost effectiveness is the primary advantage of this technique compared to other forming processes. The advantages and limitations of the process are described. Physical and mechanical property data are presented, as well as directions for future investigation

  11. Safe handling of potential peroxide forming compounds and their corresponding peroxide yielded derivatives.

    Energy Technology Data Exchange (ETDEWEB)

    Sears, Jeremiah Matthew; Boyle, Timothy J.; Dean, Christopher J.


    This report addresses recent developments concerning the identification and handling of potential peroxide forming (PPF) and peroxide yielded derivative (PYD) chemicals. PPF chemicals are described in terms of labeling, shelf lives, and safe handling requirements as required at SNL. The general peroxide chemistry concerning formation, prevention, and identification is cursorily presented to give some perspective to the generation of peroxides. The procedure for determining peroxide concentrations and the proper disposal methods established by the Hazardous Waste Handling Facility are also provided. Techniques such as neutralization and dilution are provided for the safe handling of any PYD chemicals to allow for safe handling. The appendices are a collection of all available SNL documentation pertaining to PPF/PYD chemicals to serve as a single reference.

  12. Off-Line Testing of Tribo-Systems for Sheet Metal Forming Production

    DEFF Research Database (Denmark)

    Bay, Niels; Ceron, Ermanno


    Off-line testing of new tribo-systems for sheet metal forming production is an important issue, when new, environmentally benign lubricants are to be introduced. To obtain useful results it is, however, vital to ensure similar conditions as in the production process regarding the main tribo......-parameters, which are tool/workpiece normal pressure, sliding length, sliding speed and interface contact temperature. The paper describes a generic methodology for such tests exemplified on an industrial, multistage deep drawing example, where deep drawing is followed by two successive re-drawing operations...... leading to very high tool/workpiece interface pressure and temperature in the second re-draw. Under such conditions only the best lubricant systems work satisfactory, and the paper shows how the performance of different tribo-systems in production may be predicted by off-line testing combined...

  13. Testing and Prediction of Limits of Lubrication in Sheet Metal Forming

    DEFF Research Database (Denmark)

    Ceron, Ermanno; Bay, Niels


    Increasing focus on environmental issues in industrial production has urged a number of sheet metal forming companies to look for new tribo-systems, here meaning the combination of tool_material/workpiece_material/lubricant, in order to substitute hazardous lubricants such as chlorinated paraffin...... oils. Testing of new tribo-systems under production conditions is, however, very costly. For preliminary testing it is more feasible to introduce laboratory tests. In this paper a new methodology for testing new tribo-systems is presented. The methodology describes a series of investigations combining...... laboratory and production tests as well as numerical analyses in order to evaluate and compare performance of the new tribo-systems. A part is selected from industrial production and analyzed by this methodology in order to substitute the existing tribo-system with a new one....

  14. Effect of continuum damage mechanics on spring back prediction in metal forming processes

    International Nuclear Information System (INIS)

    Nayebi, Ali; Shahabi, Mehdi


    The influence of considering the variations in material properties was investigated through continuum damage mechanics according to the Lemaitre isotropic unified damage law to predict the bending force and spring back in V-bending sheet metal forming processes, with emphasis on Finite element (FE) simulation considerations. The material constants of the damage model were calibrated through a uniaxial tensile test with an appropriate and convenient repeating strategy. Holloman’s isotropic and Ziegler’s linear kinematic hardening laws were employed to describe the behavior of a hardening material. To specify the ideal FE conditions for simulating spring back, the effect of the various numerical considerations during FE simulation was investigated and compared with the experimental outcome. Results indicate that considering continuum damage mechanics decreased the predicted bending force and improved the accuracy of spring back prediction.

  15. XPS characterization of the anodic oxide film formed on uranium metal in sodium hydroxide solution

    International Nuclear Information System (INIS)

    Fu Xiaoguo; Wang Xiaolin; Guo Huanjun; Wang Qingfu; Zhao Zhengping; Zhong Yongqiang


    X-ray photoelectron spectroscopy (XPS) is used to examine the anodic oxide film formed on uranium metal in 0.8 mol/L NaOH solution. The U4f 7/2 fitting spectra suggests that the anodic oxide film is composed of uranium trioxide and a small amount of UO 2+x . Under UHV condition, the U4f peak shifts to the lower binding energy, while a gradual increase in the intensity of U5f peak and the broad of U4f peak are also observed. All of these changes are due to reduction of uranium trioxide in the anodic oxide film. XPS quantitative analysis confirms the occurrence of reduction reaction

  16. Genetic toxicology of metal compounds. I. Induction of lambda prophage in E coli WP2/sub s/(lambda)

    Energy Technology Data Exchange (ETDEWEB)

    Rossman, T.G.; Molina, M.; Meyer, L.W.


    A number of metal compounds have been shown to be human carcinogens. Others, while not proven human carcinogens, are able to cause tumors in laboratory animals. Short-term bacterial assays for genotoxic effects have not been successful in predicting the carcinogenicity of metal compounds. The authors report here the ability of some metal compounds to cause the induction of lambda prophage in E coli WP2/sub s/(lambda). By far the strongest inducing ability was observed with K/sub 2/CrO/sub 4/, followed by Pb(NO/sub 3/)/sub 2/ > Ni(OOCCH/sub 3/)/sub 2/ > CrCl/sub 2/ > NaWO/sub 4/ > Na/sub 2/MoO/sub 4/ > KMnO/sub 4/. With the exception of chromate, long-term exposures in a narrow, subtoxic dose range were required in order to demonstrate phage induction. A new microtiter assay for lambda prophage induction, which incorporates these features, is described. This system also was able to detect very small amounts of organic carcinogens.

  17. New pathway for the formation of metallic cubic phase Ge-Sb-Te compounds induced by an electric current. (United States)

    Park, Yong-Jin; Cho, Ju-Young; Jeong, Min-Woo; Na, Sekwon; Joo, Young-Chang


    The novel discovery of a current-induced transition from insulator to metal in the crystalline phase of Ge2Sb2Te5 and GeSb4Te7 have been studied by means of a model using line-patterned samples. The resistivity of cubic phase Ge-Sb-Te compound was reduced by an electrical current (~1 MA/cm(2)), and the final resistivity was determined based on the stress current density, regardless of the initial resistivity and temperature, which indicates that the conductivity of Ge-Sb-Te compound can be modulated by an electrical current. The minimum resistivity of Ge-Sb-Te materials can be achieved at high kinetic rates by applying an electrical current, and the material properties change from insulating to metallic behavior without a phase transition. The current-induced metal transition is more effective in GeSb4Te7 than Ge2Sb2Te5, which depends on the intrinsic vacancy of materials. Electromigration, which is the migration of atoms induced by a momentum transfer from charge carriers, can easily promote the rearrangement of vacancies in the cubic phase of Ge-Sb-Te compound. This behavior differs significantly from thermal annealing, which accompanies a phase transition to the hexagonal phase. This result suggests a new pathway for modulating the electrical conductivity and material properties of chalcogenide materials by applying an electrical current.

  18. Interfacial Microstructure Formed by Reactive Metal Penetration of Al into Mullite

    International Nuclear Information System (INIS)

    Du, T.B.; Ewsuk, K.G.; Fahrenholtz, W.G.; Loehman, R.E.; Lu, P.


    Microstructure in the reaction interface between molten Al and dense mullite have been studied by transmission electron microscopy to provide insight into mechanisms for forming ceramic-metal composites by reactive metal penetration. The reactions, which have the overall stoichiometry, 3Al number sign iz01 + (8+ x)A1 + 13 AlzO + xA1 + 6Si, were carried out at temperatures of 900, 1100, and 1200oC for 5 minutes and 60 minutes, and 1400oC for 15 minutes. Observed phases generally were those given in the above reaction, although their proportions and interracial rnicrostructures differed strongly with reaction temperature. After reaction at 900oC, a thin Al layer separated unreacted mullite from the cx-AlzO and Al reaction products. No Si phase was found near the reaction front. After 5 minutes at 1100''C, the nxtction front contained Si, ct-A120, and an aluminum oxide phase with a high concentration of Si. After 60 minutes at 11O(YC many of the cx-A120g particles were needle-shaped with a preferred orientation. After reaction at 1200oC, the reaction front contained a high density of Si particles that formed a continuous layer over many of the mullite grains. The sample reacted at 140VC for 15 minutes had a dense ct-A120J reaction layer less than 2m thick. Some isolated Si particles were present between the a-AlzO layer and the unreacted mullite. Using previously measured reaction kinetics data, the observed temperature dependence of the interracial microstructure have been modeled as three sequential steps, each one of which is rate-limiting in a different temperature range

  19. Investigation of spin-gapless semiconductivity and half-metallicity in Ti2MnAl-based compounds

    International Nuclear Information System (INIS)

    Lukashev, P.; Staten, B.; Hurley, N.; Kharel, P.; Gilbert, S.; Fuglsby, R.; Huh, Y.; Valloppilly, S.; Zhang, W.; Skomski, R.; Sellmyer, D. J.; Yang, K.


    The increasing interest in spin-based electronics has led to a vigorous search for new materials that can provide a high degree of spin polarization in electron transport. An ideal candidate would act as an insulator for one spin channel and a conductor or semiconductor for the opposite spin channel, corresponding to the respective cases of half-metallicity and spin-gapless semiconductivity. Our first-principle electronic-structure calculations indicate that the metallic Heusler compound Ti 2 MnAl becomes half-metallic and spin-gapless semiconducting if half of the Al atoms are replaced by Sn and In, respectively. These electronic structures are associated with structural transitions from the regular cubic Heusler structure to the inverted cubic Heusler structure.

  20. Synthesis and characterization of homo- and hetero-metallic coordination compounds and oxide nanostructures (United States)

    Hofmann, Cristina

    This dissertation combines coordination and materials chemistry studies. The oxide materials and nanoparticles formed are produced from decomposition of known or brand new coordination compounds. Chapters I and II discuss the synthesis, characterization, and functionalization of shaped nanoparticles. Fe(II)(O2CH)2 and Mn(II)(O 2CH)2 were used as precursors for the controlled synthesis of wustite (FexO), manganosite (MnO), and iron-manganese (Fe 1-yMnyO) nanocrystals with non-thermodynamic shapes, such as concave cubes, nanocrosses, and 'dogbones'. An acid-base surfactant system under thermal conditions and atmospheric pressure was employed. The nanoparticle morphology was studied as a function of reaction parameters, of which water and surfactants were found most critical for shape control. Shaping progress is described as a function of crystal defects and dissolution-precipitation processes. Nanoparticles were successfully oxidized to the magnetic phases, Fe3O4 (magnetite) and Mn3O4 (hausmannite), while retaining original shape. Iron oxide-gold and manganese oxide-gold nanoshells were produced, and these maintained the magnetic behavior of magnetite and hausmannite, as demonstrated by magnetic measurements.

  1. Discovery of a Novel Dibromoquinoline Compound Exhibiting Potent Antifungal and Antivirulence Activity That Targets Metal Ion Homeostasis. (United States)

    Mohammad, Haroon; Elghazawy, Nehal H; Eldesouky, Hassan E; Hegazy, Youssef A; Younis, Waleed; Avrimova, Larisa; Hazbun, Tony; Arafa, Reem K; Seleem, Mohamed N


    Globally, invasive fungal infections pose a significant challenge to modern human medicine due to the limited number of antifungal drugs and the rise in resistance to current antifungal agents. A vast majority of invasive fungal infections are caused by species of Candida, Cryptococcus, and Aspergillus. Novel antifungal molecules consisting of unexploited chemical scaffolds with a unique mechanism are a pressing need. The present study identifies a dibromoquinoline compound (4b) with broad-spectrum antifungal activity that inhibits the growth of pertinent species of Candida (chiefly C. albicans), Cryptococcus, and Aspergillus at a concentration of as low as 0.5 μg/mL. Furthermore, 4b, at a subinhibitory concentration, interfered with the expression of two key virulence factors (hyphae and biofilm formation) involved in C. albicans pathogenesis. Three yeast deletion strains ( cox17Δ, ssa1Δ, and aft2Δ) related to metal ion homeostasis were found to be highly sensitive to 4b in growth assays, indicating that the compound exerts its antifungal effect through a unique, previously unexploited mechanism. Supplementing the media with either copper or iron ions reversed the strain sensitivity to 4b, further corroborating that the compound targets metal ion homeostasis. 4b's potent antifungal activity was validated in vivo, as the compound enhanced the survival of Caenorhabditis elegans infected with fluconazole-resistant C. albicans. The present study indicates that 4b warrants further investigation as a novel antifungal agent.

  2. Metal-impregnated carbon applied as adsorbent for removal of sulphur compounds using fixed-bed column technology. (United States)

    Martins, A V P R; Ramos, J E T; Coelho, J A; Vidal, C B; Cavalcante, C L; Azevedo, D C S


    Metal-impregnated carbons (Cu--AC; Ag--AC and Pd--AC) were studied as adsorbents for the desulphurization of liquid fuels. A real gasoline was examined for sulphur compounds. Textural characteristics of adsorbents were determined by nitrogen adsorption/desorption isotherms at 77 K. The adsorption isotherms were obtained by frontal analysis in a single fixed bed at 30 degrees C and 45 degrees C. Breakthrough curves were simulated according to a mathematical model that assumed axially dispersed flow and mass transfer described by a linear driving force approximation and nonlinear adsorption equilibrium reached instantaneously on the external surface of the adsorbents particles. The model was solved numerically by orthogonal collocation in finite elements, using the commercial solver gPROMS. The proposed model matched experimental data reasonably well. Resistance to mass transfer was significant and thought to be due to intraparticle diffusion kinetics. The results confirmed the efficiency of the use of activated carbon (AC) in the adsorption of sulphur compounds, especially when its surface is modified with metals. Comparing adsorption capacities of sulphur compounds from real gasoline, AC-Pd material appeared more selective than other materials, even presenting a behaviour of rapid saturation explained by the presence of other components competing for adsorption sites, reducing their effectiveness in removing sulphur compounds. Both pristine AC and Pd--AC showed good regenerability. The regenerated Pd--AC sorbent can recover about 85% of the desulphurization capacity.

  3. High-Resolution p-Type Metal Oxide Semiconductor Nanowire Array as an Ultrasensitive Sensor for Volatile Organic Compounds. (United States)

    Cho, Soo-Yeon; Yoo, Hae-Wook; Kim, Ju Ye; Jung, Woo-Bin; Jin, Ming Liang; Kim, Jong-Seon; Jeon, Hwan-Jin; Jung, Hee-Tae


    The development of high-performance volatile organic compound (VOC) sensor based on a p-type metal oxide semiconductor (MOS) is one of the important topics in gas sensor research because of its unique sensing characteristics, namely, rapid recovery kinetics, low temperature dependence, high humidity or thermal stability, and high potential for p-n junction applications. Despite intensive efforts made in this area, the applications of such sensors are hindered because of drawbacks related to the low sensitivity and slow response or long recovery time of p-type MOSs. In this study, the VOC sensing performance of a p-type MOS was significantly enhanced by forming a patterned p-type polycrystalline MOS with an ultrathin, high-aspect-ratio (∼25) structure (∼14 nm thickness) composed of ultrasmall grains (∼5 nm size). A high-resolution polycrystalline p-type MOS nanowire array with a grain size of ∼5 nm was fabricated by secondary sputtering via Ar(+) bombardment. Various p-type nanowire arrays of CuO, NiO, and Cr2O3 were easily fabricated by simply changing the sputtering material. The VOC sensor thus fabricated exhibited higher sensitivity (ΔR/Ra = 30 at 1 ppm hexane using NiO channels), as well as faster response or shorter recovery time (∼30 s) than that of previously reported p-type MOS sensors. This result is attributed to the high resolution and small grain size of p-type MOSs, which lead to overlap of fully charged zones; as a result, electrical properties are predominantly determined by surface states. Our new approach may be used as a route for producing high-resolution MOSs with particle sizes of ∼5 nm within a highly ordered, tall nanowire array structure.

  4. Clathrate Hydrates for Thermal Energy Storage in Buildings: Overview of Proper Hydrate-Forming Compounds

    Directory of Open Access Journals (Sweden)

    Beatrice Castellani


    Full Text Available Increasing energy costs are at the origin of the great progress in the field of phase change materials (PCMs. The present work aims at studying the application of clathrate hydrates as PCMs in buildings. Clathrate hydrates are crystalline structures in which guest molecules are enclosed in the crystal lattice of water molecules. Clathrate hydrates can form also at ambient pressure and present a high latent heat, and for this reason, they are good candidates for being used as PCMs. The parameter that makes a PCM suitable to be used in buildings is, first of all, a melting temperature at about 25 °C. The paper provides an overview of groups of clathrate hydrates, whose physical and chemical characteristics could meet the requirements needed for their application in buildings. Simulations with a dynamic building simulation tool are carried out to evaluate the performance of clathrate hydrates in enhancing thermal comfort through the moderation of summer temperature swings and, therefore, in reducing energy consumption. Simulations suggest that clathrate hydrates have a potential in terms of improvement of indoor thermal comfort and a reduction of energy consumption for cooling. Cooling effects of 0.5 °C and reduced overheating hours of up to 1.1% are predicted.

  5. Potential for energy conservaton in the metal forming industries. Progress report, July 1, 1978-August 15, 1979

    Energy Technology Data Exchange (ETDEWEB)

    Avitzur, B.; Beidleman, C.R.; Smackey, B.M.


    Reduced energy consumption and improved product attributes are realizable benefits that are achievable through the adoption of optimal metal forming techniques. With the meteoric rise in energy costs, certain segments of the metal forming industries have accelerated their efforts in switching from energy intensive manufacturing techniques, e.g., casting, to metal forming, and, furthermore, from hot forming and machined components to cold forming, notably the automotive industry. The first year results of a two year study that will identify and document potential energy and cost savings associated with the adoption of low energy consumption techniques are presented. When compared with techniques requiring energy for hot forming, heat treatments, and excess or scrap material, the utilizaton of alternative metal forming processes offer considerable promise for energy savings. Descriptions of savings achieved by a combination of analytical methods and imaginative new processes are provided in the form of specific industrial case studies. The elimination of defects through the use of an analytical criteria for the prevention of the central burst is presented. Such available criteria for central burst serve as a justification for the desirability to develop criteria for the prevention of fishskin and other defects. Other savings which may be possible through the development of new technologies are included in an Appendix entitled: Recent Developments in Wire Making. One specific new process, Continuous Hydrostatic Extrusion, has been developed at Western Electric and is described in detail.

  6. Methods of forming boron nitride (United States)

    Trowbridge, Tammy L; Wertsching, Alan K; Pinhero, Patrick J; Crandall, David L


    A method of forming a boron nitride. The method comprises contacting a metal article with a monomeric boron-nitrogen compound and converting the monomeric boron-nitrogen compound to a boron nitride. The boron nitride is formed on the same or a different metal article. The monomeric boron-nitrogen compound is borazine, cycloborazane, trimethylcycloborazane, polyborazylene, B-vinylborazine, poly(B-vinylborazine), or combinations thereof. The monomeric boron-nitrogen compound is polymerized to form the boron nitride by exposure to a temperature greater than approximately C. The boron nitride is amorphous boron nitride, hexagonal boron nitride, rhombohedral boron nitride, turbostratic boron nitride, wurzite boron nitride, combinations thereof, or boron nitride and carbon. A method of conditioning a ballistic weapon and a metal article coated with the monomeric boron-nitrogen compound are also disclosed.

  7. Iron-Targeting Antitumor Activity of Gallium Compounds and Novel Insights Into Triapine®-Metal Complexes (United States)

    Antholine, William E.


    Abstract Significance: Despite advances made in the treatment of cancer, a significant number of patients succumb to this disease every year. Hence, there is a great need to develop new anticancer agents. Recent Advances: Emerging data show that malignant cells have a greater requirement for iron than normal cells do and that proteins involved in iron import, export, and storage may be altered in cancer cells. Therefore, strategies to perturb these iron-dependent steps in malignant cells hold promise for the treatment of cancer. Recent studies show that gallium compounds and metal-thiosemicarbazone complexes inhibit tumor cell growth by targeting iron homeostasis, including iron-dependent ribonucleotide reductase. Chemical similarities of gallium(III) with iron(III) enable the former to mimic the latter and interpose itself in critical iron-dependent steps in cellular proliferation. Newer gallium compounds have emerged with additional mechanisms of action. In clinical trials, the first-generation-compound gallium nitrate has exhibited activity against bladder cancer and non-Hodgkin's lymphoma, while the thiosemicarbazone Triapine® has demonstrated activity against other tumors. Critical Issues: Novel gallium compounds with greater cytotoxicity and a broader spectrum of antineoplastic activity than gallium nitrate should continue to be developed. Future Directions: The antineoplastic activity and toxicity of the existing novel gallium compounds and thiosemicarbazone-metal complexes should be tested in animal tumor models and advanced to Phase I and II clinical trials. Future research should identify biologic markers that predict tumor sensitivity to gallium compounds. This will help direct gallium-based therapy to cancer patients who are most likely to benefit from it. Antioxid. Redox Signal. 00, 000–000. PMID:22900955

  8. Structure of the Mesophases Formed by a Perfluoroalkyl/Biphenyl Compound. Amphiphilic and Steric Effects (United States)

    Pensec, Sandrine; Tournilhac, François-Genès; Bassoul, Pierre


    We describe the synthesis and mesomorphic behaviour of 4-(1H,1H-perfluorooctyloxy)- 4'-methoxy biphenyl. Two mesophases of smectic E and smectic A types were observed. X-ray diffraction study of the smectic E phase indicates a herringbone arrangement of the biphenyl cores, the perfluoroalkyl chains being in a molten state. The {S_E to S_A} transition is related to the melting of the biphenyl sublattice. In both phases, the flexibility of perfluoroalkyl chains permits the area matching between the two segregated sublayers. Nous décrivons la synthèse et les propriétés mésomorphes du 4-(1H,1H-perfluorooctyloxy)- 4'-méthoxy biphényle. Ce composé forme deux mésophases de type smectique E et smectique A. L'analyse par diffraction des rayons X révèle, dans le cas de la phase smectique E un arrangement en chevrons des coeurs biphényles, les chaînes perfluoroalkyles se trouvant dans un état désordonné. La transition {S_E to S_A} correspond à la fusion partielle de la sous-couche biphényle. Dans les deux phases smectiques, la flexibilité des chaînes perfluoroalkyles permet l'adéquation des aires moléculaires entre les deux sous-couches ségrégées.

