WorldWideScience

Sample records for hexagonal phase formation

  1. Hexagonal phase based gel-emulsion (O/H1 gel-emulsion): formation and rheology.

    Science.gov (United States)

    Alam, Mohammad Mydul; Aramaki, Kenji

    2008-11-04

    The formation, stability, and rheological behavior of a hexagonal phase based gel-emulsion (O/H1 gel-emulsion) have been studied in water/C12EO8/hydrocarbon oil systems. A partial phase behavior study indicates that the oil nature has no effect on the phase sequences in the ternary phase diagram of water/C12EO8/oil systems but the domain size of the phases or the oil solubilization capacity considerably changes with oil nature. Excess oil is in equilibrium with the hexagonal phase (H1) in the ternary phase diagram in the H1+O region. The O/H1 gel-emulsion was prepared (formation) and kept at 25 degrees C to check stability. It has been found that the formation and stability of the O/H1 gel-emulsion depends on the oil nature. After 2 min observation (formation), the results show that short chain linear hydrocarbon oils (heptane, octane) are more apt to form a O/H1 gel-emulsion compared to long chain linear hydrocarbon oils (tetradecane, hexadecane), though the stability is not good enough in either system, that is, oil separates within 24 h. Nevertheless, the formation and stability of the O/H1 gel-emulsion is appreciably increased in squalane and liquid paraffin. It is surmised that the high transition temperature of the H1+O phase and the presence of a bicontinuous cubic phase (V1) might hamper the formation of a gel-emulsion. It has been pointed out that the solubilization of oil in the H1 phase could be related to emulsion stability. On the other hand, the oil nature has little or no effect on the formation and stability of a cubic phase based gel-emulsion (O/I1 gel-emulsion). From rheological measurements, it has found that the rheogram of the O/H1 gel-emulsion indicates gel-type structure and shows shear thinning behavior similar to the case of the O/I1 gel-emulsion. Rheological data infer that the O/I1 gel-emulsion is more viscous than the O/H1 gel-emulsion at room temperature but the O/H1 gel-emulsion shows consistency at elevated temperature.

  2. Glycerol effects on the formation and rheology of hexagonal phase and related gel emulsion.

    Science.gov (United States)

    Alam, Mohammad Mydul; Aramaki, Kenji

    2009-08-15

    We have investigated the effects of glycerol on the formation and rheology of hexagonal phase (H(1)) and related O/H(1) gel emulsion in the water/C(12)EO(8)/dodecane system at 25 degrees C. It has been found that the aqueous solution of C(12)EO(8) forms H(1) phase, which could solubilize some amounts of dodecane. Beyond the solubilization limit, oil is separated and a two-phase region or H(1)+O phase appeared. Due to high viscosity of the H(1) phase, allows forming O/H(1) gel emulsion at the H(1)+O region. Rheological measurements (without glycerol) have shown that the rheogram of the H(1) phase does not change drastically with the addition of oil but the system is shifted to longer relaxation time. Simultaneously, the values of the absolute value(eta(*)) are found to increase with the addition of oil, which has been described with the neighboring micellar interaction. The rheogram of the O/H(1) gel emulsion shows gel type nature (G'>G'') but the viscosity monotonically decreases with increasing oil content, which could be due to the lower volume fraction of the continuous phase (H(1) phase). Addition of glycerol has brought an order-order transition or the microstructural transition from H(1)-lamellar (L(alpha)) phase, which is manifested from rheology and SAXS measurements. Viscosity of the O/H(1) gel emulsion also decreases with increasing glycerol content. Digital images show the physical appearance of the gel emulsion changes from turbid to transparent, which is depended on the glycerol concentration (since glycerol matches the refractive index of the H(1) phase and dodecane). Structural parameters of the H(1) phase have been evaluated with the help of Bohlin's model and found that the coordination number of the H(1) phase depends not only the oil and glycerol concentrations but also temperature.