  9. Vacuum tight sodium resistant compound between ThO2 ceramic and metal

    International Nuclear Information System (INIS)

    Reetz, T.

    A method for evaluating the mechanical tensions for metal/ ceramic joinings was applied to the selection of metal components for a highly vacuum tight, sodium-resistant metal/ThO 2 ceramic solder joining. The metal component selected was the iron--nickel alloy Dilasil which is joined to the ceramic using a nickel-based solder. The wetting of the cearamic could be carried out using the titanium hydride technique or after the formation of a W-cerium layer on the surface of this ceramic. (U.S.)

  10. The synthesis and structure of new transition metal lithium calcium nitride compounds

    Energy Technology Data Exchange (ETDEWEB)

    Hunting, Janet L., E-mail: [Department of Chemistry, Cornell University, Baker Laboratory, Ithaca, New York 14853 (United States); Department of Chemistry, Ithaca College, 953 Danby Road, Ithaca, New York 14850 (United States); Szymanski, Marta M. [Department of Chemistry, Cornell University, Baker Laboratory, Ithaca, New York 14853 (United States); Kowalsick, Amanda L. [Department of Chemistry, Ithaca College, 953 Danby Road, Ithaca, New York 14850 (United States); Downie, Craig M.; DiSalvo, Francis J. [Department of Chemistry, Cornell University, Baker Laboratory, Ithaca, New York 14853 (United States)


    Three new nitrides, Li{sub 3}Ca{sub 2}V{sub 0.79}Nb{sub 0.21}N{sub 4}, Li{sub 2}Ca{sub 2.67}Nb{sub 0.33}N{sub 3} and Li{sub 12}Ca{sub 9}W{sub 5}N{sub 20}, were synthesized in sealed niobium tubes using lithium nitride as a flux at temperatures ranging from 800 Degree-Sign C to 1050 Degree-Sign C. In all of these compounds, the transition metals are coordinated tetrahedrally by nitrogen; these tetrahedra are isolated from each other. Bullet Li{sub 3}Ca{sub 2}V{sub 0.79}Nb{sub 0.21}N{sub 4}, space group P2{sub 1}/m (no. 11), cell parameters a=5.7669(8) A, b=6.9123(9) A, c=6.0116(12) A, {beta}=90.727(9) Degree-Sign , Z=2, has a shared vanadium/niobium tetrahedral position which shares vertices with the tetrahedrally-coordinated lithium position. Bullet Li{sub 2}Ca{sub 2.67}Nb{sub 0.33}N{sub 3}, space group Req /o(3, Macron )m (no. 166), cell parameters a=3.6311(2) A, c=29.459(3) A, Z=3, contains a disordered tetrahedral calcium/niobium position, an octahedral calcium position and a triangularly coordinated lithium position. Bullet Li{sub 12}Ca{sub 9}W{sub 5}N{sub 20}, space group C2/c (no. 15), cell parameters a=27.7347(19) A, b=8.6652(6) A, c=10.7685(7) A, {beta}=110.314(2) Degree-Sign , Z=4, contains three crystallographically different tungsten positions as well as one disordered lithium position. - Graphical abstract: Crystal structure of Li{sub 3}Ca{sub 2}V{sub 0.79}Nb{sub 0.21}N{sub 4} depicting the chains of edge-sharing LiN{sub 4} (light hatching) and (V/Nb)N{sub 4} (dark hatching) tetrahedra viewed approximately along the [100] direction. Calcium atoms are shown as open circles and nitrogen atoms are colored black. Highlights: Black-Right-Pointing-Pointer Three new lithium calcium nitrides are synthesized. Black-Right-Pointing-Pointer Lithium nitride flux used in synthesis. Black-Right-Pointing-Pointer Structures contain isolated tetrahedrally coordinated transition metals. Black-Right-Pointing-Pointer Li{sub 12}Ca{sub 9}W{sub 5}N{sub 20} contains three

  11. Performance of TD-DFT for Excited States of Open-Shell Transition Metal Compounds. (United States)

    Suo, Bingbing; Shen, Kaiyuan; Li, Zhendong; Liu, Wenjian


    Time-dependent density functional theory (TD-DFT) has been very successful in accessing low-lying excited states of closed-shell systems. However, it is much less so for excited states of open-shell systems: unrestricted Kohn-Sham based TD-DFT (U-TD-DFT) often produces physically meaningless excited states due to heavy spin contaminations, whereas restricted Kohn-Sham based TD-DFT often misses those states of lower energies. A much better variant is the explicitly spin-adapted TD-DFT (X-TD-DFT) [J. Chem. Phys. 2011, 135, 194106] that can capture all the spin-adapted singly excited states yet without computational overhead over U-TD-DFT. While the superiority of X-TD-DFT over U-TD-DFT has been demonstrated for open-shell systems of main group elements, it remains to be seen if this is also the case for open-shell transition metal compounds. Taking as benchmark the results by MS-CASPT2 (multistate complete active space second-order perturbation theory) and ic-MRCISD (internally contracted multireference configuration interaction with singles and doubles), it is shown that X-TD-DFT is indeed superior to U-TD-DFT for the vertical excitation energies of ZnH, CdH, ScH 2 , YH 2 , YO, and NbO 2 . Admittedly, there exist a few cases where U-TD-DFT appears to be better than X-TD-DFT. However, this is due to a wrong reason: the underestimation (due to spin contamination) and the overestimation (due to either the exchange-correlation functional itself or the adiabatic approximation to the exchange-correlation kernel) happen to be compensated in the case of U-TD-DFT. As for [Cu(C 6 H 6 ) 2 ] 2+ , which goes beyond the capability of both MS-CASPT2 and ic-MRCISD, X-TD-DFT revises the U-TD-DFT assignment of the experimental spectrum.

  12. SOA Formation form the NO3 radicals Chemistry of Isoprene, Monoterpenes, Sesquiterpenes, Biogenic Oxygenated Compounds, and Aromatics (United States)

    Kleindienst, T. E.; Jaoui, M.; Docherty, K.; Corse, E.; Offenberg, J. H.; Lewandowski, M.


    Volatile organic compounds (VOCs) are oxidized in the atmosphere primarily by hydroxyl radicals (OH) during daylight hours but also by nitrate radicals (NO3) during overnight, photochemically inactive periods. While reactions with OH have received considerable attention with regard to gas-phase reaction products and secondary organic aerosol (SOA) formation, less is known about the mechanisms and products resulting from nighttime NO3 reactions despite their potential for SOA formation. To date, there have been limited studies on the chemical characteristics of aerosol reaction products formed from VOCs oxidation with NO3, and few SOA reaction products have been identified. Nighttime reactions have nevertheless been incorporated into some air quality models despite the limited information available and substantial uncertainties which still exist. The National Exposure Research Laboratory of the U.S. Environmental Protection Agency recently undertook an integrated laboratory research effort to better understand the contribution of NO3 reactions to nighttime SOA formation. Isoprene, methacrolein, a-pinene, b-pinene, d-limonene, b-caryophyllene, farnesene, a-humulene, 2-methyl-3-buten-2-ol, toluene, m-xylene, and naphthalene were reacted with NO3 under a wide range of conditions in a series of separate photochemical reaction chamber experiments. These hydrocarbons are thought to contribute to ambient SOA formation. NO3 was formed through thermal decomposition of N2O5. The yield, physical characteristics, and composition of SOA formed in each experiment was analyzed by a suite of instruments including a scanning mobility particle sizer, a Sunset Labs semi continuous EC-OC monitor, a volatility differential mobility analyzer, a direct insertion probe-mass spectrometer, a high resolution time-of-flight aerosol mass spectrometer, and a gas-chromatography-mass spectrometer. To understand the relative contributions of nighttime versus daytime VOCs reactions, a similar

  13. First-principles study of new quaternary Heusler compounds without 3d transition metal elements: ZrRhHfZ (Z = Al, Ga, In)

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Xiaotian [School of Material Sciences and Engineering, Hebei University of Technology, Tianjin 300130 (China); Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Cheng, Zhenxiang, E-mail: [Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Guo, Ruikang [School of Material Sciences and Engineering, Hebei University of Technology, Tianjin 300130 (China); Wang, Jianli [Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Rozale, Habib [Condensed Matter and Sustainable Development Laboratory, Physics Department, University of Sidi-Bel-Abbès, 22000 Sidi-Bel-Abbès (Algeria); Wang, Liying [Department of Physics, Tianjin University, Tianjin 300350 (China); Yu, Zheyin [Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Liu, Guodong, E-mail: [School of Material Sciences and Engineering, Hebei University of Technology, Tianjin 300130 (China)


    Plane-wave pseudo-potential methods based on density functional theory are employed to investigate the electronic structures, and the magnetic and half-metallic properties of the newly designed quaternary Heusler compounds ZrRhHfZ (Z = Al, Ga, In) without 3d transition metal elements. The calculated results show that ZrRhHfZ (Z = Al, Ga, In) compounds are half-metallic, with 100% spin polarization around the Fermi level. The structural stability of these compounds has been tested from the aspects of their cohesion energy and formation. The spin-flip/half-metallic gaps of ZrRhHfZ (Z = Al, Ga, In) compounds are quite large, with values of 0.2548 eV, 0.3483 eV, and 0.2866 eV, respectively. These compounds show Slater-Pauling behavior, and the total spin magnetic moment per unit cell (M{sub t}) scales with the total number of valence electrons (Z{sub t}) following the rule: M{sub t} = Z{sub t} - 18. The magnetization of ZrRhHfZ (Z = Al, Ga, In) compounds mainly comes from the 4d electrons of the Zr atoms and the 5d electrons of the Hf atoms. Furthermore, the effects of uniform strain and tetragonal deformation on the half metallicity has been investigated in detail, which is important for practical application. Finally, we reveal that the half-metallicity can be maintained when the Coulomb interactions are considered. - Highlights: • New quaternary compounds without 3d transition metal elements have been designed. • The electronic structures and magnetism of the ZrRhHfZ compounds have been studied. • The effect of strain on the half-metallic behavior has been tested. • The effect of the Coulomb interactions on the half-metallicity has been investigated.

  14. Spectrophotometric Study of Ternary Complex Forming Systems of Some Lanthanide Metal Ions with Eriochrome Cyanine R in Presence of Cetylpyridinium Bromide for Microdetermination

    Directory of Open Access Journals (Sweden)

    A. S. Dhepe


    Full Text Available Study of coordination compounds of lanthanide elements has received a great attention due to growing applications in science and technology. Number of chromogenic reagents form water soluble colored complexes with lanthanides. Eriochrome cyanine R (ECR a member of triphenylmethane type of dye has been reported to form green colored complexes with lanthanides and has been used for microdetermination of these metal ions. Addition of cationic surfactant, Cetylpyridinium bromide (CPB, a cationic surfactant sensitizes the color reactions of Gd(III, Tb(III, Dy(III, Ho(III and Lu(III with ECR. Formation of water soluble, highly colored ternary complexes with a considerable bathochromic shift of about 50 nm in presence of surfactant has been observed. Optimum reaction conditions and other analytical parameters were also evaluated. Stoichiometric ratio 1:3:3 of Ln: ECR: CPB are responsible for the observed rise in molar absorptivity and sensitivity. Beer’s law was obeyed between 0.50 to 13.00 ppm. Effective photometric range and molar absorptivity of these ternary complexes have been calculated. Effect of some common interfering ions on determination of these lanthanide metal ions was studied. A simple, rapid and highly sensitive spectrophotometeric method has been proposed for the determination of metal ions understudy.

  15. The mass-metallicity relations for gas and stars in star-forming galaxies: strong outflow versus variable IMF (United States)

    Lian, Jianhui; Thomas, Daniel; Maraston, Claudia; Goddard, Daniel; Comparat, Johan; Gonzalez-Perez, Violeta; Ventura, Paolo


    We investigate the mass-metallicity relations for the gaseous (MZRgas) and stellar components (MZRstar) of local star-forming galaxies based on a representative sample from Sloan Digital Sky Survey Data Release 12. The mass-weighted average stellar metallicities are systematically lower than the gas metallicities. This difference in metallicity increases towards galaxies with lower masses and reaches 0.4-0.8 dex at 109 M⊙ (depending on the gas metallicity calibration). As a result, the MZRstar is much steeper than the MZRgas. The much lower metallicities in stars compared to the gas in low-mass galaxies imply dramatic metallicity evolution with suppressed metal enrichment at early times. The aim of this paper is to explain the observed large difference in gas and stellar metallicity and to infer the origin of the mass-metallicity relations. To this end we develop a galactic chemical evolution model accounting for star formation, gas inflow and outflow. By combining the observed mass-metallicity relation for both gas and stellar components to constrain the models, we find that only two scenarios are able to reproduce the observations. Either strong metal outflow or a steep initial mass function (IMF) slope at early epochs of galaxy evolution is needed. Based on these two scenarios, for the first time we successfully reproduce the observed MZRgas and MZRstar simultaneously, together with other independent observational constraints in the local Universe. Our model also naturally reproduces the flattening of the MZRgas at the high-mass end leaving the MZRstar intact, as seen in observational data.

  16. Gold nanoparticles modified with coordination compounds of metals: synthesis and application

    International Nuclear Information System (INIS)

    Beloglazkina, Elena K; Majouga, Alexander G; Romashkina, Renata B; Zyk, Nikolai V; Zefirov, Nikolai S


    The data on the preparation methods and applications of gold nanoparticles with coordinated metal ions on the surfaces are generalized. The currently available data on the interaction of metal ions with gold nanoparticles modified with organic (particularly, sulfur-containing) ligands comprising terminal chelating groups are considered in detail as well as the applications of such modified nanoparticles. The bibliography includes 141 references.

  17. An investigation of the primary species formed in pulse irradiated nitro-aromatic compounds in aqueous solution

    International Nuclear Information System (INIS)

    Van der Linde, H.J.; Schulte-Frohlinde, D.; Schworer, F.


    The ring-structured compounds containing nitrogen are of considerable importance in radiation chemistry and radiation biology, inasmuch as they form the basis of many nucleic acids, proteins and other biological molecules. The pulse radiolysis of aqueous solutions of nitrobenzene, nitrophenol and nitroaniline was investigated in order to obtain more information of the primary processes which occur in these systems. By making use of various scavengers, and by changing the pH of the solutions, it was possible to study the reactions of electrons, hydrogen atoms and hydroxyl radicals with the compounds mentioned. The spectra were analysed kinetically, and reaction-rate constants were determined for the formation and decay of the intermediates. The in situ radiolysis and photolysis ESR techniques were used in an effort to detect the primarily formed intermediates. With the possible exception of nitrobenzene, no cyclohexadienyl-type radical was observed, but it was found that semiquinone radicals are formed in nitrobenzene in the presence of hydrogen peroxide. A reaction scheme to explain this finding is proposed. The formation of HNO 2 was studied by means of the electrical-conductivity method. It was found that the group NO 2 -group is eliminated not only in the case of nitrophenol, but also in the cases of nitrobenzene and nitroaniline. The reaction-rate constants for the NO 2 -elimination step was determined in the various cases and, by making use of the mobilities of the different ions, the HNO 2 yield was calculated. The values obtained were in good agreement with results obtained by determining the yield of the NO 2 -ion by means of an analytical method [af

  18. Resistance of full veneer metal crowns with different forms of axial grooves (United States)

    Hidayat, A. S.; Masulili, C.; Indrasari, M.


    Dental crowns or bridges can occasionally come loose or separate from the tooth during chewing, particularly when they are situated on small, short, and conical teeth. The main cause of this separation is a lack of retention and resistance to the tooth. There are several methods available to increase the retention and resistance of the crown during both inlay and onlay preparation, including parallelism, groove preparation, crown build-up, and surface roughness. The aim of this study was to determine the differences in resistance of full veneer metal crowns with various forms of groove preparation. The study involved the compressive strength testing of a total of 24 specimens, namely six specimens without groove preparation, six specimens with box-shaped grooves, six specimens with V-shaped grooves, and six specimens with half round grooves. The mean values of the metal crowns that separated from the teeth during testing were 27.97 ± 1.08 kgF for the crowns with box-shaped grooves, 6.15 ± 0.22 kgF for those with V-shaped grooves, 1.77 ± 0.12 kgF for those with half round grooves, and 0.95 ± 0.13 kgF for those without grooves. This study found that the resistance is best in crowns with box-shaped grooves, followed by those with V-shaped grooves, half round grooves, and those without groove. When clinicians are working on short and conical molar teeth, it is therefore recommended that box-shaped grooves are used to increase the resistance of the crown.

  19. Issues in the validation of CFD modelling of semi-solid metal forming

    International Nuclear Information System (INIS)

    Ward, P.J.; Atkinson, H.V.; Kirkwood, D.H.; Liu, T.Y.; Chin, S.B.


    Modelling of die filling during semi-solid metal processing (thixoforming) places particular demands on the CFD package being used. Not only are the velocities of the metal slurry in the die very high, the viscosity is too. Furthermore, the viscosity changes with shear rate (i.e. with changes in cross sectional area of the region the slurry travels through) and with time, as the injected material is thixotropic. The CFD software therefore requires good free surface tracking, accurate implicit solutions of the flow equations (as the CPU times for explicit solutions at high viscosities are impractical) and a model that adequately describes the slurry thixotropy. Finally, reliable, experimentally determined viscosity data are required. This paper describes the experiments on tin-lead and aluminium alloy slurries using compressive tests and rotating cylinder viscometry, followed by modelling using FLOW-3D. This package is known for its ability to track free surfaces accurately. Compressive tests allow rapid changes in shear rate to be imparted to the slurry, without wall slip, while the simple geometry of the viscometer makes it possible to compare analytical and numerical solutions. It is shown that the implicit viscous solver in its original form can reproduce the general trends found in the compressive and viscometry tests. However, sharp changes in shear rate lead to overestimation of pressure gradients in the slurry, making it difficult to separate these effects from those due to thixotropic breakdown. In order to achieve this separation, it is necessary to implement a more accurate implicit solver, which is currently under development. (author)

  20. Content and the forms of heavy metals in bottom sediments in the zone of industrial pollution sources ,


    Voytyuk Y.Y.; Kurayeva I.V.; Kroyik H.A.; Karmazynenko S.P.; Matsibora O.V.


    Regularities in the distribution of heavy metals in sediments in the zone of influence of the steel industry in Mariupol are installed. The study results of the forms of occurrence of Zn, Pb, Cu, Cr, Ni are represented. Ecological and geochemical assessment of sediment contamination by heavy metals is performed. The main sources of pollution of bottom sediments are air borne emissions from industrial plants, hydrogenous pollution in industrial sewage entering the water, sewage sludge, ash dum...

  1. Crystal Structures of Apo and Metal-Bound Forms of the UreE Protein from Helicobacter pylori: Role of Multiple Metal Binding Sites

    Energy Technology Data Exchange (ETDEWEB)

    Shi, Rong; Munger, Christine; Asinas, Abdalin; Benoit, Stephane L.; Miller, Erica; Matte, Allan; Maier, Robert J.; Cygler, Miroslaw (McGill); (Georgia); (Biotech Res.)


    The crystal structure of the urease maturation protein UreE from Helicobacter pylori has been determined in its apo form at 2.1 {angstrom} resolution, bound to Cu{sup 2+} at 2.7 {angstrom} resolution, and bound to Ni{sup 2+} at 3.1 {angstrom} resolution. Apo UreE forms dimers, while the metal-bound enzymes are arranged as tetramers that consist of a dimer of dimers associated around the metal ion through coordination by His102 residues from each subunit of the tetramer. Comparison of independent subunits from different crystal forms indicates changes in the relative arrangement of the N- and C-terminal domains in response to metal binding. The improved ability of engineered versions of UreE containing hexahistidine sequences at either the N-terminal or C-terminal end to provide Ni{sup 2+} for the final metal sink (urease) is eliminated in the H102A version. Therefore, the ability of the improved Ni{sup 2+}-binding versions to deliver more nickel is likely an effect of an increased local concentration of metal ions that can rapidly replenish transferred ions bound to His102.

  2. Metal based biologically active compounds: Design, synthesis, DNA binding and antidiabetic activity of 6-methyl-3-formyl chromone derived hydrazones and their metal (II) complexes. (United States)

    Philip, Jessica Elizabeth; Shahid, Muhammad; Prathapachandra Kurup, M R; Velayudhan, Mohanan Puzhavoorparambil


    Two chromone hydrazone ligands HL 1 and HL 2 were synthesized and characterized by elemental analyses, IR, 1 H NMR & 13 C NMR, electronic absorption and mass spectra. The reactions of the chromone hydrazones with transition metals such as Ni, Cu, and Zn (II) salts of acetate afforded mononuclear metal complexes. Characterization and structure elucidation of the prepared chromone hydrazone metal (II) complexes were done by elemental, IR, electronic, EPR spectra and thermo gravimetric analyses as well as conductivity and magnetic susceptibility measurements. The spectroscopic data showed that the ligand acts as a mono basic bidentate with coordination sites are azomethine nitrogen and hydrazonic oxygen, and they exhibited distorted geometry. The biological studies involved antidiabetic activity i.e. enzyme inhibition of α-amylase and α-glucosidase, Calf Thymus - DNA (CT-DNA) interaction and molecular docking. Potential capacity of synthesized compounds to inhibit the α-amylase and α-glucosidase activity was assayed whereas DNA interaction studies were carried out with the help UV-Vis absorption titration and viscosity method. The docking studies of chromone hydrazones show that they are minor groove binders. Complexes were found to be good DNA - intercalates. Chromone hydrazones and its transition metal complexes have shown comparable antidiabetic activity with a standard drug acarbose. Copyright © 2017 Elsevier B.V. All rights reserved.

  3. Effects of complexing compounds on sorption of metal ions to cement

    Energy Technology Data Exchange (ETDEWEB)

    Loevgren, Lars [Umeaa Univ. (Sweden). Inorganic chemistry


    This present report is a literature review addressing the effects of complexing ligands on the sorption of radionuclides to solid materials of importance for repositories of radioactive waste. Focus is put on laboratory studies of metal ion adsorption to cement in presence of chelating agents under strongly alkaline conditions. As background information, metal sorption to different mineral and cement phases in ligand free systems is described. Furthermore, surface complexation model (SCM) theories are introduced. According to surface complexation theories these interactions occur at specific binding sites at the particle/water interface. Adsorption of cationic metals is stronger at high pH, and the adsorption of anions occurs preferentially at low pH. The adsorption of ions to mineral surfaces is a result of both chemical bonding and electrostatic attraction between the ions and charged mineral surfaces. By combining uptake data with spectroscopic information the sorption can be explained on a molecular level by structurally sound surface complexation models. Most of the metal sorption studies reviewed are dealing with minerals exhibiting oxygen atoms at their surfaces, mainly oxides of Fe(II,III) and Al(III), and aluminosilicates. Investigations of radionuclides are focused on clay minerals, above all montmorillonite and illite. Which mechanism that is governing the metal ion adsorption to a given mineral is to a large extent depending on the metal adsorbed. For instance, sorption of Ni to montmorillonite can occur by formation of inner-sphere mononuclear surface complexes located at the edges of montmorillonite platelets and by formation of a Ni phyllosilicate phase parallel to montmorillonite layers. Also metal uptake to cement materials can occur by different mechanisms. Cationic metals can both be attached to cement (calcium silicate hydrate, CSH) and hardened cement paste (HCP) by formation of inner-sphere complexes at specific surface sites and by

  4. Effect of central metal ions of analogous metal-organic frameworks on adsorption of organoarsenic compounds from water: plausible mechanism of adsorption and water purification. (United States)

    Jun, Jong Won; Tong, Minman; Jung, Beom K; Hasan, Zubair; Zhong, Chongli; Jhung, Sung Hwa


    The adsorptive removal of organoarsenic compounds such as p-arsanilic acid (ASA) and roxarsone (ROX) from water using metal-organic frameworks (MOFs) has been investigated for the first time. A MOF, iron benzenetricarboxylate (also called MIL-100-Fe) exhibits a much higher adsorption capacity for ASA and ROX than activated carbon, zeolite (HY), goethite, and other MOFs. The adsorption of ASA and ROX over MIL-100-Fe is also much more rapid than that over activated carbon. Moreover, the used MIL-100-Fe can be recycled by simply washing with acidic ethanol. Therefore, it is determined that a MOF such as MIL-100-Fe can be used to remove organoarsenic compounds from contaminated water because of its high adsorption capacity, rapid adsorption, and ready regeneration. Moreover, only one of three analogous MIL-100 species (MIL-100-Fe, rather than MIL-100-Al or MIL-100-Cr) can effectively remove the organoarsenic compounds. This selective and high adsorption over MIL-100-Fe, different from other analogous MIL-100 species, can be explained (through calculations) by the facile desorption of water from MIL-100-Fe as well as the large (absolute value) replacement energy (difference between the adsorption energies of the organoarsenic compounds and water) exhibited by MIL-100-Fe. A plausible adsorption/desorption mechanism is proposed based on the surface charge of the MOFs, FTIR results, calculations, and the reactivation results with respect to the solvents used in the experiments. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  5. Radionuclides, Trace Metals, and Organic Compounds in Shells of Native Freshwater Mussels Along the Hanford Reach of the Columbia River: 6000 Years Before Present to Current Times

    Energy Technology Data Exchange (ETDEWEB)

    B. L. Tiller; T. E. Marceau


    This report documents concentrations of radionuclides, trace metals, and semivolatile organic compounds measured in shell samples of the western pearl shell mussel collected along the Hanford Reach of the Columbia River.

  6. Chemical form of metals in traditional medicines underlines potential toxicity in cell cultures. (United States)

    Wu, Qin; Lu, Yuan-Fu; Shi, Jing-Zhen; Liang, Shi-Xia; Shi, Jin-Shan; Liu, Jie


    Mercury (Hg) and arsenic (As) are frequently found in traditional medicines as sulfides, such as cinnabar (HgS) and realgar (As(4)S(4)). There is a general perception that any medicinal use of such metal-containing remedies is unacceptable. An opposing opinion is that different chemical forms of arsenic and mercury have different toxic potentials. To clarify this question, cinnabar, realgar, and cinnabar- and realgar-containing traditional medicine An-Gong-Niu-HuangWan (AGNH), were compared to well-known mercurials (HgS, HgCl(2) and MeHg) and arsenicals (As(2)S(2), As(2)O(3), NaAsO(2), and Na(2)HAsO(4)) for their cytotoxicity in human and rodent cell lines. Cultured cells derived from target organs such as brain (HAPI) and liver (Hep3B, HepG2 and TRL1215) were treated with chemicals for 48 h and cytotoxicity was determined by the MTS assay. MeHg was most toxic with LC(50) of 4-20μM, followed by NaAsO(2) (LC(50), 25-250 μM) and HgCl(2) (LC(50,) 50-100 μM), Na(2)HAsO(4)(LC(50), 60-400μM), As(2)O(3)(LC(50), 30-900 μM), and As(2)S(2) (LC(50), 100-500 μM). In comparison, the LC(50) of realgar ranged from 250 to1500 μM; whereas cinnabar or HgS were approximately 20,000 μM and the toxicity of AGNH was in the range of 1500-8000 μM. Approximately 5000-fold differences exist between MeHg and HgS, and over 10-fold differences exist between NaAsO(2) and As(4)S(4). Chemical forms of metals are important factor in determining their toxicity in traditional medicines, both cinnabar and realgar are much less toxic than well-known mercurial and arsenicals. Copyright © 2011 Elsevier Ireland Ltd. All rights reserved.

  7. Interaction of Model Inhibitor Compounds with Minimalist Cluster Representations of Hydroxyl Terminated Metal Oxide Surfaces

    Directory of Open Access Journals (Sweden)

    Christopher D. Taylor


    Full Text Available The computational modeling of corrosion inhibitors at the level of molecular interactions has been pursued for decades, and recent developments are allowing increasingly realistic models to be developed for inhibitor–inhibitor, inhibitor–solvent and inhibitor–metal interactions. At the same time, there remains a need for simplistic models to be used for the purpose of screening molecules for proposed inhibitor performance. Herein, we apply a reductionist model for metal surfaces consisting of a metal cation with hydroxide ligands and use quantum chemical modeling to approximate the free energy of adsorption for several imidazoline class candidate corrosion inhibitors. The approximation is made using the binding energy and the partition coefficient. As in some previous work, we consider different methods for incorporating solvent and reference systems for the partition coefficient. We compare the findings from this short study with some previous theoretical work on similar systems. The binding energies for the inhibitors to the metal hydroxide clusters are found to be intermediate to the binding energies calculated in other work for bare metal vs. metal oxide surfaces. The method is applied to copper, iron, aluminum and nickel metal systems.

  8. Transient compounds of high alkaline earth metals with custom-made organic ligands as potential precursors for the gas phase separator of high temperature ceramic superconductors

    International Nuclear Information System (INIS)

    Teske, M.


    The aim of this work was the representation of new transient custom-made metal/organic compounds of the high alkaline earth metals Ca, Sr and Ba as potential precursors for the gas phase separation (chemical vapour deposition, CVD) of high temperature ceramic superconductors. There is a report on the synthesis and comprehensive characterisation of representatives of the class of compounds of substituted metallocenes and the B diketone compounds of these metals. Some selected compounds were examined as regards their suitability for CVD. The main task was the examination of the effect of structural and electronic parameters of ligands on the properties of the compounds, where the volatility was to the fore. (orig./MM) [de

  9. Rheological and sensory properties and aroma compounds formed during ripening of soft brined cheese made from camel milk

    DEFF Research Database (Denmark)

    Hailu, Yonas; Hansen, Egon Bech; Seifu, Eyassu


    Protein degradation, rheological properties, sensory properties and the aroma profile of soft brined cheese made from camel milk using two levels of coagulant (camel chymosin) [55 and 85 International Milk Clotting Units (IMCU) L−1] and two levels of brine (2% or 5% NaCl, w/w) were investigated...... over a ripening period of 60 d. Casein degradation in soft brined camel milk cheese significantly (p ... during ripening. However, cheese made with 85 IMCU L−1 coagulant resulted in softening of cheese texture and higher salt uptake. Using descriptive sensory analysis, the experimental cheeses were described as salty, sour and firm. The volatile aroma compounds formed in soft ripened camel milk cheese...

  10. Fundamental Studies of the Reforming of Oxygenated Compounds over Supported Metal Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Dumesic, James A. [Univ. of Wisconsin, Madison, WI (United States)


    The main objective of our research has been to elucidate fundamental concepts associated with controlling the activity, selectivity, and stability of bifunctional, metal-based heterogeneous catalysts for tandem reactions, such as liquid-phase conversion of oxygenated hydrocarbons derived from biomass. We have shown that bimetallic catalysts that combine a highly-reducible metal (e.g., platinum) with an oxygen-containing metal promoter (e.g., molybdenum) are promising materials for conversion of oxygenated hydrocarbons because of their high activity for selective cleavage for carbon-oxygen bonds. We have developed methods to stabilize metal nanoparticles against leaching and sintering under liquid-phase reaction conditions by using atomic layer deposition (ALD) to apply oxide overcoat layers. We have used controlled surface reactions to produce bimetallic catalysts with controlled particle size and controlled composition, with an important application being the selective conversion of biomass-derived molecules. The synthesis of catalysts by traditional methods may produce a wide distribution of metal particle sizes and compositions; and thus, results from spectroscopic and reactions kinetics measurements have contributions from a distribution of active sites, making it difficult to assess how the size and composition of the metal particles affect the nature of the surface, the active sites, and the catalytic behavior. Thus, we have developed methods to synthesize bimetallic nanoparticles with controlled particle size and controlled composition to achieve an effective link between characterization and reactivity, and between theory and experiment. We have also used ALD to modify supported metal catalysts by addition of promoters with atomic-level precision, to produce new bifunctional sites for selective catalytic transformations. We have used a variety of techniques to characterize the metal nanoparticles in our catalysts, including scanning transmission electron

  11. Chiral phosphites as ligands in asymmetric metal complex catalysis and synthesis of coordination compounds

    Energy Technology Data Exchange (ETDEWEB)

    Gavrilov, Konstantin N [Department of Chemistry, S.A. Esenin Ryazan State Pedagogical University, Ryazan (Russian Federation); Bondarev, Oleg G; Polosukhin, Aleksei I [A.N. Nesmeyanov Institute of Organoelement Compounds, Russian Academy of Sciences, Moscow (Russian Federation)


    The data published during the last five years on the application of chiral derivatives of phosphorous acid in coordination chemistry and enantioselective catalysis are summarised and discussed. The effect of the nature of these ligands on the structure of metal complexes and on the efficiency of catalytic organic syntheses is shown. Hydroformylation, hydrogenation, allylic substitution and conjugate addition catalysed by transition metal complexes with optically active phosphites and hydrophosphoranes are considered. The prospects for the development of this field of research are demonstrated.

  12. Ideal flow theory for the double – shearing model as a basis for metal forming design (United States)

    Alexandrov, S.; Trung, N. T.


    In the case of Tresca’ solids (i.e. solids obeying the Tresca yield criterion and its associated flow rule) ideal flows have been defined elsewhere as solenoidal smooth deformations in which an eigenvector field associated everywhere with the greatest principal stress (and strain rate) is fixed in the material. Under such conditions all material elements undergo paths of minimum plastic work, a condition which is often advantageous for metal forming processes. Therefore, the ideal flow theory is used as the basis of a procedure for the preliminary design of such processes. The present paper extends the theory of stationary planar ideal flow to pressure dependent materials obeying the double shearing model and the double slip and rotation model. It is shown that the original problem of plasticity reduces to a purely geometric problem. The corresponding system of equations is hyperbolic. The characteristic relations are integrated in elementary functions. In regions where one family of characteristics is straight, mapping between the principal lines and Cartesian coordinates is determined by linear ordinary differential equations. An illustrative example is provided.

  13. Determination of critical cooling rates in metallic glass forming alloy libraries through laser spike annealing. (United States)

    Bordeenithikasem, Punnathat; Liu, Jingbei; Kube, Sebastian A; Li, Yanglin; Ma, Tianxing; Scanley, B Ellen; Broadbridge, Christine C; Vlassak, Joost J; Singer, Jonathan P; Schroers, Jan


    The glass forming ability (GFA) of metallic glasses (MGs) is quantified by the critical cooling rate (R C ). Despite its key role in MG research, experimental challenges have limited measured R C to a minute fraction of known glass formers. We present a combinatorial approach to directly measure R C for large compositional ranges. This is realized through the use of compositionally-graded alloy libraries, which were photo-thermally heated by scanning laser spike annealing of an absorbing layer, then melted and cooled at various rates. Coupled with X-ray diffraction mapping, GFA is determined from direct R C measurements. We exemplify this technique for the Au-Cu-Si system, where we identify Au 56 Cu 27 Si 17 as the alloy with the highest GFA. In general, this method enables measurements of R C over large compositional areas, which is powerful for materials discovery and, when correlating with chemistry and other properties, for a deeper understanding of MG formation.

  14. An Experimental Study on Micro Clinching of Metal Foils with Cutting by Laser Shock Forming. (United States)

    Wang, Xiao; Li, Cong; Ma, Youjuan; Shen, Zongbao; Sun, Xianqing; Sha, Chaofei; Gao, Shuai; Li, Liyin; Liu, Huixia


    This paper describes a novel technique for joining similar and dissimilar metal foils, namely micro clinching with cutting by laser shock forming. A series of experiments were conducted to study the deformation behavior of single layer material, during which many important process parameters were determined. The process window of the 1060 pure aluminum foils and annealed copper foils produced by micro clinching with cutting was analyzed. Moreover, similar material combination (annealed copper foils) and dissimilar material combination (1060 pure aluminum foils and 304 stainless steel foils) were successfully achieved. The effect of laser energy on the interlock and minimum thickness of upper foils was investigated. In addition, the mechanical strength of different material combinations joined by micro clinching with cutting was measured in single lap shearing tests. According to the achieved results, this novel technique is more suitable for material combinations where the upper foil is thicker than lower foil. With the increase of laser energy, the interlock increased while the minimum thickness of upper foil decreased gradually. The shear strength of 1060 pure aluminum foils and 304 stainless steel foils combination was three times as large as that of 1060 pure aluminum foils and annealed copper foils combination.

  15. An Experimental Study on Micro Clinching of Metal Foils with Cutting by Laser Shock Forming

    Directory of Open Access Journals (Sweden)

    Xiao Wang


    Full Text Available This paper describes a novel technique for joining similar and dissimilar metal foils, namely micro clinching with cutting by laser shock forming. A series of experiments were conducted to study the deformation behavior of single layer material, during which many important process parameters were determined. The process window of the 1060 pure aluminum foils and annealed copper foils produced by micro clinching with cutting was analyzed. Moreover, similar material combination (annealed copper foils and dissimilar material combination (1060 pure aluminum foils and 304 stainless steel foils were successfully achieved. The effect of laser energy on the interlock and minimum thickness of upper foils was investigated. In addition, the mechanical strength of different material combinations joined by micro clinching with cutting was measured in single lap shearing tests. According to the achieved results, this novel technique is more suitable for material combinations where the upper foil is thicker than lower foil. With the increase of laser energy, the interlock increased while the minimum thickness of upper foil decreased gradually. The shear strength of 1060 pure aluminum foils and 304 stainless steel foils combination was three times as large as that of 1060 pure aluminum foils and annealed copper foils combination.

  16. Influence of liposome forms of the rhenium compounds and cis-platin on thiol-disulfide coefficient in the rats’ blood

    Directory of Open Access Journals (Sweden)

    I. V. Klenina


    Full Text Available Thiol-disulfide coefficient (TDC and its different modifications in model in vivo were studied. Introduction of the liposome forms of cluster rhenium compounds with organic ligands (CROL leads to both TDC increasing and to the constancy of the TDC. Thus, CROLs aren’t toxic agents and some compounds could mobilize organisms’ thiol defence system. Liposome form of cis-platin leads to the TDC decreasing. Important CROL capacities for its future medical treatment practice were shown.

  17. Noble metal catalyzed aqueous phase hydrogenation and hydrodeoxygenation of lignin-derived pyrolysis oil and related model compounds. (United States)

    Mu, Wei; Ben, Haoxi; Du, Xiaotang; Zhang, Xiaodan; Hu, Fan; Liu, Wei; Ragauskas, Arthur J; Deng, Yulin


    Aqueous phase hydrodeoxygenation of lignin pyrolysis oil and related model compounds were investigated using four noble metals supported on activated carbon. The hydrodeoxygenation of guaiacol has three major reaction pathways and the demethylation reaction, mainly catalyzed by Pd, Pt and Rh, produces catechol as the products. The presence of catechol and guaiacol in the reaction is responsible for the coke formation and the catalysts deactivation. As expected, there was a significant decrease in the specific surface area of Pd, Pt and Rh catalysts during the catalytic reaction because of the coke deposition. In contrast, no catechol was produced from guaiacol when Ru was used so a completely hydrogenation was accomplished. The lignin pyrolysis oil upgrading with Pt and Ru catalysts further validated the reaction mechanism deduced from model compounds. Fully hydrogenated bio-oil was produced with Ru catalyst. Copyright © 2014 Elsevier Ltd. All rights reserved.

  18. Organic acid compounds in root exudation of Moso Bamboo (Phyllostachys pubescens) and its bioactivity as affected by heavy metals. (United States)

    Chen, Junren; Shafi, Mohammad; Wang, Ying; Wu, Jiasen; Ye, Zhengqian; Liu, Chen; Zhong, Bin; Guo, Hua; He, Lizhi; Liu, Dan


    Moso bamboo (Phyllostachys pubescens) has great potential as phytoremediation material in soil contaminated by heavy metals. A hydroponics experiment was conducted to determine organic acid compounds of root exudates of lead- (Pb), zinc- (Zn), copper- (Cu), and cadmium (Cd)-tolerant of Moso bamboo. Plants were grown in nutrients solution which included Pb, Zn, Cu, and Cd applied as Pb(NO 3 ) 2 (200 μM), ZnSO 4 ·7H 2 O (100 μM), CuSO 4 ·5H 2 O (25 μM), and CdCl 2 (10 μM), respectively. Oxalic acid and malic acid were detected in all treatments. Lactic acid was observed in Cu, Cd, and control treatments. The oxalic was the main organic acid exudated by Moso bamboo. In the sand culture experiment, the Moso bamboo significantly activated carbonate heavy metals under activation of roots. The concentration of water-soluble metals (except Pb) in sand were significantly increased as compared with control. Organic acids (1 mM mixed) were used due to its effect on the soil adsorption of heavy metals. After adding mixed organic acids, the Cu and Zn sorption capacity in soils was decreased markedly compared with enhanced Pb and Cd sorption capacity in soils. The sorption was analyzed using Langmuir and Freundlich equations with R 2 values that ranged from 0.956 to 0.999 and 0.919 to 0.997, respectively.

  19. Mesoionic Compounds

    Indian Academy of Sciences (India)

    property has been used to determine whether a compound is aromatic or not. Mesoionic compounds are structurally very different from ben- zenoid compounds, but they fulfill most of the criteria of aroma- ticity and form a part of a variety of aromatic compounds, which can be classified as follows. A) Benzenoid Compounds.