  3. Factors controlling phase formation of novel Sr-based Y-type hexagonal ferrite nanoparticles

    Science.gov (United States)

    Tholkappiyan, R.; Vishista, K.; Hamed, Fathalla

    2017-02-01

    New Sr-based Y-type nanocrystalline hexagonal ferrites with a nominal chemical composition of Sr 2Mg 2Fe 12 O 22 (Sr 2Y) were prepared by autocombustion from mixtures of Sr(NO 3) 2, Mg(NO 3) 2ṡ6H 2O and Fe(NO 3) 3ṡ9H 2O. The newly prepared Sr 2Y nanocrystalline particles were characterized by powder X-ray diffraction (XRD). A well crystalline phase of Sr 2Y with hexagonal crystal structure was observed. Fourier transform infrared spectroscopy (FTIR) studies revealed the information about the positions of the ions and their bonds within the lattice structure of the Sr 2Y. The chemical elements and their oxidation states in the Sr 2Y hexaferrites were determined using X-ray photoelectron spectroscopy (XPS). The XRD, FTIR and XPS studies confirmed the formation of Sr 2Mg 2Fe 12 O 22 hexaferrites. The morphology and porosity of the prepared Sr 2Y nanocrystalline Sr 2Y hexaferrite particles were studied by field emission scanning electron microscopy. The magnetic properties of Sr 2Y hexaferrites showed dependence on the methods of preparation conditions and calcination treatments. The values of coercivity, saturation magnetization and retentivity were in the range of 21.33-19.66 kA m -1, 42.44- 38.72 emu g -1 and 10.05-13.19 emu g -1 respectively.

  4. Factors controlling phase formation of novel Sr-based Y-type hexagonal ferrite nanoparticles

    Indian Academy of Sciences (India)

    R THOLKAPPIYAN; K VISHISTA; FATHALLA HAMED

    2017-02-01

    New Sr-based Y-type nanocrystalline hexagonal ferrites with a nominal chemical composition of Sr$_2$Mg$_2$Fe$_{12}$O$_{22}$ (Sr$_2$Y) were prepared by autocombustion from mixtures of Sr(NO$_3$)$_2$, Mg(NO$_3$ )$_2$·6H$_2$O and Fe(NO$_3$)$_3$·9H$_2$O. The newly prepared Sr$_2$Y nanocrystalline particles were characterized by powder X-ray diffraction (XRD). A well crystalline phase of Sr$_2$Y with hexagonal crystal structure was observed. Fourier transform infrared spectroscopy (FTIR) studies revealed the information about the positions of the ions and their bonds within the lattice structure of the Sr2Y. The chemical elements and their oxidation states in the Sr$_2$Y hexaferriteswere determined using X-ray photoelectron spectroscopy (XPS). The XRD, FTIR and XPS studies confirmed the formation of Sr$_2$Mg$_2$Fe$_{12}$O$_{22}$ hexaferrites. The morphology and porosity of the prepared Sr$_2$Y nanocrystalline Sr$_2$Y hexaferrite particles were studied by field emission scanning electron microscopy. The magnetic properties of Sr$_2$Y hexaferrites showed dependence on the methods of preparation conditions and calcination treatments. The values of coercivity, saturation magnetization and retentivity were in the range of 21.33–19.66 kA m$^{−1}$, 42.44–38.72 emu g$^{−1}$ and 10.05–13.19 emu g$^{−1}$ respectively.

  5. Effect of molecular weight of triglycerides on the formation and rheological behavior of cubic and hexagonal phase based gel emulsions.

    Science.gov (United States)

    Alam, Mohammad Mydul; Aramaki, Kenji

    2009-08-01

    The effect of triglyceride molecular weight on the formation and rheology of cubic (O/I(1)) and hexagonal (O/H(1)) phase based gel emulsions has been studied in water/C(12)EO(8) systems. It was found that the addition of TDG (1,2,3-tridecanoyl glycerol) in the micellar solution leads to the formation of the I(1) phase, which can solubilize some added oil. From SAXS data, it is revealed that the interlayer spacing (d) and the length of hydrophobic part (r(I)) increase with increasing TDG concentration in the I(1) phase, whereas the effective cross-sectional area (a(s)) decreases. After the oil solubilization limit, the d value remains nearly constant, indicating the I(1)+O phase appears. The high viscosity of the I(1) phase facilitates the formation of the O/I(1) gel emulsion. It has been observed that the formation and stability of the O/I(1) and O/H(1) gel emulsion is highly dependent on the molecular weight of triglycerides, namely, the high molecular weight triglycerides show better performance (formation and stability) compared to the low molecular weight triglycerides. The rheological behavior of the I(1) phase was found to change from viscoelastic to elastic nature with TDG content. The values of the complex viscosity, mid absolute value(eta*) show different trends at different fixed frequencies within the I(1) phase, whereas it decrease monotonically in the O/I(1) gel emulsions. The increasing values of the absolute value(eta*) (at lower frequency) could be due to the neighboring micellar interaction and decreasing values of the absolute value(eta*) in the O/I(1) gel emulsion could relate to the volume fraction of the I(1) phase in the system. It is also figured out that the rheological parameters (elastic modulus, viscous modulus, and absolute value(eta*)) of the O/I(1) the gel emulsion do not depend on the oil nature, whereas the O/H(1) gel emulsion shows oil nature dependency.