  20. Study of X-ray L2 absorption edges of Gd, Dy, Ho and Er in metals and compounds

    International Nuclear Information System (INIS)

    Agarwal, B.K.; Agarwal, B.R.K.


    The positions and shapes of L2 X-ray absorption edges of Gd, Dy, Ho and Er have been studied in metals and in oxides and chlorides, using a forty centimetre bent mica crystal spectrograph. It has been found that the L2 edge shifts towards the high energy side in the compounds and that the chemical shift ΔE depends on the degree of covalency involved. The white line structure at the edge has been analysed in terms of transitions of L2 shell electron to optical nd (n >= 5) states. (author)

  1. Quantitative analysis of hydrogen gas formed by aqueous corrosion of metallic uranium

    International Nuclear Information System (INIS)

    Fonnesbeck, J.


    Three unirradiated EBR-II blanket fuel samples containing depleted uranium metal were corrosion tested in simulated J-13 well water at 90 C. The corrosion rate of the blanket uranium metal was then determined relative to H 2 formation. Corrosion of one of the samples was interrupted prior to complete oxidation of the uranium metal and the solid corrosion product was analyzed for UO 2 and UH 3

  2. The Experimental Analysis of Forming and Strength of Clinch Riveting Sheet Metal Joint Made of Different Materials

    Directory of Open Access Journals (Sweden)

    Jacek Mucha


    Full Text Available The paper presents the pressed joint technology using forming process with or without additional fastener. The capabilities for increasing the load-carrying ability of mechanical joints by applying special rivets and dies were presented. The experimental research focused on joining steel sheet metal made of different materials. The joint forming was performed with the solid round die and rectangular split die for riveted joint forming. The load-carrying ability of joints was evaluated by measuring the maximum load force in the shearing test in the tensile testing machine. The effect of joint forming process on joined material strain was compared by measuring the microhardness of the joints.

  3. Formation of ohmic contacts to p-type diamond using carbide forming metals (United States)

    Nakanishi, Jiro; Otsuki, A.; Oku, T.; Ishiwata, O.; Murakami, Masanori


    The measurement of the specific contact resistance, rho(sub C), and microstructural analysis at the metal/diamond interface were carried out for diamond with various acceptor concentrations, N(sub A), in order to understand the carrier transport mechanism at the metal/diamond interface. The rho(sub C) measurements were carried out for polycrystalline boron-doped semiconducting diamonds which were prepared by the microwave plasma chemical vapor deposition. The acceptor concentrations, estimated by the boron concentrations measured by secondary ion mass spectroscopy, ranged from 3 x 10(exp 18) to 3 x 10(exp 20)/cu cm. Ti and Mo films, which form carbides with diamond, were deposited on the diamonds using the electron-beam evaporation technique. The rho(sub C) values were measured by the cricular transmission line method before and after annealing at temperatures in the range of 400-600 C. The dependence of the rho(sub C) values on the acceptor concentrations suggested that the dominant transport mechanism was the field-emission for the diamond with N(sub A) around 10(exp 20)/cu cm and the thermionic-field-emission for the diamond with N(sub A) from 3 x 10(exp 18)/cu cm to 4 x 10(exp 19)/cu cm. The rho(sub C) values of the Ti contacts were observed to decrease upon annealing, whereas those of the Mo contacts decreased gradually with increasing annealing temperature. However, the rho(sub C) values of both the Ti and Mo contacts reached at the same value of approximately 1 x 10(exp -6) Ohm sq cm after annealing at 600 C for the diamonds with N(sub A) higher than 10(exp 20)/cu cm. Note that the rho(sub C) values of the Mo contact were extremely stable at high temperatures: the rho(sub C) values did not deteriorate after annealing at 600 C for more than 3 h. The thermally stable molybdenum carbide (alpha-Mo2C) and amorphous layers were observed at the Mo/diamond interface after annealing at 600 C by cross-sectional transmission electron microscopy and x-ray diffraction.

  4. Time dependent enhanced resistance against antibiotics & metal salts by planktonic & biofilm form of Acinetobacter haemolyticus MMC 8 clinical isolate. (United States)

    Gaidhani, Sharvari Vijaykumar; Raskar, Aartee Vishnu; Poddar, Sharmishtha; Gosavi, Shriya; Sahu, Praveen Kishore; Pardesi, Karishma Rajendra; Bhide, Shobhana V; Chopade, Balu Ananada


    Available literature shows paucity of reports describing antibiotic and metal resistance profile of biofilm forming clinical isolates of Acinetobacter haemolyticus. The present study was undertaken to evaluate the antibiotic and metal resistance profile of Indian clinical isolate of A. haemolyticus MMC 8 isolated from human pus sample in planktonic and biofilm form. Antibiotic susceptibility and minimum inhibitory concentration were determined employing broth and agar dilution techniques. Biofilm formation was evaluated quantitatively by microtiter plate method and variation in complex architecture was determined by scanning electron microscopy. Minimum biofilm inhibiting concentration was checked by Calgary biofilm device. Planktonic A. haemolyticus MMC 8 was sensitive to 14 antibiotics, AgNO 3 and HgC1 2 resistant to streptomycin and intermediately resistant to netilmycin and kanamycin. MMC 8 exhibited temporal variation in amount and structure of biofilm. There was 32-4000 and 4-256 fold increase in antibiotic and metal salt concentration, respectively to inhibit biofilm over a period of 72 h as against susceptible planktonic counterparts. Total viable count in the range of 10(5)-10(6) cfu / ml was observed on plating minimum biofilm inhibiting concentration on Muller-Hinton Agar plate without antimicrobial agents. Biofilm forming cells were several folds more resistant to antibiotics and metal salts in comparison to planktonic cells. Presence of unaffected residual cell population indicated presence of persister cells. The results indicate that biofilm formation causes enhanced resistance against antibiotics and metal salts in otherwise susceptible planktonic A. haemolyticus MMC 8.

  5. Multilayered thermal insulation formed of zirconia bonded layers of zirconia fibers and metal oxide fibers and method for making same (United States)

    Wrenn, Jr., George E.; Holcombe, Jr., Cressie E.


    A multilayered thermal insulating composite is formed of a first layer of zirconia-bonded zirconia fibers for utilization near the hot phase or surface of a furnace or the like. A second layer of zirconia-bonded metal oxide fibers is attached to the zirconia fiber layer by a transition layer formed of intermingled zirconia fibers and metal oxide fibers. The thermal insulation is fabricated by vacuum molding with the layers being sequentially applied from aqueous solutions containing the fibers to a configured mandrel. A portion of the solution containing the fibers forming the first layer is intermixed with the solution containing the fibers of the second layer for forming the layer of mixed fibers. The two layers of fibers joined together by the transition layer are saturated with a solution of zirconium oxynitrate which provides a zirconia matrix for the composite when the fibers are sintered together at their nexi.

  6. Metal and hydrogen catalysis in isotopic hydrogen exchange in some biologically important heterocyclic compounds

    International Nuclear Information System (INIS)

    Buncel, E.; Joly, H.A.; Jones, J.R.; Onyido, I.


    This study reports on the catalytic roles of metal and hydrogen ions in tritium exchange in some heterocyclic substrates which occur as residues in many biologically important molecules. We have found that detritiation of 1-methyl[2- 3 H]imidazole is inhibited by a number of metal ions. As well, inhibition of exchange rates was noted with Ag(I) and Cu(II) for [2- 3 H]thiazole and 1-methyl[8- 3 H]inosine, with Ag(I) for [2- 3 H]benzothiazole, and with Cu(II) for 1-methyl[8- 3 H]guanosine. A complete mechanistic description, which includes the various metal ion-coordinated species generated under the experimental conditions, is presented. The results demonstrate the reactivity order: protonated >> metal-coordinated >> neutral substrates. The differential catalytic effects of metal and hydrogen ions in these processes are discussed in terms of the extent of charge developed on the ligating heteroatom in the reaction intermediate. (author). 13 refs.; 1 fig

  7. Fiscal Year 2010 Summary Report on the Epsilon-Metal Phase as a Waste Form for 99 Tc

    Energy Technology Data Exchange (ETDEWEB)

    Strachan, Denis M. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Crum, Jarrod V. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Buck, Edgar C. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Riley, Brian J. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Zumhoff, Mac R. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States)


    Epsilon metal (ε-metal) is generated in nuclear fuel during irradiation. This metal consists of Pd, Ru, Rh, Mo, and some Te. These accumulate at the UO2 grain boundaries as small (ca 5 µm) particles. These metals have limited solubility in the acid used to dissolve fuel during reprocessing and in typical borosilicate glass. These must be treated separately to improve overall waste loading in glass. This low solubility and their survival in 2 Gy-old natural reactors led us to investigate them as a waste form for the immobilization of 99Tc and 107Pd, two very long-lived isotopes.

  8. Rubber pad forming - Efficient approach for the manufacturing of complex structured sheet metal blanks for food industry (United States)

    Spoelstra, Paul; Djakow, Eugen; Homberg, Werner


    The production of complex organic shapes in sheet metals is gaining more importance in the food industry due to increasing functional and hygienic demands. Hence it is necessary to produce parts with complex geometries promoting cleanability and general sanitation leading to improvement of food safety. In this context, and especially when stainless steel has to be formed into highly complex geometries while maintaining desired surface properties, it is inevitable that alternative manufacturing processes will need to be used which meet these requirements. Rubber pad forming offers high potential when it comes to shaping complex parts with excellent surface quality, with virtually no tool marks and scratches. Especially in cases where only small series are to be produced, rubber pad forming processes offers both technological and economic advantages. Due to the flexible punch, variation in metal thickness can be used with the same forming tool. The investments to set-up Rubber pad forming is low in comparison to conventional sheet metal forming processes. The process facilitates production of shallow sheet metal parts with complex contours and bends. Different bending sequences in a multiple tool set-up can also be conducted. The planned contribution thus describes a brief overview of the rubber pad technology. It shows the prototype rubber pad forming machine which can be used to perform complex part geometries made from stainless steel (1.4301). Based on an analysis of the already existing systems and new machines for rubber pad forming processes, together with their process properties, influencing variables and areas of application, some relevant parts for the food industry are presented.

  9. Crystal structure of the compounds formed in the systems of Sm-(Pd, Pt)-(Si, Ge) at 20 at.%Sm and 870K

    International Nuclear Information System (INIS)

    Barakatova, Zh.M.; Seropegin, Yu.D.; Bodak, O.I.; Belan, B.D.


    Formation of two new compounds at component interaction in Sm(Pd-Pt) -(Si, Ge) ternary structures is determined under 20at.%Sm and 870 K and their crystalline structure is studied. Formation of three new intermetallic compounds is determined and occurrence of SmPd 2 Si compound is proved within Sm-Pd-Si system. Formation of five compounds is determined within Sm-Pt-Si system; periods of crystalline lattice and structure type are determined for Sm 2 Pt 3 Si 5 , S, PtSi 3 structure. Minimal amount of compounds was detected in Sm-Pd-Ge system. Periods of crystalline structure and structure type are determined for two compounds formed in the studied isoconcentrate. 4 refs.; 2 figs

  10. Validation tool for 2D multi-stage metal-forming processes on meta-stable stainless steels

    NARCIS (Netherlands)

    Post, J.; de Vries, C.; Huetink, Han


    During the last few years it has become more and more customary for major industries to use FEM simulations during the product creation process. Most of these metal-forming process simulations are based on elastic plastic behaviour of material and use non-deformable tools. For a correct use of FEM

  11. Anomalous Crystallization as a Signature of the Fragile-to-Strong Transition in Metallic Glass-Forming Liquids

    DEFF Research Database (Denmark)

    Yang, X.N.; Zhou, C.; Sun, Q.J.


    We study the fragile-to-strong (F−S) transition of metallic glass-forming liquids (MGFLs) by measuring the thermal response during annealing and dynamic heating of La55Al25Ni5Cu15 glass ribbons fabricated at different cooling rates. We find that the glasses fabricated in the intermediate regime...

  12. The influence of surface condition on the metal dusting behavior of cast and wrought chromia forming alloys

    NARCIS (Netherlands)

    Hermse, C.G.M.; Asteman, H.; Ijzerman, R.M.; Jakobi, D.


    The current work investigated the impact of surface condition on the metal dusting behavior of chromia forming alloys. Five commercial alloys were included in the study, wrought 800H, 353MA, and cast G4859, G4852 Micro, and ET45 Micro, these alloys have a chromium and nickel content in the range of

  13. Form and position measurement of sheet metal parts by boundary outlines extracting strategy (United States)

    Ma, Liqun; Fan, Jingjing; Zhou, Zili; Li, Yongqian


    This paper proposes a new strategy of extracting boundary points from scanning point cloud (SPC) data of sheet metal parts (SMPs). This strategy is suitable for bending SMPs with slowly changing surfaces. To cope with the problem that the SMP is too thin to have enough points of its lateral surface to be calculated for the boundary outline, the boundary points are obtained by moving ridge points which is the maximum curvature points on the marginal of parts along theoretical position direction. In this article, the strategy is explained firstly and then carried out on two different experimental SMPs. The strategy contains several steps. Firstly, we construct a slice set called multiple direction slices (MDS) along a curve fitted by boundary points of SPC. Then marginal point data (MPD) is obtained completely and accurately by MDS. And then the chamfer arc data is extracted from MPD by setting identification model of chamfer arc's two endpoints. Then the ridge points which are the maximal curvature points of chamfer arc data are picked out from chamfer arc data. Finally, by moving the ridge points along a certain direction for a fixed distance, the boundary points are calculated out. Two experiments are carried out to identify position error and form error of the extracted boundary points. The measurement results of boundary outlines of a 6mm thick SMP from a three coordinate measuring machine (CMM) is taken as reference in the first experiment. The second experiment regards theoretical boundary outline as reference. Both two experiments demonstrate the effectiveness of the strategy.

  14. Systematics in band gaps and optical spectra of 3D transition metal compounds

    International Nuclear Information System (INIS)

    Zaanen, J.; Sawatzky, G.A.


    In this paper the authors discuss the systematics in the transition metal d-d Coulomb interactions and the anion to cation charge transfer energies, and relate these to systematics in observed band gaps. In addition, they discuss the nature of the optical thresholds and their dependence on the cation and anion electronegativity

  15. Simultaneous removal of metals and organic compounds from a heavily polluted soil

    International Nuclear Information System (INIS)

    Szpyrkowicz, L.; Radaelli, M.; Bertini, S.; Daniele, S.; Casarin, F.


    The paper describes the results of treatment of soil samples, deriving from a dismissed industrial site, contaminated with several metals: Hg, Ni, Co, Zn, Pb, Cu, Cr, As and organic substances. The soil was subjected to remediation based on a process in which an oxidising leaching agent was produced electrochemically in-line in an undivided electrochemical cell reactor equipped with a Ti/Pt-Ir anode and a stainless steel cathode. Leaching of the soil samples was performed under dynamic conditions using a leaching column. A subsequent regeneration of the leaching solution, which consisted in electrodeposition of metals and electro-oxidation of organic substances, was carried out in a packed-bed reactor equipped with a centrally positioned graphite rod, serving as an anode, and stainless steel three-dimensional filling as a cathode. The study was focused on how and to which extent the metals present in the soil, as organic complexes, can be solubilised and how the process rates are impacted by the solution pH and other process variables. Data obtained under non-oxidising conditions, typically adopted for leaching of metals, are compared with the performance of chlorine-enriched leaching solutions. The results obtained under various conditions are also discussed in terms of the total organic carbon (TOC) removal from the water phase

  16. Transition-Metal-Mediated or -Catalyzed Syntheses of Steroids and Steroid-Like Compounds

    Czech Academy of Sciences Publication Activity Database

    Kotora, Martin; Hessler, F.; Eignerová, B.

    -, č. 1 (2012), s. 29-42 ISSN 1434-193X R&D Projects: GA MŠk 1M0508 Institutional research plan: CEZ:AV0Z40550506 Keywords : steroids * synthesis design * synthetic methods * asymmetric synthesis * transition metals Subject RIV: CC - Organic Chemistry Impact factor: 3.344, year: 2012

  17. Analysis of sulphur, phosphorus and silica in metals, alloys, inorganic compounds and solvents

    International Nuclear Information System (INIS)

    Upadhya, J.C.; Naik, S.S.; Khedikar, W.K.; Sudersanan, M.; Mathur, P.K


    Procedures for the analysis of sulphur, phosphorus and silica in various metals and alloys like mild steel, carbon steel and stainless steel as well as nickel base alloys are described. Procedures were also developed for the analysis of sulphur in thoria pellets and in other materials like crack check fluids, coal etc. Typical results obtained are summarised. (author)

  18. A novel stir bar sorptive extraction coating based on monolithic material for apolar, polar organic compounds and heavy metal ions. (United States)

    Huang, Xiaojia; Qiu, Ningning; Yuan, Dongxing; Huang, Benli


    In this study, a novel stir bar sorptive extraction (SBSE) based on monolithic material (SBSEM) was prepared. The monolithic material was obtained by in situ copolymerization of vinylpyrrolidone and divinylbenzene in the presence of a porogen solvent containing cyclohexanol and 1-dodecanol with azobisisobutyronitrile as initiator. The influences of polymerization conditions on the extraction efficiencies were investigated, using phenol and p-nitrophenol as detected solutes. The monolithic material was characterized by various techniques, such as elemental analysis, scanning electron microscopy, mercury intrusion porosimetry, infrared spectroscopy. Polycyclic aromatic hydrocarbons were used to investigate the extraction efficiencies of SBSEM for apolar analytes. Hormones, aromatic amines and phenols were selected as test analytes to investigate the extraction efficiencies of SBSEM for weakly and strongly polar compounds. The results showed that the new SBSEM could enrich the above-mentioned organic compounds effectively. It is worthy to mention that the SBSEM can enrich some heavy metal ions, such as Cu(2+), Pb(2+), Cr(3+) and Cd(2+), through coordination adsorption. To our best knowledge, that is the first to use SBSE to enrich heavy metal ions.

  19. Structure of metal-rich (001) surfaces of III-V compound semiconductors

    DEFF Research Database (Denmark)

    Kumpf, C.; Smilgies, D.; Landemark, E.


    feature of the structure is accompanied by linear arrays of atoms on nonbulklike sites at the surface which, depending on the compounds, exhibit a certain degree of disorder. A tendency to group-III-dimer formation within these chains increases when descending the periodic table. We propose that all the c...

  20. Transition metal catalyzed oxidation of Alcell lignin, soda lignin, and lignin model compounds in ionic liquids

    NARCIS (Netherlands)

    Zakzeski, J.; Jongerius, A.L.; Weckhuysen, B.M.


    Lignin is a component of lignocellulosic biomass from which important aromatic compounds can potentially be obtained. In the present work, Alcell and soda lignin were dissolved in the ionic liquid 1-ethyl-3-methylimidazolium diethylphosphate (EMIM DEP) and subsequently oxidized using several

  1. The Transition Metal-Like Reactivity of Low Oxidation State s- and p-Block Compounds (United States)


    significantly more reactive than their 3-coordinate counterparts. This has been manifested by the fact that the compounds have been shown to activate H2 (at...University of Melbourne, July, 2017. c) provide a list any interactions with industry or with Air Force Research Laboratory scientists or significant

  2. Hard X-ray PhotoElectron Spectroscopy of transition metal oxides: Bulk compounds and device-ready metal-oxide interfaces

    International Nuclear Information System (INIS)

    Borgatti, F.; Torelli, P.; Panaccione, G.


    Highlights: • Hard X-ray PhotoElectron Spectroscopy (HAXPES) applied to buried interfaces of systems involving Transition Metal Oxides. • Enhanced contribution of the s states at high kinetic energies both for valence and core level spectra. • Sensitivity to chemical changes promoted by electric field across metal-oxide interfaces in resistive switching devices. - Abstract: Photoelectron spectroscopy is one of the most powerful tool to unravel the electronic structure of strongly correlated materials also thanks to the extremely large dynamic range in energy, coupled to high energy resolution that this form of spectroscopy covers. The kinetic energy range typically used for photoelectron experiments corresponds often to a strong surface sensitivity, and this turns out to be a disadvantage for the study of transition metal oxides, systems where structural and electronic reconstruction, different oxidation state, and electronic correlation may significantly vary at the surface. We report here selected Hard X-ray PhotoElectron Spectroscopy (HAXPES) results from transition metal oxides, and from buried interfaces, where we highlight some of the important features that such bulk sensitive technique brings in the analysis of electronic properties of the solids.

  3. Effects of metallic nanoparticle doped flux on the interfacial intermetallic compounds between lead-free solder ball and copper substrate

    International Nuclear Information System (INIS)

    Sujan, G.K.; Haseeb, A.S.M.A.; Afifi, A.B.M.


    Lead free solders currently in use are prone to develop thick interfacial intermetallic compound layers with rough morphology which are detrimental to the long term solder joint reliability. A novel method has been developed to control the morphology and growth of intermetallic compound layers between lead-free Sn–3.0Ag–0.5Cu solder ball and copper substrate by doping a water soluble flux with metallic nanoparticles. Four types of metallic nanoparticles (nickel, cobalt, molybdenum and titanium) were used to investigate their effects on the wetting behavior and interfacial microstructural evaluations after reflow. Nanoparticles were dispersed manually with a water soluble flux and the resulting nanoparticle doped flux was placed on copper substrate. Lead-free Sn–3.0Ag–0.5Cu solder balls of diameter 0.45 mm were placed on top of the flux and were reflowed at a peak temperature of 240 °C for 45 s. Angle of contact, wetting area and interfacial microstructure were studied by optical microscopy, field emission scanning electron microscopy and energy-dispersive X-ray spectroscopy. It was observed that the angle of contact increased and wetting area decreased with the addition of cobalt, molybdenum and titanium nanoparticles to flux. On the other hand, wettability improved with the addition of nickel nanoparticles. Cross-sectional micrographs revealed that both nickel and cobalt nanoparticle doping transformed the morphology of Cu 6 Sn 5 from a typical scallop type to a planer one and reduced the intermetallic compound thickness under optimum condition. These effects were suggested to be related to in-situ interfacial alloying at the interface during reflow. The minimum amount of nanoparticles required to produce the planer morphology was found to be 0.1 wt.% for both nickel and cobalt. Molybdenum and titanium nanoparticles neither appear to undergo alloying during reflow nor have any influence at the solder/substrate interfacial reaction. Thus, doping of flux

  4. Effects of metallic nanoparticle doped flux on the interfacial intermetallic compounds between lead-free solder ball and copper substrate

    Energy Technology Data Exchange (ETDEWEB)

    Sujan, G.K., E-mail:; Haseeb, A.S.M.A., E-mail:; Afifi, A.B.M., E-mail:


    Lead free solders currently in use are prone to develop thick interfacial intermetallic compound layers with rough morphology which are detrimental to the long term solder joint reliability. A novel method has been developed to control the morphology and growth of intermetallic compound layers between lead-free Sn–3.0Ag–0.5Cu solder ball and copper substrate by doping a water soluble flux with metallic nanoparticles. Four types of metallic nanoparticles (nickel, cobalt, molybdenum and titanium) were used to investigate their effects on the wetting behavior and interfacial microstructural evaluations after reflow. Nanoparticles were dispersed manually with a water soluble flux and the resulting nanoparticle doped flux was placed on copper substrate. Lead-free Sn–3.0Ag–0.5Cu solder balls of diameter 0.45 mm were placed on top of the flux and were reflowed at a peak temperature of 240 °C for 45 s. Angle of contact, wetting area and interfacial microstructure were studied by optical microscopy, field emission scanning electron microscopy and energy-dispersive X-ray spectroscopy. It was observed that the angle of contact increased and wetting area decreased with the addition of cobalt, molybdenum and titanium nanoparticles to flux. On the other hand, wettability improved with the addition of nickel nanoparticles. Cross-sectional micrographs revealed that both nickel and cobalt nanoparticle doping transformed the morphology of Cu{sub 6}Sn{sub 5} from a typical scallop type to a planer one and reduced the intermetallic compound thickness under optimum condition. These effects were suggested to be related to in-situ interfacial alloying at the interface during reflow. The minimum amount of nanoparticles required to produce the planer morphology was found to be 0.1 wt.% for both nickel and cobalt. Molybdenum and titanium nanoparticles neither appear to undergo alloying during reflow nor have any influence at the solder/substrate interfacial reaction. Thus, doping

  5. Metal Evolution and TrAnsport in the Large Magellanic Cloud (METAL): Probing Dust Evolution in Star Forming Galaxies (United States)



    METAL is a large spectroscopic and imaging program with HST dedicated to the study of dust evolution in the Large Magellanic Cloud (LMC). The program will obtain FUV and NUV medium-resolution spectra of 33 massive stars in the LMC with STIS and COS complementing existing archival data to measure gas-phase and dust-phase (depletion) elemental abundances. With these spectra, we will subsequently directly measure the dust composition and abundance as a function of environment (surface density, radiation field, dynamical conditions, such as the proximity of supernova remnants or expanding HI shells). The depletion information will be complemented with dust UV extinction curves (i.e., the UV opacity of dust grains as a function of wavelength) derived from either archival IUE, or new COS and low-resolution STIS spectra acquired as part of this program. Together, the depletions and extinction curves will constrain how the dust abundance and properties (composition, size distribution) vary with environment at Z=0.5Zo. In parallel to the spectroscopic observations, we will obtain WFC3 NUV-NIR imaging to map dust extinction parameters (AV, RV) in the vicinity of our targets and calibrate the far-infrared (FIR) emissivity of dust. Our observations we will improve the accuracy of dust mass and extinction estimates in the local and high-redshift universe by up to an order of magnitude.METAL will complement a Cycle 23 HST/STIS program (GO-13778) focused on dust evolution in the Small Magellanic Cloud (SMC) at Z=0.2Zo, and previously published depletion studies in the Milky Way (Jenkins et al. 2009) to provide a comprehensive view of dust evolution as a function of metallicity.

  6. New data on mineral forms of rare metals in phosphogypsum wastes (United States)

    Samonov, A. E.


    Phosphogypsum is an industrial waste of the processing of Khibiny apatite concentrate into chemical fertilizers by sulfurous technology. This is a valuable and promising technogenous rare-metal feedstock. The samples of fresh and old phosphogypsum were studied using precision physical techniques of analytical electron microscopy and X-ray spectral microanalysis. These studies allowed the discovery of new and unusual mineral compositions including strontium and rare earth metals in mineral fractions of phosphogypsum. The appearance of a new generation of technogenous rare-metal raw material permits us to characterize the prospects of its industrial use and to develop nonwaste technologies of its complex treatment.

  7. Large scale simulations of the mechanical properties of layered transition metal ternary compounds for fossil energy power system applications

    Energy Technology Data Exchange (ETDEWEB)

    Ching, Wai-Yim [Univ. of Missouri, Kansas City, MO (United States)


    Advanced materials with applications in extreme conditions such as high temperature, high pressure, and corrosive environments play a critical role in the development of new technologies to significantly improve the performance of different types of power plants. Materials that are currently employed in fossil energy conversion systems are typically the Ni-based alloys and stainless steels that have already reached their ultimate performance limits. Incremental improvements are unlikely to meet the more stringent requirements aimed at increased efficiency and reduce risks while addressing environmental concerns and keeping costs low. Computational studies can lead the way in the search for novel materials or for significant improvements in existing materials that can meet such requirements. Detailed computational studies with sufficient predictive power can provide an atomistic level understanding of the key characteristics that lead to desirable properties. This project focuses on the comprehensive study of a new class of materials called MAX phases, or Mn+1AXn (M = a transition metal, A = Al or other group III, IV, and V elements, X = C or N). The MAX phases are layered transition metal carbides or nitrides with a rare combination of metallic and ceramic properties. Due to their unique structural arrangements and special types of bonding, these thermodynamically stable alloys possess some of the most outstanding properties. We used a genomic approach in screening a large number of potential MAX phases and established a database for 665 viable MAX compounds on the structure, mechanical and electronic properties and investigated the correlations between them. This database if then used as a tool for materials informatics for further exploration of this class of intermetallic compounds.

  8. Effect of thermal and mechanical parameter’s damage numerical simulation cycling effects on defects in hot metal forming processes (United States)

    El Amri, Abdelouahid; el yakhloufi Haddou, Mounir; Khamlichi, Abdellatif


    Damage mechanisms in hot metal forming processes are accelerated by mechanical stresses arising during Thermal and mechanical properties variations, because it consists of the materials with different thermal and mechanical loadings and swelling coefficients. In this work, 3D finite element models (FEM) are developed to simulate the effect of Temperature and the stresses on the model development, using a general purpose FE software ABAQUS. Explicit dynamic analysis with coupled Temperature displacement procedure is used for a model. The purpose of this research was to study the thermomechanical damage mechanics in hot forming processes. The important process variables and the main characteristics of various hot forming processes will also be discussed.

  9. The Oxidation of Sulfur-Containing Compounds Using Heterogeneous Catalysts of Transition Metal Oxides Deposited on the Polymeric Matrix (United States)

    Dinh Vu, Ngo; Dinh Bui, Nhi; Thi Minh, Thao; Thi Thanh Dam, Huong; Thi Tran, Hang


    We investigate the activity of heterogeneous catalysts of transition metal oxides deposited on the polymeric matrix in the oxidation of sulfur-containing compounds. It is shown that MnO2-10/CuO-10 has the highest catalytic activity. The physicomechanical properties of polymeric heterogeneous catalysts of transition-metal oxides, including the specific surface area, elongation at break and breaking strength, specific electrical resistance, and volume resistivity were studied by using an Inspekt mini 3 kN universal tensile machine in accordance with TCVN 4509:2006 at a temperature of 20 ± 2°C. Results show that heterogeneous polymeric catalysts were stable under severe reaction conditions. Scanning electron microscopy, and energy-dispersive analysis are used to study the surfaces of the catalysts. Microstructural characterization of the catalysts is performed by using x-ray computed tomography. We demonstrate the potential application of polymeric heterogeneous catalysts of transition-metal oxides in industrial wastewater treatment.

  10. Synchrotron Diffraction Studies of Spontaneous Magnetostriction in Rare Earth Transition Metal Compounds

    International Nuclear Information System (INIS)

    Ning Yang


    Thermal expansion anomalies of R 2 Fe 14 B and R 2 Fe 17 C x (x = 0,2) (R Y, Nd, Gd, Tb, Er) stoichiometric compounds are studied with high-energy synchrotron X-ray powder diffraction using Debye-Schemer geometry in temperature range 10K to 1000K. Large spontaneous magnetostriction up to their Curie temperatures (T c ) is observed. The a-axes show relatively larger invar effects than c-axes in the R 2 Fe 14 B compounds whereas the R 2 Fe 17 C x show the contrary anisotropies. The iron sub-lattice is shown to dominate the spontaneous magnetostriction of the compounds. The contribution of the rare earth sublattice is roughly proportional to the spin magnetic moment of the rare earth in the R 2 Fe 14 B compounds but in R 2 Fe 17 C x , the rare earth sub-lattice contribution appears more likely to be dominated by the local bonding. The calculation of spontaneous magnetostrain of bonds shows that the bonds associated with Fe(j2) sites in R 2 Fe 14 B and the dumbbell sites in R 2 Fe 17 C x have larger values, which is strongly related to their largest magnetic moment and Wigner-Seitz atomic cell volume. The roles of the carbon atoms in increasing the Curie temperatures of the R 2 Fe 17 compounds are attributed to the increased separation of Fe hexagons. The R 2 Fe 17 and R 2 Fe 14 B phases with magnetic rare earth ions also show anisotropies of thermal expansion above T c . For R 2 Fe 17 and R 2 Fe 14 B the a a /a c > 1 whereas the anisotropy is reversed with the interstitial carbon in R 2 Fe 17 . The average bond magnetostrain is shown to be a possible predictor of the magnetic moment of Fe sites in the compounds. Both of the theoretical and phenomenological models on spontaneous magnetostriction are discussed and a Landau model on the spontaneous magnetostriction is proposed

  11. Mechanism and kinetics of halogenated compound removal by metallic iron: Transport in solution, diffusion and reduction within corrosion films. (United States)

    Tang, Shun; Wang, Xiao-Mao; Liu, Shi-Ting; Yang, Hong-Wei; Xie, Yuefeng F; Yang, Xiao-Yi


    A detailed kinetic model comprised of mass transport (k tra ), pore diffusion (k dif ), adsorption and reduction reaction (k rea ), was developed to quantitatively evaluate the effect of corrosion films on the removal rate (k obs ) of halogenated compounds by metallic iron. Different corrosion conditions were controlled by adjusting the iron aging time (0 or 1 yr) and dissolved oxygen concentration (0-7.09 mg/L DO). The k obs values for bromate, mono-, di- and tri-chloroacetic acids (BrO 3 - , MCAA, DCAA and TCAA) were 0.41-7.06, 0-0.16, 0.01-0.53, 0.10-0.73 h -1 , with k tra values at 13.32, 12.12, 11.04 and 10.20 h -1 , k dif values at 0.42-5.82, 0.36-5.04, 0.30-4.50, 0.30-3.90 h -1 , and k rea values at 14.94-421.18, 0-0.19, 0.01-1.30, 0.10-3.98 h -1 , respectively. The variation of k obs value with reaction conditions depended on the reactant species, while those of k tra , k dif and k rea values were irrelevant to the species. The effects of corrosion films on k dif and k rea values were responsible for the variation of k obs value for halogenated compounds. For a mass-transfer-limited halogenated compound such as BrO 3 - , an often-neglected k dif value primarily determined its k obs value when pore diffusion was the rate-limiting step of its removal. In addition, the value of k dif might influence product composition during a consecutive dechlorination, such as for TCAA and DCAA. For a reaction-controlled compound such as MCAA, an increased k rea value was achieved under low oxic conditions, which was favorable to improve its k obs value. The proposed model has a potential in predicting the removal rate of halogenated compounds by metallic iron under various conditions. Copyright © 2017. Published by Elsevier Ltd.

  12. A Stable, Magnetic, and Metallic Li3O4 Compound as a Discharge Product in a Li-Air Battery. (United States)

    Yang, Guochun; Wang, Yanchao; Ma, Yanming


    The Li-air battery with the specific energy exceeding that of a Li ion battery has been aimed as the next-generation battery. The improvement of the performance of the Li-air battery needs a full resolution of the actual discharge products. Li2O2 has been long recognized as the main discharge product, with which, however, there are obvious failures on the understanding of various experimental observations (e.g., magnetism, oxygen K-edge spectrum, etc.) on discharge products. There is a possibility of the existence of other Li-O compounds unknown thus far. Here, a hitherto unknown Li3O4 compound as a discharge product of the Li-air battery was predicted through first-principles swarm structure searching calculations. The new compound has a unique structure featuring the mixture of superoxide O2(-) and peroxide O2(2-), the first such example in the Li-O system. The existence of superoxide O2(-) creates magnetism and hole-doped metallicity. Findings of Li3O4 gave rise to direct explanations of the unresolved experimental magnetism, triple peaks of oxygen K-edge spectra, and the Raman peak at 1125 cm(-1) of the discharge products. Our work enables an opportunity for the performance of capacity, charge overpotential, and round-trip efficiency of the Li-air battery.

  13. Thermoplastic forming of bulk metallic glasses for precision robotics components, Phase I (United States)

    National Aeronautics and Space Administration — Demand for novel manufacturing methods for space systems brings unique properties of bulk metallic glasses (BMG) into the spotlight. In addition to superior...

  14. Development of fluoric compound treatment system in conversion for recycle in metal industry

    International Nuclear Information System (INIS)

    Kim, P.O.; Cho, N.C.


    Korea Nuclear Fuel Company (KNFC) has been operating AUC conversion process from UF 6 to UO 2 from 1990. In 1997, KNFC constructed another conversion line called dry conversion to meet the increasing demand for nuclear fuel fabrication. In the dry conversion, two kinds of hydrofluoric acid (HF) are produced as a by-product. The first one is 50% concentration HF and the other one is diluted HF ranging from 10% to 49%. The high concentration HF can be used in metal industry, but there is no use for diluted one. The diluted HF should be disposed of as liquid waste after some treatment. To solve this problem we have developed the process to convert the diluted hydrofluoric acid to the sodium fluoride, which is readily used in the metal industry. By developing the process we could make a contribution to the environment as well as cost reduction in manufacturing nuclear fuel. (author)


    Teitel, R.J.


    Liquid metal compositions containing a solid uranium compound dispersed therein is described. Uranium combines with tin to form the intermetallic compound USn/sub 3/. It has been found that this compound may be incorporated into a liquid bath containing bismuth and lead-bismuth components, if a relatively small percentage of tin is also included in the bath. The composition has a low thermal neutron cross section which makes it suitable for use in a liquid metal fueled nuclear reactor.

  16. Ambient-temperature superconductor symetrical metal-dihalide bis-(ethylenedithio)-tetrathiafulvalene compounds (United States)

    Williams, Jack M.; Wang, Hsien-Hau; Beno, Mark A.


    A new class of organic superconductors having the formula (ET).sub.2 MX.sub.2 wherein ET represents bis(ethylenedithio)-tetrathiafulvalene, M is a metal such as Au, Ag, In, Tl, Rb, Pd and the like and X is a halide. The superconductor (ET).sub.2 AuI.sub.2 exhibits a transition temperature of 5 K. which is high for organic superconductors.

  17. Graphene from Alginate Pyrolysis as a Metal-Free Catalyst for Hydrogenation of Nitro Compounds. (United States)

    Trandafir, Mihaela-Mirela; Florea, Mihaela; Neaţu, Florentina; Primo, Ana; Parvulescu, Vasile I; García, Hermenegildo


    Graphene obtained by pyrolysis of alginate at 900 °C under inert atmosphere and exfoliation is used as a metal-free catalyst for reduction of nitro to amino groups with hydrogen as a reagent. The process is general for aromatic and aliphatic, conjugated and isolated nitro groups, and occurs with low selectivity over hydrogenation of carbon-carbon double bonds. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  18. The interaction of metal carbonyl compounds with organic polymers and monomers


    Lyons, Michael P.


    The photochemistry of W(CO)6, Mo(CO)6, and Cr(CO)6 in the presence of monomeric and polymeric triphenylphosphine ligands was investigated in toluene solution, using laser flash photolysis with 355nm excitation. The mechanism and kinetics of interaction of the primary photoproducts M(CO)5(toluene) (M = W, Mo, or Cr) with the various monomeric ligands were investigated. Interaction of the metal carbonyl photofragments with various homopolymers is also discussed. The polymerisation methods used ...

  19. Volatile organic compounds and trace metal level in some beers collected from Romanian market (United States)

    Voica, Cezara; Kovacs, Melinda; Vadan, Marius


    Beer is one of the most popular beverages at worldwide level. Through this study fifteen different types of beer collected from Romanian market were analysed in order to evaluate their mineral, trace element as well the their organic content. Importance of such characterization of beer samples is supported by the fact that their chemical composition can affect both taste and stability of beer, as well the consumer health. Minerals and trace elements analysis were performed on ICP-MS while organic compounds analysis was done through GC-MS. Through ICP-MS analysis, elements as Ca, Na, K and Mg were evidenced at mgṡkg-1 order while elements as Cr, Ba, Co, Ni were detected at lower level. After GC-MS analysis the major volatile compounds that were detected belong to alcohols namely ethanol, propanol, isobutanol, isoamyl alcohol and linalool. Selected fatty acids and esters were evidenced also in the studied beer samples.


    Energy Technology Data Exchange (ETDEWEB)

    Genzel, R.; Tacconi, L. J.; Schreiber, N. M. Foerster; Gracia-Carpio, J.; Lutz, D.; Saintonge, A. [Max-Planck-Institut fuer extraterrestrische Physik (MPE), Giessenbachstr. 1, 85748 Garching (Germany); Combes, F. [Observatoire de Paris, LERMA, CNRS, 61 Av. de l' Observatoire, F-75014 Paris (France); Bolatto, A. [Department of Astronomy, University of Maryland, College Park, MD 20742-2421 (United States); Neri, R.; Cox, P. [IRAM, 300 Rue de la Piscine, 38406 St. Martin d' Heres, Grenoble (France); Sternberg, A. [Sackler School of Physics and Astronomy, Tel Aviv University, Tel Aviv 69978 (Israel); Cooper, M. C. [Department of Physics and Astronomy, Frederick Reines Hall, University of California, Irvine, CA 92697-4575 (United States); Bouche, N. [Department of Physics, University of California, Santa Barbara, Broida Hall, Santa Barbara, CA 93106 (United States); Bournaud, F. [Service d' Astrophysique, DAPNIA, CEA/Saclay, F-91191 Gif-sur-Yvette Cedex (France); Burkert, A. [Universitaetssternwarte der Ludwig-Maximiliansuniversitaet, Scheinerstr. 1, D-81679 Muenchen (Germany); Comerford, J. [Department of Astronomy and McDonald Observatory, 1 University Station, C1402 Austin, TX 78712-0259 (United States); Davis, M.; Newman, S. [Department of Astronomy, Campbell Hall, University of California, Berkeley, CA 94720 (United States); Garcia-Burillo, S. [Observatorio Astronomico Nacional-OAN, Apartado 1143, 28800 Alcala de Henares- Madrid (Spain); Naab, T., E-mail:, E-mail: [Max-Planck Institut fuer Astrophysik (MPA), Karl Schwarzschildstrasse 1, D-85748 Garching (Germany); and others


    We use the first systematic samples of CO millimeter emission in z {>=} 1 'main-sequence' star-forming galaxies to study the metallicity dependence of the conversion factor {alpha}{sub CO,} from CO line luminosity to molecular gas mass. The molecular gas depletion rate inferred from the ratio of the star formation rate (SFR) to CO luminosity, is {approx}1 Gyr{sup -1} for near-solar metallicity galaxies with stellar masses above M{sub S} {approx} 10{sup 11} M{sub Sun }. In this regime, the depletion rate does not vary more than a factor of two to three as a function of molecular gas surface density or redshift between z {approx} 0 and 2. Below M{sub S} the depletion rate increases rapidly with decreasing metallicity. We argue that this trend is not caused by starburst events, by changes in the physical parameters of the molecular clouds, or by the impact of the fundamental-metallicity-SFR-stellar mass relation. A more probable explanation is that the conversion factor is metallicity dependent and that star formation can occur in 'CO-dark' gas. The trend is also expected theoretically from the effect of enhanced photodissociation of CO by ultraviolet radiation at low metallicity. From the available z {approx} 0 and z {approx} 1-3 samples we constrain the slope of the log({alpha}{sub CO})-log (metallicity) relation to range between -1 and -2, fairly insensitive to the assumed slope of the gas-SFR relation. Because of the lower metallicities near the peak of the galaxy formation activity at z {approx} 1-2 compared to z {approx} 0, we suggest that molecular gas masses estimated from CO luminosities have to be substantially corrected upward for galaxies below M{sub S}.

  1. Precise coulometric titration of uranium in a high-purity uranium metal and in uranium compounds

    International Nuclear Information System (INIS)

    Tanaka, Tatsuhiko; Yoshimori, Takayoshi


    Uranium in uranyl nitrate, uranium trioxide and a high-purity uranium metal was assayed by the coulometric titration with biamperometric end-point detection. Uranium (VI) was reduced to uranium (IV) by solid bismuth amalgam in 5M sulfuric acid solution. The reduced uranium was reoxidized to uranium (VI) with a large excess of ferric ion at a room temperature, and the ferrous ion produced was titrated with the electrogenerated manganese(III) fluoride. In the analyses of uranium nitrate and uranium trioxide, the results were precise enough when the error from uncertainty in water content in the samples was considered. The standard sample of pure uranium metal (JAERI-U4) was assayed by the proposed method. The sample was cut into small chips of about 0.2g. Oxides on the metal surface were removed by the procedure shown by National Bureau of Standards just before weighing. The mean assay value of eleven determinations corrected for 3ppm of iron was (99.998+-0.012) % (the 95% confidence interval for the mean), with a standard deviation of 0.018%. The proposed coulometric method is simple and permits accurate and precise determination of uranium which is matrix constituent in a sample. (auth.)

  2. NUMISHEET 2016: 10th International Conference and Workshop on Numerical Simulation of 3D Sheet Metal Forming Processes

    International Nuclear Information System (INIS)


    The NUMISHEET conference series have been established as a world-class forum through which new intellectual ideas and technologies in the area of sheet metal forming simulation are exchanged. Previous NUMISHEET conferences have given enormous contributions to industry and academia in what regards the development of new methods and ideas for the numerical simulation of sheet metal forming processes. Previous NUMISHEET conferences were held in: Zurich (Switzerland, 1991), Isehara (Japan, 1993), Dearborn (USA, 1996), Besancon (France, 1999), Jeju Island (South Korea, 2002), Detroit (USA, 2005), Interlaken (Switzerland, 2008), Seoul (South Korea, 2011) and Melbourne (Australia, 2014). The NUMISHEET 2016 conference will be held in Bristol, UK. It features technical, keynote and plenary sessions and mini-symposiums in diverse sheet metal forming areas including the recently introduced incremental sheet forming and electromagnetic forming, as well as new prominent numerical methods such as IsoGeometric Analysis and meshless methods for sheet analysis. NUMISHEET 2016 will have eight academic plenary lectures delivered by worldwide recognised experts in the areas of sheet metal forming, material modelling and numerical methods in general. Also, NUMISHEET 2016 will have three industrial plenary lectures which will be addressed by three different companies with strong businesses in sheet metal forming processes: AutoForm, Crown Technology and Jaguar Land Rover. One of the most distinguishing features of NUMISHEET conference series is the industrial benchmark sessions, during which numerical simulations of industrial sheet formed parts are compared with experimental results from the industry. The benchmark sessions provide an extraordinary opportunity for networking, for the exchange of technologies related to sheet metal forming and for the numerical validation of sheet metal forming codes/software. Three benchmark studies have been organised in NUMISHEET 2016: BM1) &apos

  3. Metal organic chemical vapor deposition of 111-v compounds on silicon (United States)

    Vernon, Stanley M.


    Expitaxial composite comprising thin films of a Group III-V compound semiconductor such as gallium arsenide (GaAs) or gallium aluminum arsenide (GaAlAs) on single crystal silicon substrates are disclosed. Also disclosed is a process for manufacturing, by chemical deposition from the vapor phase, epitaxial composites as above described, and to semiconductor devices based on such epitaxial composites. The composites have particular utility for use in making light sensitive solid state solar cells.

  4. Flow injection determination of carboxylate, phosphate, and sulfhydryl compounds using metal exchange complexation. (United States)

    Mansour, Fotouh R; Shafi, Mohammad A; Danielson, Neil D


    The determination of carboxylate, phosphorous, and sulfhydryl compounds has been studied using flow injection by measuring the decrease in absorbance of the Fe(III)-salicylate complex due to preferential ligand interaction with ferric ion. Targeted compounds include polycarboxylates such as sodium citrate, sodium oxalate, and EDTA, anionic phosphorous compounds such as sodium monofluoroorthophosphate, sodium trimetaphosphate, and sodium hexametaphosphate, and sulfhydryl compounds such as cysteine, glutathione, and captopril. Initial flow injection optimization has focused on citrate based on its ability to replace salicylate ion in the Fe(III)-salicylate complex causing a decrease in absorbance at 525 nm proportional to the citrate concentration. Two flow injection analysis methods are developed. In the first method, offline reaction flow injection, sodium citrate dissolved in 100 μmol L(-1) Fe-salicylate is injected in a carrier solution of 100 μmol L(-1) Fe-salicylate. The decrease in peak area is linear over a range of 1.36-109 μmol L(-1) using a flow rate of 1 mL min(-1) and an injection volume of 100 μL. The effect of pH on the Fe-salicylate complex absorbance is studied from 1 to 3.5; pH 3 shows both a high and stable complex absorbance in the visible range which provided important potential selectivity over UV detection. The limit of detection is found to be less than 57 nmol L(-1) depending on the Fe(III)-salicylate concentration used. The second method is reverse flow injection using the sample as a flowing stream in which 3 mmol L(-1) Fe(III)-salicylate is injected and the decrease in the response with increased sample concentration was monitored. The commercially available pharmaceutical product (Citroma)(®) is used to assess the accuracy and precision of the two proposed methods as compared to a reference method. Copyright © 2012 Elsevier B.V. All rights reserved.

  5. Density functional study of d0 half-metallic ferromagnetism in a bulk and (001) nano-surface of KP compound (United States)

    Kazemi, Marjan; Amiri, Peiman; Salehi, Hamdollah


    According to many applications of half-metals in the spintronics devices, we investigate half-metallic properties of KP compound in rock-salt (RS), zinc-blende (ZB), cesium chloride (CsCl) and wurtzite (WZ) structural phases by using density functional theory. Results indicate that KP compound is half-metal in RS, ZB and WZ structures, while in CsCl structure, due to small lattice constant and failure of Stoner criterion, KP compound doesn't have any magnetic properties. Half-metallic gap values obtained are 0.47, 0.95 and 0.91 eV for RS, ZB, WZ structures, respectively. Although KP compound in CsCl structure is more stable than RS structure energetically, but from dynamical point of view only RS structure is stable and other structures are unstable. Calculations corresponding to (001) surface of RS structure demonstrate the conservation of bulk half-metallic properties in this crystallographic direction. So nano-layers of KP compound in RS structure might be an appropriate candidate for application in near future spintronics devices.

  6. Rare earth intermetallic compounds produced by a reduction-diffusion process

    International Nuclear Information System (INIS)

    Cech, R.E.


    A reduction-diffusion process is given for producing novel rare earth intermetallic compounds, such as cobalt--rare earth intermetallic compounds, especially compounds useful in preparing permanent magnets. A particulate mixture of rare earth metal halide, cobalt and calcium hydride is heated to effect reduction of the rare earth metal halide and to diffuse the resulting rare earth metal into the cobalt to form the intermetallic compound

  7. A sheet metal forming simulation of automotive outer panels considering the behavior of air in die cavity (United States)

    Choi, Kwang Yong; Kim, Yun Chang; Choi, Hee Kwan; Kang, Chul Ho; Kim, Heon Young


    During a sheet metal forming process of automotive outer panels, the air trapped between a blank sheet and a die tool can become highly compressed, ultimately influencing the blank deformation and the press force. To prevent this problem, vent holes are drilled into die tools and needs several tens to hundreds according to the model size. The design and the drilling of vent holes are based on expert's experience and try-out result and thus the process can be one of reasons increasing development cycle. Therefore the study on the size, the number, and the position of vent holes is demanded for reducing development cycle, but there is no simulation technology for analyzing forming defects, making numerical sheet metal forming process simulations that incorporate the fluid dynamics of air. This study presents a sheet metal forming simulation of automotive outer panels (a roof and a body side outer) that simultaneously simulates the behavior of air in a die cavity. Through CAE results, the effect of air behavior and vent holes to blank deformation was analyzed. For this study, the commercial software PAM-STAMP{trade mark, serif} and PAM-SAFE{trade mark, serif} was used.

  8. Synchrotron Diffraction Studies of Spontaneous Magnetostriction in Rare Earth Transition Metal Compounds

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Ning [Iowa State Univ., Ames, IA (United States)


    Thermal expansion anomalies of R2Fe14B and R2Fe17Cx (x = 0,2) (R = Y, Nd, Gd, Tb, Er) stoichiometric compounds are studied with high-energy synchrotron X-ray powder diffraction using Debye-Schemer geometry in temperature range 10K to 1000K. Large spontaneous magnetostriction up to their Curie temperatures (Tc) is observed. The a-axes show relatively larger invar effects than c-axes in the R2Fe14B compounds whereas the R2Fe17Cx show the contrary anisotropies. The iron sub-lattice is shown to dominate the spontaneous magnetostriction of the compounds. The contribution of the rare earth sublattice is roughly proportional to the spin magnetic moment of the rare earth in the R2Fe14B compounds but in R2Fe17Cx, the rare earth sub-lattice contribution appears more likely to be dominated by the local bonding. The calculation of spontaneous magnetostrain of bonds shows that the bonds associated with Fe(j2) sites in R2Fe14B and the dumbbell sites in R2Fe17Cx have larger values, which is strongly related to their largest magnetic moment and Wigner-Seitz atomic cell volume. The roles of the carbon atoms in increasing the Curie temperatures of the R2Fe17 compounds are attributed to the increased separation of Fe hexagons. The R2Fe17 and R2Fe14B phases with magnetic rare earth ions also show anisotropies of thermal expansion above c. For R2Fe17 and R2Fe14B the a a/a c > 1 whereas the anisotropy is reversed with the interstitial carbon in R2Fe17. The average bond magnetostrain is shown to be a possible predictor of the magnetic moment of Fe sites in the compounds. Both of the theoretical and

  9. Theoretical modelling of intermediate band solar cell materials based on metal-doped chalcopyrite compounds

    Energy Technology Data Exchange (ETDEWEB)

    Palacios, P. [Instituto de Energia Solar and Dpt. de Tecnologias Especiales, ETSI de Telecomunicacion, UPM, Ciudad Universitaria s/n, 28040 Madrid (Spain)]. E-mail:; Sanchez, K. [Instituto de Energia Solar and Dpt. de Tecnologias Especiales, ETSI de Telecomunicacion, UPM, Ciudad Universitaria s/n, 28040 Madrid (Spain); Conesa, J.C. [Instituto de Catalisis y Petroleoquimica, CSIC, Marie Curie 2, Cantoblanco, 28049 Madrid (Spain); Fernandez, J.J. [Dpt. de Fisica Fundamental, Universidad Nacional de Educacion a Distancia, 28080, Madrid (Spain); Wahnon, P. [Instituto de Energia Solar and Dpt. de Tecnologias Especiales, ETSI de Telecomunicacion, UPM, Ciudad Universitaria s/n, 28040 Madrid (Spain)


    Electronic structure calculations are carried out for CuGaS{sub 2} partially substituted with Ti, V, Cr or Mn to ascertain if some of these systems could provide an intermediate band material able to give a high efficiency photovoltaic cell. Trends in electronic level positions are analyzed and more accurate advanced theory levels (exact exchange or Hubbard-type methods) are used in some cases. The Ti-substituted system seems more likely to yield an intermediate band material with the desired properties, and furthermore seems realizable from the thermodynamic point of view, while those with Cr and Mn might give half-metal structures with applications in spintronics.

  10. Ambient air monitoring for organic compounds, acids, and metals at Los Alamos National Laboratory, January 1991

    International Nuclear Information System (INIS)

    Williams, C.H.; Eberhart, C.F.


    Los Alamos National Laboratory (LANL) contracted Radian Corporation (Radian) to conduct a short-term, intensive air monitoring program whose goal was to estimate the impact of chemical emissions from LANL on the ambient air environment. A comprehensive emission inventory had identified more than 600 potential air contaminants in LANL's emissions. A subset of specific target chemicals was selected for monitoring: 20 organic vapors, 6 metals and 5 inorganic acid vapors. These were measured at 5 ground level sampling sites around LANL over seven consecutive days in January 1991. The sampling and analytical strategy used a combination of EPA and NIOSH methods modified for ambient air applications

  11. Rapid coastal survey of anthropogenic radionuclides, metals, and organic compounds in surficial marine sediments

    Energy Technology Data Exchange (ETDEWEB)

    Noakes, J.E.; Noakes, S.E.; Dvoracek, D.K.; Culp, R.A. [Center for Applied Isotope Studies, University of Georgia, Athens, GA (United States); Bush, P.B. [Agricultural and Environmental Services Laboratories, Cooperative Extension Service, University of Georgia, Athens, GA (United States)


    A towed survey system, the GIMS/CS{sup 3}, has been developed to enable the rapid measurement and mapping of a variety of physical and geochemical parameters in the surficial sediments of aquatic environments while the survey vessel is underway. With its capability for measuring radiometric, elemental and organic compound constituents of sediments, as well as bathymetry and water quality parameters, the GIMS/CS{sup 3} provides a cost-effective means of performing reconnaissance determinations of contaminant distributions and environmental monitoring tasks over broad geographic regions.

  12. Rapid coastal survey of anthropogenic radionuclides, metals, and organic compounds in surficial marine sediments

    International Nuclear Information System (INIS)

    Noakes, J.E.; Noakes, S.E.; Dvoracek, D.K.; Culp, R.A.; Bush, P.B.


    A towed survey system, the GIMS/CS 3 , has been developed to enable the rapid measurement and mapping of a variety of physical and geochemical parameters in the surficial sediments of aquatic environments while the survey vessel is underway. With its capability for measuring radiometric, elemental and organic compound constituents of sediments, as well as bathymetry and water quality parameters, the GIMS/CS 3 provides a cost-effective means of performing reconnaissance determinations of contaminant distributions and environmental monitoring tasks over broad geographic regions

  13. The Little Cub: Discovery of an Extremely Metal-poor Star-forming Galaxy in the Local Universe

    Energy Technology Data Exchange (ETDEWEB)

    Hsyu, Tiffany; Prochaska, J. Xavier; Bolte, Michael [Department of Astronomy and Astrophysics, University of California Santa Cruz, 1156 High Street, Santa Cruz, CA 95060 (United States); Cooke, Ryan J. [Centre for Extragalactic Astronomy, Department of Physics, Durham University, South Road, Durham DH1 3LE (United Kingdom)


    We report the discovery of the Little Cub, an extremely metal-poor star-forming galaxy in the local universe, found in the constellation Ursa Major (a.k.a. the Great Bear). We first identified the Little Cub as a candidate metal-poor galaxy based on its Sloan Digital Sky Survey photometric colors, combined with spectroscopy using the Kast spectrograph on the Shane 3 m telescope at Lick Observatory. In this Letter, we present high-quality spectroscopic data taken with the Low Resolution Imaging Spectrometer at Keck Observatory, which confirm the extremely metal-poor nature of this galaxy. Based on the weak [O iii] λ 4363 Å emission line, we estimate a direct oxygen abundance of 12 + log(O/H) = 7.13 ± 0.08, making the Little Cub one of the lowest-metallicity star-forming galaxies currently known in the local universe. The Little Cub appears to be a companion of the spiral galaxy NGC 3359 and shows evidence of gas stripping. We may therefore be witnessing the quenching of a near-pristine galaxy as it makes its first passage about a Milky Way–like galaxy.

  14. Study of the influence of the molecular structure of vinyl compounds on their ability to form polymer films by electro-polymerization under cathodic polarisation

    International Nuclear Information System (INIS)

    Deniau, Guy


    This research thesis addresses the study of new vinyl compounds, and aims at improving knowledge on the interaction between metal and a vinyl molecule under an intense electric field (the field of the double electrochemical layer), and more particularly at studying the influence of the molecular structure of the vinyl compound as well as the occurring reactions. After a first part presenting physical-chemical principles and knowledge which govern the whole set of reactions which are occurring within an electrolysis reactor, and a brief historical overview, this research thesis proposes a presentation of molecules which have been chosen for this study (vinyl compounds) and a justification of this choice. The author also presents the experimental device and describes the process implementation. Then, he presents and analyses experimental results. It appears that only some studied molecules result in the formation of polymer film [fr


    Energy Technology Data Exchange (ETDEWEB)

    Ivanova, N.; Avendano Nandez, J. L.; Sivakoff, G. R. [Department of Physics, University of Alberta, Edmonton, AB T6G 2E1 (Canada); Fragos, T.; Kim, D.-W.; Fabbiano, G. [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138 (United States); Lombardi, J. C. [Department of Physics, Allegheny College, Meadville, PA 16335 (United States); Voss, R. [Department of Astrophysics/IMAPP, Radboud University Nijmegen, P.O. Box 9010, 6500-GL Nijmegen (Netherlands); Jordan, A., E-mail: [Departamento de Astronomia y Astrofisica, Pontificia Universidad Catolica de Chile, 7820436 Macul, Santiago (Chile)


    Globular clusters (GCs) effectively produce dynamically formed low-mass X-ray binaries (LMXBs). Observers detect {approx}100 times more LMXBs per stellar mass in GCs compared to stars in the fields of galaxies. Observationally, metal-rich GCs are about three times more likely to contain an X-ray source than their metal-poor counterparts. Recent observations have shown that this ratio holds in extragalactic GCs for all bright X-ray sources with L{sub X} between 2 Multiplication-Sign 10{sup 37} and 5 Multiplication-Sign 10{sup 38} erg s{sup -1}. In this Letter, we propose that the observed metallicity dependence of LMXBs in extragalactic GCs can be explained by the differences in the number densities and average masses of red giants in populations of different metallicities. Red giants serve as seeds for the dynamical production of bright LMXBs via two channels-binary exchanges and physical collisions-and the increase of the number densities and masses of red giants boost LMXB production, leading to the observed difference. We also discuss a possible effect of the age difference in stellar populations of different metallicities.

  16. Phase Structure and Properties of a Biodegradable Block Copolymer Coalesced from It's Crystalline Inclusion Compound Formed with alpha-Cyclodextrin (United States)

    Shuai, Xintao; Wei, Min; Probeni, Francis; Bullions, Todd A.; Shin, I. Daniel; Tonelli, Alan E.


    A well-defined biodegradable block copolymer of poly(epsilon caprolactone) (PCL) and poly(L-lactic acid) (PLLA) was synthesized and characterized and then included as a guest in an inclusion compound (IC) formed with the host alpha-cyclodextrin (CD). The PCL-b-PLLA block copolymer was subsequently coalesced from it's CD-IC crystals by either treatment with hot water (50 C) or an aqueous amylase solution at 25 C. The coalesced PCL-b-PLLA was examined by FTIR, DSC, TGA, and WAXD and was found to be much more homogeneosly organized, with much less segregation and crystallinity of the PCL and PLLA microphases. The morpholgy, crystallization kinetics, thermal behavior, and biodegradability of the coalesced PCL-b-PLLA block copolymer was studied by comparison to similar observations made on as-synthesized PCL-b-PLLA, PCL and PLLA homopolymers, and their solution-cast blend. The PCL and PLLA blocks are found to be more intimately mixed, with less phase segregation, in the coalesced diblock copolymer, and this leads to homogeneous bulk crystallization, which is not observed for the as-synthesized diblock copolymer. The coalesced PCL-b-PLLA was also found to be more quickly biodegraded (lipase from Rhizopus arrhizus)than the as-synthesized PCL-b-PLLA or the physical blend of PCL and PLLA homopolymers. Overall, the coalescence of the inherently phase segregated diblock copolymer PCL-b-PLLA results in a small amount of compact, chain-extended PCL and PLLA crystals embedded in an amorphous phase, largely consisting of well-mixed PCL and PLLA blocks. Thus, we have demonstrated that it is possible to control the morpholgy of a biodegradable diblock copolymer, thereby significantly modifying it's properties, by coalescence from it's CD-IC crystals.

  17. Simultaneous Patterning of Independent Metal/Metal Oxide Multi-Layer Films Using Two-Tone Photo-Acid Generating Compound Systems

    Directory of Open Access Journals (Sweden)

    Hideo Honma


    Full Text Available (1 The photo-induced solubility and positive-tone direct photo-patterning of iron, copper and lanthanides chelated with 4-(2-nitrobenzyloxycarbonylcatechol (NBOC or 4-(6-nitroveratryloxycarbonylcatechol (NVOC was investigated. Photo-patterning of iron, copper, cerium, samarium, europium, terbium, dysprosium, holmium, erbium and lutetium complexes was accomplished. Continuous films were formed by the pyrolysis of metal complex films at 500 °C. (2 Based on the difference in the photo-reaction excitation wavelength profile of NBOC and NVOC complexes, a short and simple method for simultaneous micro-patterning of two independent films on each side of a transparent glass substrate was developed. Using the developed procedure, indium tin oxide and/or titanium oxide films were formed on each side of a quartz substrate without use of resist or etching.

  18. Selection of the Composition with High Glass Forming Ability in Zr-Cu-Ni-Al Bulk Metallic Glasses

    Directory of Open Access Journals (Sweden)

    Yajuan Sun


    Full Text Available Three new Zr-Cu-Ni-Al bulk metallic glasses were developed through appropriate mixing of three binary eutectics Zr38.2Cu61.8, Zr51Al49, and Zr64Ni36. By suppressing solidification of competing crystalline phases, a new glass forming alloy Zr51Cu24.22Ni14.06Al10.72 with the critical diameter of up to 10 mm is obtained.

  19. Transition Metal Catalyzed Reactions for Forming Carbon–Oxygen and Carbon–Carbon Bonds

    DEFF Research Database (Denmark)

    Sølvhøj, Amanda Birgitte

    of ether and hydrocarbon radicals with -bromostyrenes was serendipitously discovered and subsequently optimized. By screening of various radical initiators and transition metal salts the best conditions were found to involve addition of three to four equivalents of Me2Zn to a solution of -bromostyrene...

  20. Characterization of the whiskerlike products formed by hydriding magnesium metal powders

    DEFF Research Database (Denmark)

    Herley, P. J.; Jones, W.; Vigeholm, Bjørn


    The structure of filamentary crystals produced during the hydriding of magnesium powder has been studies in detail. The needles of small dimensions (typically 0.5 μm in diameter) have been identified by electron analytical techniques to be oriented microcrystals of metallic magnesium...

  1. Titanium coordination compounds: from discrete metal complexes to metal–organic frameworks

    KAUST Repository

    Assi, Hala


    Owing to their promise in photocatalysis and optoelectronics, titanium based metal–organic frameworks (MOFs) are one of the most appealing classes of MOFs reported to date. Nevertheless, Ti-MOFs are still very scarce because of their challenging synthesis associated with a poor degree of control of their chemistry and crystallization. This review aims at giving an overview of the recent progress in this field focusing on the most relevant existing titanium coordination compounds as well as their promising photoredox properties. Not only Ti-MOFs but also Ti-oxo-clusters will be discussed and particular interest will be dedicated to highlight the different successful synthetic strategies allowing to overcome the still “unpredictable” reactivity of titanium ions, particularly to afford crystalline porous coordination polymers.

  2. Low temperature specific heat and phonon anomalies in transition metal compounds

    International Nuclear Information System (INIS)

    Roedhammer, P.; Weber, W.; Gmelin, E.; Rieder, K.H.


    Specific heat measurements reported in the temperature range 1.5 to 70 0 K for TiC, TiN, ZrC, NbC, HfC and TaC. The Debye temperatures calculated as functions of temperature from the experimental data are in close agreement with theoretical values obtained using shell models to predict phonon densities. It is shown that the frequencies of lowest-lying phonon anomalies may be calculated from specific heat differences between superconducting and normal compounds; frequencies of 5.8, 4.8 and 3.1 Th/sub z/ are predicted for TiN, NbC and TaC respectively. 15 refs

  3. Study of the thermodynamic properties of the metallic compounds Sr(NH{sub 3}){sub 6} and Li(NH{sub 3}){sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Medouer, Hadria [L.E.P.C.M, Departement de physique, Faculte des sciences, Universite de Batna, B.P. C2045, Poste Hadj Lakhdar, Batna 05011 (Algeria); Messaadi, Saci [L.E.P.C.M, Departement de physique, Faculte des sciences, Universite de Batna, B.P. C2045, Poste Hadj Lakhdar, Batna 05011 (Algeria)], E-mail:; Aiadi, Kamel Eddine [Departement de physique, Faculte des sciences et sciences de l' ingenieur, Universite de Ouargla (Algeria)


    The metallic compounds Sr(NH{sub 3}){sub 6} and Li(NH{sub 3}){sub 4} are prepared in vacuum within cells of quartz. The non-reproducibility of Jacobs' measurements of the heat capacity at high temperature of the compound Sr(NH{sub 3}){sub 6} led us to reconsider the thermal studies. Our measurements by differential thermal analysis (D.T.A.) were obtained by the analysis of the phase shift between the piloting and the differential signals. The metallic compound Li(NH{sub 3}){sub 4} was also examined by the mean of D.T.A. A detailed study has been carried out in a range of temperature 25-90 K, where the results obtained shows a second-order transition at 23 K, which can be compared with these observed in the case of deutered compound.

  4. Steam reforming of biomass gasification tar using benzene as a model compound over various Ni supported metal oxide catalysts. (United States)

    Park, Hyun Ju; Park, Sung Hoon; Sohn, Jung Min; Park, Junhong; Jeon, Jong-Ki; Kim, Seung-Soo; Park, Young-Kwon


    The steam reforming of benzene as a model compound of biomass gasification tar was carried out over various Ni/metal oxide catalysts. The effects of the support, temperature, Ni-precursor, Ni loading and reaction time were examined, and their catalytic performance was compared with that of a commercial Ni catalyst. Among the Ni/metal oxide catalysts used, 15 wt% Ni/CeO(2)(75%)-ZrO(2)(25%) showed the highest catalytic performance owing to its greater redox characteristics and increased surface area, irrespective of the reaction temperature. The catalytic activity of 15 wt% Ni/CeO(2)(75%)-ZrO(2)(25%) was higher than that of the commercial Ni catalyst. Moreover, the catalyst activity was retained due to its excellent resistance to coke deposition even after 5h. The Ni-precursor played a critical role in the catalytic activity. With the exception of nickel nitrate, all the Ni-precursors (chloride and sulfate) caused deactivation of the catalyst.

  5. Study of interactions between metal ions and protein model compounds by energy decomposition analyses and the AMOEBA force field (United States)

    Jing, Zhifeng; Qi, Rui; Liu, Chengwen; Ren, Pengyu


    The interactions between metal ions and proteins are ubiquitous in biology. The selective binding of metal ions has a variety of regulatory functions. Therefore, there is a need to understand the mechanism of protein-ion binding. The interactions involving metal ions are complicated in nature, where short-range charge-penetration, charge transfer, polarization, and many-body effects all contribute significantly, and a quantitative description of all these interactions is lacking. In addition, it is unclear how well current polarizable force fields can capture these energy terms and whether these polarization models are good enough to describe the many-body effects. In this work, two energy decomposition methods, absolutely localized molecular orbitals and symmetry-adapted perturbation theory, were utilized to study the interactions between Mg2+/Ca2+ and model compounds for amino acids. Comparison of individual interaction components revealed that while there are significant charge-penetration and charge-transfer effects in Ca complexes, these effects can be captured by the van der Waals (vdW) term in the AMOEBA force field. The electrostatic interaction in Mg complexes is well described by AMOEBA since the charge penetration is small, but the distance-dependent polarization energy is problematic. Many-body effects were shown to be important for protein-ion binding. In the absence of many-body effects, highly charged binding pockets will be over-stabilized, and the pockets will always favor Mg and thus lose selectivity. Therefore, many-body effects must be incorporated in the force field in order to predict the structure and energetics of metalloproteins. Also, the many-body effects of charge transfer in Ca complexes were found to be non-negligible. The absorption of charge-transfer energy into the additive vdW term was a main source of error for the AMOEBA many-body interaction energies.

  6. Technique for detecting liquid metal leaks

    International Nuclear Information System (INIS)

    Bauerle, J.E.


    In a system employing flowing liquid metal as a heat transfer medium in contact with tubular members containing a working fluid, i.e., steam, liquid metal leaks through the wall of the tubular member are detected by dislodging the liquid metal compounds forming in the tubular member at the leak locations and subsequently transporting the dislodged compound in the form of an aerosol to a detector responsive to the liquid metal compound. In the application to a sodium cooled tubular member, the detector would consist of a sodium responsive device, such as a sodium ion detector

  7. Metal surface coloration by oxide periodic structures formed with nanosecond laser pulses (United States)

    Veiko, Vadim; Karlagina, Yulia; Moskvin, Mikhail; Mikhailovskii, Vladimir; Odintsova, Galina; Olshin, Pavel; Pankin, Dmitry; Romanov, Valery; Yatsuk, Roman


    In this work, we studied a method of laser-induced coloration of metals, where small-scale spatially periodic structures play a key role in the process of color formation. The formation of such structures on a surface of AISI 304 stainless steel was demonstrated for the 1.06 μm fiber laser with nanosecond duration of pulses and random (elliptical) polarization. The color of the surface depends on the period, height and orientation of periodic surface structures. Adjustment of the polarization of the laser radiation or change of laser incidence angle can be used to control the orientation of the structures. The formation of markings that change their color under the different viewing angles becomes possible. The potential application of the method is metal product protection against falsification.

  8. The concept of virtual material testing and its application to sheet metal forming simulations


    Butz, A.; Pagenkopf, J.; Baiker, M.; Helm, D.


    A crystal plasticity based full-field microstructure simulation approach is used to virtually determine mechanical properties of sheet metals. Microstructural features like the specific grain morphology and the crystallographic texture are taken into account to predict the plastic anisotropy. A special focus is on the determination of the Lankford coefficients and on the yield surface under plane stress conditions. Compared to experimental procedures, virtual material testing allows to genera...

  9. An Assessment of Binary Metallic Glasses: Correlations Between Structure, Glass Forming Ability and Stability (Preprint) (United States)


    P. Predecki, B. C. Giessen, and N. J. Grant, "New metastable alloy phases of gold, silver, and aluminium ," Trans. Metall. Soc. AIME, vol. 233, pp...Res. Inst. Tohoku University (Sendai), vol. 27A, pp. 127-146, 1979. [50] A. Inoue, A. Kitamura, and T. Masumoto, "The effect of aluminium on... hydrides ," J. Non-Cryst. Sol., vol. 53, pp. 105-122, 1982. [180] K. Togano and K. Tachikawa, "Structure and superconductivity of metastable phases in

  10. Tool degradation during sheet metal forming of three stainless steel alloys

    DEFF Research Database (Denmark)

    Wadman, Boel; Nielsen, Peter Søe; Wiklund, Daniel


    degradation was analysed by the strip reduction test, simulating resistance to galling during ironing. It was shown that the surface condition of both the tools and the sheet metal was of importance to the galling resistance. Numerical simulations of the experimental tests were compared with the experimental...... test results. The software program DEFORM™ 3D was used to analyse the pressure and temperature development in the tool/work piece interface during strip reduction....

  11. A unified dislocation density-dependent physical-based constitutive model for cold metal forming (United States)

    Schacht, K.; Motaman, A. H.; Prahl, U.; Bleck, W.


    Dislocation-density-dependent physical-based constitutive models of metal plasticity while are computationally efficient and history-dependent, can accurately account for varying process parameters such as strain, strain rate and temperature; different loading modes such as continuous deformation, creep and relaxation; microscopic metallurgical processes; and varying chemical composition within an alloy family. Since these models are founded on essential phenomena dominating the deformation, they have a larger range of usability and validity. Also, they are suitable for manufacturing chain simulations since they can efficiently compute the cumulative effect of the various manufacturing processes by following the material state through the entire manufacturing chain and also interpass periods and give a realistic prediction of the material behavior and final product properties. In the physical-based constitutive model of cold metal plasticity introduced in this study, physical processes influencing cold and warm plastic deformation in polycrystalline metals are described using physical/metallurgical internal variables such as dislocation density and effective grain size. The evolution of these internal variables are calculated using adequate equations that describe the physical processes dominating the material behavior during cold plastic deformation. For validation, the model is numerically implemented in general implicit isotropic elasto-viscoplasticity algorithm as a user-defined material subroutine (UMAT) in ABAQUS/Standard and used for finite element simulation of upsetting tests and a complete cold forging cycle of case hardenable MnCr steel family.

  12. Thermal, structural, and magnetic studies of metals and intermetallic compounds. Final report

    International Nuclear Information System (INIS)

    Wallace, W.E.; Craig, R.S.; Rao, V.U.S.


    The powerful magnetism of certain intermetallics, e.g., SmCo 5 , has been established to originate with the powerful magnetic anisotropy of SmCo 5 , not its large magnetization. The anisotropy is, in turn, a crystal field effect. The crystal field interaction has been elucidated by the method of quantum mechanics. Studies of the systems RFe 2 , RFe 3 , RCo 3 , and R 2 Co 7 (R = a rare earth, Y or Th) reveals them to be important for hydrogen storage. In addition, important effects associated with hydrogenation of metals have been found--great enhancement of magnetization of certain systems (e.g., ErFe 2 ) and substantial increase in superconducting transition temperatures (e.g., Zr/sub .5/H/sub .5/V 2 ). Results of studies suggest that the surfaces of rare earth intermetallics are atypical. The spectrum of properties exhibited by the rare earth intermetallics suggests their utility in the efficient capture and storage of solar energy and the use of it for powering a vehicle. These aspects of the systems warrant further attention

  13. Irradiations of a metallic layer compound: the di-chalcogenide 1T-TaS2

    International Nuclear Information System (INIS)

    Mutka, Hannu


    The effects of electron irradiation defects in 1T-TaS 2 have been studied by measuring the resistivity, the Hall effect and the lattice parameters as well as by electron diffraction which reveals the periodic lattice distortion due to charge density waves (CDW). Only the displacements of the tantalum atoms produce defects that are stable at room temperature. The ones of them between the layers of the crystal structure make it locally more isotropic: the average distance between the layers decreases. The defects do not destroy the CDW but pin its phase; this hinders the ordering of the CDW. As the low temperature commensurate phase of the CDW is suppressed the material changes its behaviour from semiconducting (resistivity 1 Ωcm, Hall constant 8 cm 3 /C at 10 K) to a metallic one (10 3 Ωcm, 5.10 -3 cm 3 /C). At higher defect concentrations a localization of change carriers occurs and once again the resistivity diverges at temperatures approaching zero. (author) [fr

  14. Hypervalent Compounds as Ligands: I 3 -Anion Adducts with Transition Metal Pentacarbonyls

    KAUST Repository

    Rogachev, Andrey Yu.


    Just a couple of transition metal complexes of the familiar triiodide anion are known. To investigate the bonding in these, as well as isomeric possibilities, we examined theoretically adducts of I3 - with model organometallic fragments, [Cr(CO)5] and [Mn(CO) 5]+. Bonding energy computations were augmented by a Natural Bond Orbital (NBO) perturbation theory analysis and Energy Decomposition Analysis (EDA). The bonding between I3 - and the organometallic fragment is substantial, especially for the electrostatically driven anion-cation case. "End-on" coordination is favored by 5-13 kcal/mol over "side-on" (to the central I of I3 -), with a ∼10 kcal/mol barrier for isomerization. A developing asymmetry in the I-I bonding of "end-on" coordinated I 3 - led us to consider in some detail the obvious fragmentation to a coordinated I- and free I2. While the signs of incipient fragmentation in that direction are there, these is a definite advantage to maintaining some I- to I2 bonding in triiodide complexes. © 2013 American Chemical Society.

  15. Monitoring of metals, organic compounds and coliforms in water catchment points from the Sinos River basin. (United States)

    Nascimento, C A; Staggemeier, R; Bianchi, E; Rodrigues, M T; Fabres, R; Soliman, M C; Bortoluzzi, M; Luz, R B; Heinzelmann, L S; Santos, E L; Fleck, J D; Spilki, F R


    Unplanned use and occupation of the land without respecting its capacity of assimilation and environmental purification leads to the degradation of the environment and of water used for human consumption. Agricultural areas, industrial plants and urban centres developed without planning and the control of effluent discharges are the main causes of water pollution in river basins that receive all the liquid effluents produced in those places. Over the last decades, environmental management has become part of governmental agendas in search of solutions for the preservation of water quality and the restoration of already degraded resources. This study evaluated the conditions of the main watercourse of the Sinos River basin by monitoring the main physical, chemical and microbiological parameters described in the CONAMA Resolution no. 357/2005.The set of parameters evaluated at five catchment points of water human consumption revealed a river that has different characteristics in each reach, as the upper reach was class 1, whereas the middle and lower reaches of the basin were class 4. Monitoring pointed to households as the main sources of pollutants in those reaches, although metals used in the industrial production of the region were found in the samples analyzed.


    Elger, G.W.; Boubel, R.W.


    This patent deals with a process of producing pure Hf metal from oxygen- contaminated gaseous Hf chloride. The oxygen compounds in the chioride gas are halogenated by contacting the gas at elevated temperature with Cl/sub 2/ in the presence of C. The Hf chloride, still in gaseous form, is contacted with molten Mg whereby Hf metal is formed and condensed on the Mg. (AEC)

  17. Proton and metal ion binding to natural organic polyelectrolytes-I. Studies with synthetic model compounds (United States)

    Marinsky, J.A.; Reddy, M.M.


    A unified physico-chemical model, based on a modified Henderson-Hasselbalch equation, for the analysis of ion complexation reactions involving charged polymeric systems is presented and verified. In this model pH = pKa+p(??Ka) + log(??/1 - ??) where Ka is the intrinsic acid dissociation constant of the ionizable functional groups on the polymer, ??Ka is the deviation of the intrinsic constant due to electrostatic interaction between the hydrogen ion and the polyanion, and alpha (??) is the polyacid degree of ionization. Using this approach pKa values for repeating acidic units of polyacrylic (PAA) and polymethacrylic (PMA) acids were found to be 4.25 ?? 0.03 and 4.8 ?? 0.1, respectively. The polyion electrostatic deviation term derived from the potentiometric titration data (i.e. p(??Ka)) is used to calculate metal ion concentration at the complexation site on the surface of the polyanion. Intrinsic cobalt-polycarboxylate binding constants (7.5 for PAA and 5.6 for PMA), obtained using this procedure, are consistent with the range of published binding constants for cobalt-monomer carboxylate complexes. In two phase systems incorporation of a Donnan membrane potential term allows determination of the intrinsic pKa of a cross-linked PMA gel, pKa = 4.83, in excellent agreement with the value obtained for the linear polyelectrolyte and the monomer. Similarly, the intrinsic stability constant for cobalt ion binding to a PMA-gel (??CoPMA+ = 11) was found to be in agreement with the linear polyelectrolyte analogue and the published data for cobalt-carboxylate monodentate complexes. ?? 1984.

  18. Metals, organic compounds, and nutrients in Long Island Sound: sources, magnitudes, trends, and impacts (United States)

    Mullaney, John R.; Varekamp, J.C.; MCElroy, A.E.; Brsslin, V.T.


    Long Island Sound (LIS) is a relatively shallow estuary with a mean depth of 20 m (maximum depth 49 m) and a unique hydrology and history of pollutant loading. Those factors have contributed to a wide variety of contamination problems in its muddy sediments, aquatic life and water column. The LIS sediments are contaminated with a host of legacy and more recently released toxic compounds and elements related to past and present wastewater discharges and runoff. These include non-point and storm water runoff and groundwater discharges, whose character has changed over the years along with the evolution of its watershed and industrial history. Major impacts have resulted from the copious amounts of nutrients discharged into LIS through atmospheric deposition (N), domestic and industrial waste water flows, fertilizer releases, and urban runoff. All these sources and their effects are in essence the result of human presence and activities in the watershed, and the severity of pollutant loading and their impacts generally scales with total population in the watersheds surrounding LIS. Environmental legislation passed since the mid-to late 1900s (e.g., Clean Air Act, Clean Water Act) has had a beneficial effect, however, and contaminant loadings for many toxic organic and inorganic chemicals and nutrients have diminished over the last few decades (O’Shea and Brosnan 2000; Trench, et al, 2012; O’Connor and Lauenstein 2006; USEPA 2007). Major strides have been made in reducing the inflow of nutrients into LIS, but cultural eutrophication is still an ongoing problem and nutrient control efforts will need to continue. Nonetheless, LIS is still a heavily human impacted estuary (an ‘Urban Estuary’, as described for San Francisco Bay by Conomos, 1979), and severe changes in water quality and sediment toxicity as well as ecosystem shifts have been witnessed over the relatively short period since European colonization in the early 1600s (Koppelman et al., 1976).

  19. The storage of hydrogen in the form of metal hydrides: An application to thermal engines (United States)

    Gales, C.; Perroud, P.


    The possibility of using LaNi56, FeTiH2, or MgH2 as metal hydride storage sytems for hydrogen fueled automobile engines is discussed. Magnesium copper and magnesium nickel hydrides studies indicate that they provide more stable storage systems than pure magnesium hydrides. Several test engines employing hydrogen fuel have been developed: a single cylinder motor originally designed for use with air gasoline mixture; a four-cylinder engine modified to run on an air hydrogen mixture; and a gas turbine.

  20. Development of hafnium metal and titanium-hafnium alloys having apatite-forming ability by chemical surface modification. (United States)

    Miyazaki, Toshiki; Sueoka, Masaya; Shirosaki, Yuki; Shinozaki, Nobuya; Shiraishi, Takanobu


    Hafnium (Hf) has attracted considerable attention as a component of biomedical titanium (Ti) alloys with low Young's moduli and/or shape-memory functionalities, because its cytotoxicity is as low as that of Ti. The drawback of metals is that their bone-bonding ability is generally low. It is known that apatite formation in the body is a prerequisite for bone-bonding. Although several chemical treatments have been proposed for preparing Ti for bone-bonding, there have been no similar investigations for Hf. In the present study, NaOH- and heat-treatments were applied to pure Hf and Ti-Hf alloys and their bone-bonding ability was assessed in vitro with the use of simulated body fluid (SBF). After NaOH- and heat-treatments, anatase formed on alloys with low Hf content (20-40% (atom%) Hf); mixtures of sodium titanate and hafnium titanate formed on alloys with similar Ti and Hf content (60% Hf); and hafnium oxide formed on alloys with high Hf content (80% Hf and pure Hf). Precipitates of apatite were observed on all the metals in SBF, except for the alloy with 60% Hf. We speculated that the hafnium titanate formed on this alloy had a low apatite-forming ability owing to its high negative surface charge, which inhibited P adsorption. The apatite-forming abilities of the Ti-Hf alloys strongly depended on their Hf content. The present results indicate that Hf-based materials have good potential for bone-bonding. © 2017 Wiley Periodicals, Inc. J Biomed Mater Res Part B: Appl Biomater, 2017. © 2017 Wiley Periodicals, Inc.

  1. A New Approach for Handling of Micro Parts in Bulk Metal Forming

    DEFF Research Database (Denmark)

    Mahshid, Rasoul; Hansen, Hans Nørgaard; Arentoft, M.


    During last 10 years a lot of research has been done in micro forming processes. In spite of the challenges micro forming has in process, material properties, tooling technology and machines, micro forming technology yields remarkable accuracy and good mechanical properties with high rate...... of production [1]. This can fulfill the demands for mass production and miniaturization in industries and academic communities. According to the recent studies, topics related to materials, process and simulation have been investigated intensively and well documented. Machines, forming tools and handling...... is required. The handling system for micro parts should provide good precision and reproducibility with high speed and acceleration for gripping and positioning micro parts in the right place within few micron tolerances. Nowadays, many handling systems have been developed; either the conventional systems...

  2. Forming Limits of Weld Metal in Aluminum Alloys and Advanced High-Strength Steels

    Energy Technology Data Exchange (ETDEWEB)

    Stephens, Elizabeth V.; Smith, Mark T.; Grant, Glenn J.; Davies, Richard W.


    This work characterizes the mechanical properties of DP600 laser welded TWBs (1 mm-1.5 mm) near and in the weld, as well as their limits of formability. The approach uses simple uniaxial experiments to measure the variability in the forming limits of the weld region, and uses a theoretical forming limit diagram calculation to establish a probabilistic distribution of weld region imperfection using an M-K method approach

  3. Studies of dissolution solutions of ruthenium metal, oxide and mixed compounds in nitric acid

    Energy Technology Data Exchange (ETDEWEB)

    Mousset, F.; Eysseric, C.; Bedioui, F


    Ruthenium is one of the fission products generated by irradiated nuclear fuel. It is present throughout all the steps of nuclear fuel reprocessing-particularly during extraction-and requires special attention due to its complex chemistry and high {beta}{gamma} activity. An innovative electro-volatilization process is now being developed to take advantage of the volatility of RuO{sub 4} in order to eliminate it at the head end of the Purex process and thus reduce the number of extraction cycles. Although the process operates successfully with synthetic nitrato-RuNO{sup 3+} solutions, difficulties have been encountered in extrapolating it to real-like dissolution solutions. In order to better approximate the chemical forms of ruthenium found in fuel dissolution solutions, kinetic and speciation studies on dissolved species were undertaken with RuO{sub 2},xH{sub 2}O and Ru{sup 0} in nitric acid media. (authors)

  4. Studies of dissolution solutions of ruthenium metal, oxide and mixed compounds in nitric acid

    International Nuclear Information System (INIS)

    Mousset, F.; Eysseric, C.; Bedioui, F.


    Ruthenium is one of the fission products generated by irradiated nuclear fuel. It is present throughout all the steps of nuclear fuel reprocessing-particularly during extraction-and requires special attention due to its complex chemistry and high βγ activity. An innovative electro-volatilization process is now being developed to take advantage of the volatility of RuO 4 in order to eliminate it at the head end of the Purex process and thus reduce the number of extraction cycles. Although the process operates successfully with synthetic nitrato-RuNO 3+ solutions, difficulties have been encountered in extrapolating it to real-like dissolution solutions. In order to better approximate the chemical forms of ruthenium found in fuel dissolution solutions, kinetic and speciation studies on dissolved species were undertaken with RuO 2 ,xH 2 O and Ru 0 in nitric acid media. (authors)

  5. Focused ion beam and field-emission microscopy of metallic filaments in memory devices based on thin films of an ambipolar organic compound consisting of oxadiazole, carbazole, and fluorene units (United States)

    Pearson, Christopher; Bowen, Leon; Lee, Myung Won; Fisher, Alison L.; Linton, Katherine E.; Bryce, Martin R.; Petty, Michael C.


    We report on the mechanism of operation of organic thin film resistive memory architectures based on an ambipolar compound consisting of oxadiazole, carbazole, and fluorene units. Cross-sections of the devices have been imaged by electron microscopy both before and after applying a voltage. The micrographs reveal the growth of filaments, with diameters of 50 nm–100 nm, on the metal cathode. We suggest that these are formed by the drift of aluminium ions from the anode and are responsible for the observed switching and negative differential resistance phenomena in the memory devices.

  6. Wastewater parameters after the process of phosphorus compounds removal by the metal dissolution method in comparison with precipitation and electrocoagulation methods


    Wysocka Izabela


    Precipitation methods are commonly used for removing phosphorus compounds from wastewater. Chemical precipitation method, based on adding iron, aluminium or calcium salts to the treated wastewater, is often used. Another possible way of precipitating phosphates is metal dissolution method, which is presented in this paper. The main difference between these two methods is how the phosphate precipitating ions are introduced to the wastewater.

  7. An azobenzene-containing metal-organic framework as an efficient heterogeneous catalyst for direct amidation of benzoic acids: synthesis of bioactive compounds. (United States)

    Hoang, Linh T M; Ngo, Long H; Nguyen, Ha L; Nguyen, Hanh T H; Nguyen, Chung K; Nguyen, Binh T; Ton, Quang T; Nguyen, Hong K D; Cordova, Kyle E; Truong, Thanh


    An azobenzene-containing zirconium metal-organic framework was demonstrated to be an effective heterogeneous catalyst for the direct amidation of benzoic acids in tetrahydrofuran at 70 °C. This finding was applied to the synthesis of several important, representative bioactive compounds.

  8. A metal-organic framework-templated synthesis of γ-Fe2O3 nanoparticles encapsulated in porous carbon for efficient and chemoselective hydrogenation of nitro compounds. (United States)

    Li, Yang; Zhou, Yu-Xiao; Ma, Xiao; Jiang, Hai-Long


    The γ-Fe2O3 nanoparticles well dispersed in porous carbon were fabricated via a Fe-based metal-organic framework-templated pyrolysis. The resultant product exhibits excellent catalytic activity, chemoselectivity and magnetic recyclability for the hydrogenation of diverse nitro compounds under mild conditions.

  9. Dynamical, structural and chemical heterogeneities in a binary metallic glass-forming liquid (United States)

    Puosi, F.; Jakse, N.; Pasturel, A.


    As it approaches the glass transition, particle motion in liquids becomes highly heterogeneous and regions with virtually no mobility coexist with liquid-like domains. This complex dynamic is believed to be responsible for different phenomena including non-exponential relaxation and the breakdown of the Stokes-Einstein relation. Understanding the relationships between dynamical heterogeneities and local structure in metallic liquids and glasses is a major scientific challenge. Here we use classical molecular dynamics simulations to study the atomic dynamics and microscopic structure of Cu50Zr50 alloy in the supercooling regime. Dynamical heterogeneities are identified via an isoconfigurational analysis. We demonstrate the transition from isolated to clustering low mobility with decreasing temperature. These slow clusters, whose sizes grow upon cooling, are also associated with concentration fluctuations, characterized by a Zr-enriched phase, with a composition CuZr2 . In addition, a structural analysis of slow clusters based on Voronoi tessellation evidences an increase with respect of the bulk system of the fraction of Cu atoms having a local icosahedral order. These results are in agreement with the consolidated scenario of the relevant role played by icosahedral order in the dynamic slowing-down in supercooled metal alloys.

  10. UN2−x layer formed on uranium metal by glow plasma nitriding

    International Nuclear Information System (INIS)

    Long, Zhong; Hu, Yin; Chen, Lin; Luo, Lizhu; Liu, Kezhao; Lai, Xinchun


    Highlights: • We used a very simple method to prepare nitride layer on uranium metal surface. • This modified layer is nitrogen-rich nitride, which should be written as UN 2−x . • TEM images show the nitride layer is composed of nano-sized grains. • XPS analysis indicates there is uranium with abnormal low valence in the nitride. - Abstract: Glow plasma nitriding is a simple and economical surface treatment method, and this technology was used to prepare nitride layer on the surface of uranium metal with thickness of several microns. The composition and structure of the nitride layer were analyzed by AES and XRD, indicating that this modified layer is nitrogen-rich uranium nitride, which should be written as UN 2−x . TEM images show the nitride layer is composed of nano-sized grains, with compact structure. And XPS analysis indicates there is uranium with abnormal low valence existing in the nitride. After the treated uranium storage in air for a long time, oxygen just entered the surface several nanometers, showing the nitride layer has excellent oxidation resistance. The mechanism of nitride layer formation and low valence uranium appearance is discussed

  11. Complex-forming organic ligands in cloud-point extraction of metal ions: a review. (United States)

    Pytlakowska, K; Kozik, V; Dabioch, M


    Cloud-point extraction (CPE), an easy, safe, environmentally friendly, rapid and inexpensive methodology for preconcentration and separation of trace metals from aqueous solutions has recently become an attractive area of research and an alternative to liquid-liquid extraction. Moreover, it provides results comparable to those obtained with other separation techniques and has a greater potential to be explored in improving detection limits and other analytical characteristics over other methods. A few reviews have been published covering different aspects of the CPE procedure and its relevant applications, such as the phenomenon of clouding, the application in the extraction of trace inorganic and organic materials, as well as pesticides and protein substrates from different sources, or incorporation of CPE into an FIA system. This review focuses on general properties of the most frequently used organic ligands in cloud-point extraction and on literature data (from 2000 to 2012) concerning the use of modern techniques in determination of metal ions' content in various materials. The article is divided according to the class of organic ligands to be used in CPE. Copyright © 2013 Elsevier B.V. All rights reserved.

  12. UN{sub 2−x} layer formed on uranium metal by glow plasma nitriding

    Energy Technology Data Exchange (ETDEWEB)

    Long, Zhong [China Academy of Engineering Physics, P.O. Box 919-71, Mianyang 621907 (China); Hu, Yin [Science and Technology on Surface Physics and Chemistry Laboratory, P.O. Box 718-35, Mianyang 621907 (China); Chen, Lin [China Academy of Engineering Physics, P.O. Box 919-71, Mianyang 621907 (China); Luo, Lizhu [Science and Technology on Surface Physics and Chemistry Laboratory, P.O. Box 718-35, Mianyang 621907 (China); Liu, Kezhao, E-mail: [Science and Technology on Surface Physics and Chemistry Laboratory, P.O. Box 718-35, Mianyang 621907 (China); Lai, Xinchun, E-mail: [Science and Technology on Surface Physics and Chemistry Laboratory, P.O. Box 718-35, Mianyang 621907 (China)


    Highlights: • We used a very simple method to prepare nitride layer on uranium metal surface. • This modified layer is nitrogen-rich nitride, which should be written as UN{sub 2−x}. • TEM images show the nitride layer is composed of nano-sized grains. • XPS analysis indicates there is uranium with abnormal low valence in the nitride. - Abstract: Glow plasma nitriding is a simple and economical surface treatment method, and this technology was used to prepare nitride layer on the surface of uranium metal with thickness of several microns. The composition and structure of the nitride layer were analyzed by AES and XRD, indicating that this modified layer is nitrogen-rich uranium nitride, which should be written as UN{sub 2−x}. TEM images show the nitride layer is composed of nano-sized grains, with compact structure. And XPS analysis indicates there is uranium with abnormal low valence existing in the nitride. After the treated uranium storage in air for a long time, oxygen just entered the surface several nanometers, showing the nitride layer has excellent oxidation resistance. The mechanism of nitride layer formation and low valence uranium appearance is discussed.

  13. Development of oil canning index model for sheet metal forming products with large curvature (United States)

    Kim, Honglae; Lee, Seonggi; Murugesan, Mohanraj; Hong, Seokmoo; Lee, Shanghun; Ki, Juncheol; Jung, Hunchul; Kim, Naksoo


    Oil canning is predominantly caused by unequal stretches and heterogeneous stress distributions in steel sheets, which affects the appearance of components and develop noise and vibration problems. This paper proposes the formulation of an Oil canning index (OCI) model that can predict the occurrence of oil canning in the sheet metal. To investigate the influence of material properties, we used electro-galvanized (EGI) and galvanized (GI) steel sheets with different thicknesses and processing conditions. Furthermore, this paper presents an appropriate experimental and numerical procedure for determining the sheet stiffness and indentation properties to evaluate the oil canning results. Experiments were carried out by varying the tensile force over different materials, thicknesses, and bead force. Comparison of the discrete results obtained from these experiments confirmed that the product shape characteristics, such as curvature, have a significant influence on the oil canning occurrence. Based on the results, we propose the new OCI model, which can effectively predict the oil canning occurrence owing to the shape curvature. Verification of the accuracy and usability of our model has been carried out by simulating the experiments that were done with the sheet metal. The authors observed a good agreement between the experimental and numerical results from the model. This research work can be considered as a very effective method for eliminating appearance defects from the automobile products.

  14. Development of an in-plane biaxial test for forming limit curve (FLC) characterization of metallic sheets

    International Nuclear Information System (INIS)

    Zidane, I; Guines, D; Léotoing, L; Ragneau, E


    The main objective of this work is to propose a new experimental device able to give for a single specimen a good prediction of rheological parameters and formability under static and dynamic conditions (for intermediate strain rates). In this paper, we focus on the characterization of sheet metal forming. The proposed device is a servo-hydraulic testing machine provided with four independent dynamic actuators allowing biaxial tensile tests on cruciform specimens. The formability is evaluated thanks to the classical forming limit diagram (FLD), and one of the difficulties of this study was the design of a dedicated specimen for which the necking phenomenon appears in its central zone. If necking is located in the central zone of the specimen, then the speed ratio between the two axes controls the strain path in this zone and a whole forming limit curve can be covered. Such a specimen is proposed through a numerical and experimental validation procedure. A rigorous procedure for the detection of numerical and experimental forming strains is also presented. Finally, an experimental forming limit curve is determined and validated for an aluminium alloy dedicated to the sheet forming processes (AA5086)

  15. Experimental research and numerical optimisation of multi-point sheet metal forming implementation using a solid elastic cushion system (United States)

    Tolipov, A. A.; Elghawail, A.; Shushing, S.; Pham, D.; Essa, K.


    There is a growing demand for flexible manufacturing techniques that meet the rapid changes in customer needs. A finite element analysis numerical optimisation technique was used to optimise the multi-point sheet forming process. Multi-point forming (MPF) is a flexible sheet metal forming technique where the same tool can be readily changed to produce different parts. The process suffers from some geometrical defects such as wrinkling and dimpling, which have been found to be the cause of the major surface quality problems. This study investigated the influence of parameters such as the elastic cushion hardness, blank holder force, coefficient of friction, cushion thickness and radius of curvature, on the quality of parts formed in a flexible multi-point stamping die. For those reasons, in this investigation, a multipoint forming stamping process using a blank holder was carried out in order to study the effects of the wrinkling, dimpling, thickness variation and forming force. The aim was to determine the optimum values of these parameters. Finite element modelling (FEM) was employed to simulate the multi-point forming of hemispherical shapes. Using the response surface method, the effects of process parameters on wrinkling, maximum deviation from the target shape and thickness variation were investigated. The results show that elastic cushion with proper thickness and polyurethane with the hardness of Shore A90. It has also been found that the application of lubrication cans improve the shape accuracy of the formed workpiece. These final results were compared with the numerical simulation results of the multi-point forming for hemispherical shapes using a blank-holder and it was found that using cushion hardness realistic to reduce wrinkling and maximum deviation.

  16. Characterization of the metal-semiconductor interface of gold contacts on CdZnTe formed by electroless deposition (United States)

    Bell, Steven J.; Baker, Mark A.; Duarte, Diana D.; Schneider, Andreas; Seller, Paul; Sellin, Paul J.; Veale, Matthew C.; Wilson, Matthew D.


    Fully spectroscopic x/γ-ray imaging is now possible thanks to advances in the growth of wide-bandgap semiconductors. One of the most promising materials is cadmium zinc telluride (CdZnTe or CZT), which has been demonstrated in homeland security, medical imaging, astrophysics and industrial analysis applications. These applications have demanding energy and spatial resolution requirements that are not always met by the metal contacts deposited on the CdZnTe. To improve the contacts, the interface formed between metal and semiconductor during contact deposition must be better understood. Gold has a work function closely matching that of high resistivity CdZnTe and is a popular choice of contact metal. Gold contacts are often formed by electroless deposition however this forms a complex interface. The prior CdZnTe surface preparation, such as mechanical or chemo-mechanical polishing, and electroless deposition parameters, such as gold chloride solution temperature, play important roles in the formation of the interface and are the subject of the presented work. Techniques such as focused ion beam (FIB) cross section imaging, transmission electron microscopy (TEM), energy dispersive x-ray spectroscopy (EDS), x-ray photoelectron spectroscopy (XPS) and current  -  voltage (I-V) analysis have been used to characterize the interface. It has been found that the electroless reaction depends on the surface preparation and for chemo-mechanically polished (1 1 1) CdZnTe, it also depends on the A/B face identity. Where the deposition occurred at elevated temperature, the deposited contacts were found to produce a greater leakage current and suffered from increased subsurface voiding due to the formation of cadmium chloride.

  17. Phenolic compound contents and antioxidant activity in plants with nutritional and/or medicinal properties form the Peruvian Andean region

    NARCIS (Netherlands)

    Chirinos, R.; Pedreschi Plasencia, R.P.; Rogez, H.


    Total phenolic compounds (TPC) and antioxidant activities using different assays (DPPH, ABTS and ORAC) in fruits, grains, leaves, seeds, roots and tubers from 27 different Peruvian Andean plants used in folk medicine or/and as food by the native population were evaluated in order to use these as

  18. Inclusion Compound Based Approach to Forming Arrays of Artificial Dipolar Molecular Rotors: A Search for Optimal Rotor Structures

    Czech Academy of Sciences Publication Activity Database

    Kobr, L.; Zhao, K.; Shen, X.; Shoemaker, R. K.; Rogers, C. T.; Michl, Josef


    Roč. 25, č. 3 (2013), s. 443-448 ISSN 0935-9648 EU Projects: European Commission(XE) 227756 - DIPOLAR ROTOR ARRAY Grant - others:NSF(US) CHE 0848663 Institutional support: RVO:61388963 Keywords : inclusion compounds * molecular rotors * ferroelectricity * two-dimensional arrays Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 15.409, year: 2013

  19. Simultaneous estimation of Ofloxacin and Cefixime in tablet form in presence of the inactive Ofloxacin USP Related compound A

    Directory of Open Access Journals (Sweden)

    Lobna A. Hussein


    The suggested method was validated in compliance with the ICH guidelines and was successfully applied for the quantification of Ofloxacin, Cefixime and Ofloxacin Related compound A in their commercial tablets. The method was also statistically compared to reference methods with no significant differences in performance.

  20. Spin Forming Aluminum Crew Module (CM) Metallic Aft Pressure Vessel Bulkhead (APVBH) - Phase II (United States)

    Hoffman, Eric K.; Domack, Marcia S.; Torres, Pablo D.; McGill, Preston B.; Tayon, Wesley A.; Bennett, Jay E.; Murphy, Joseph T.


    The principal focus of this project was to assist the Multi-Purpose Crew Vehicle (MPCV) Program in developing a spin forming fabrication process for manufacture of the Orion crew module (CM) aft pressure vessel bulkhead. The spin forming process will enable a single piece aluminum (Al) alloy 2219 aft bulkhead resulting in the elimination of the current multiple piece welded construction, simplify CM fabrication, and lead to an enhanced design. Phase I (NASA TM-2014-218163 (1)) of this assessment explored spin forming the single-piece CM forward pressure vessel bulkhead. The Orion MPCV Program and Lockheed Martin (LM) recently made two critical decisions relative to the NESC Phase I work scope: (1) LM selected the spin forming process to manufacture a single-piece aft bulkhead for the Orion CM, and (2) the aft bulkhead will be manufactured from Al 2219. Based on the Program's new emphasis related to the spin forming process, the NESC was asked to conduct a Phase II assessment to assist in the LM manufacture of the aft bulkhead and to conduct a feasibility study into spin forming the Orion CM cone. This activity was approved on June 19, 2013. Dr. Robert Piascik, NASA Technical Fellow for Materials at the Langley Research Center (LaRC), was selected to lead this assessment. The project plan was approved by the NASA Engineering and Safety Center (NESC) Review Board (NRB) on July 18, 2013. The primary stakeholders for this assessment were the NASA and LM MPCV Program offices. Additional benefactors are commercial launch providers developing CM concepts.