  6. Primordial hexagonal phase formation during the bcc dezincification of the {beta} Cu-Zn single crystalline surface: Matrix instabilization and transformation path

    Energy Technology Data Exchange (ETDEWEB)

    Baruj, A. [Centro Atomico Bariloche and Instituto Balseiro, Comision Nacional de Energia Atomica (CNEA), (8400) San Carlos de Bariloche, Rio Negro (Argentina); CONICET (Argentina)], E-mail: baruj@cab.cnea.gov.ar; Granada, M.; Arneodo Larochette, P. [Centro Atomico Bariloche and Instituto Balseiro, Comision Nacional de Energia Atomica (CNEA), (8400) San Carlos de Bariloche, Rio Negro (Argentina); CONICET (Argentina); Sommadossi, S. [F. Ingenieria, U. N. Comahue, Buenos Aires 1400, (8300) Neuquen (Argentina); CONICET (Argentina); Troiani, H.E. [Centro Atomico Bariloche and Instituto Balseiro, Comision Nacional de Energia Atomica (CNEA), (8400) San Carlos de Bariloche, Rio Negro (Argentina); CONICET (Argentina)

    2009-07-29

    Subjecting Cu-Zn samples to annealing under dynamical vacuum produces the evaporation of Zn, a process known as dezincification. Here, we study the phase transitions related to dezincification of Cu-48 at.% Zn (bcc, Beta phase) single crystalline surfaces with residual stresses due to mechanical polishing. In order to identify different steps in the dezincification process of these deformed samples we apply a combination of in situ optical microscopy and transmission electron microscopy (TEM) observations. The former allows us to control and stop the dezincification process at a specific stage of evolution while the latter allows relating surface features with structure and composition changes. Due to dezincification, the formation of an on average 4H hexagonal phase and the fcc equilibrium phase take place. TEM observations show that the bcc to 4H phase transformation occurs by a mechanism of nucleation and growth. In particular, we show evidence of the mechanism of embryo formation for the first time. During the subsequent growth process, the coalescence of transformed zones defines regions in the micron range which after subsequent prolonged dezincification transform to the final fcc equilibrium structure. These experiments provide an insight on the reason for the formation of the non-equilibrium hexagonal phase during the dezincification of electropolished (non-deformed) samples. The new experimental results evidence the heterogeneous character of the dezincification.

  7. Homogeneous precipitation of α-phase Co-Ni hydroxides hexagonal platelets

    Institute of Scientific and Technical Information of China (English)

    Juanjuan Liu; Xuyang Wang; Xiayin Yao; Jun wang; Zhaoping Liu

    2012-01-01

    This paper describes the synthesis of α-phase Co-Ni hydroxides hexagonal platelets through homogeneous precipitation,using hexamethylenetetramine (HMT) or urea as a hydrolytic agent.In the CoCl2-NiCl2-HMT system,pure α-phase can be synthesized at the concentrations of both metal ions higher than 20 mM,while in the CoCl2-NiCl2-urea system,the formation of pure α-phase is independent of the concentrations of the metal ions.When using HMT,monodisperse hexagonal platelets of α-phase Co-Ni hydroxides can be produced in the presence of polyvinylpyrrolidone (PVP).Cyclic voltammogram curve of the hexagonal platelets prepared with HMT demonstrates electrochemical performance superior to that of urea.

  8. Raman study of magnetic phase transitions of hexagonal manganites

    Science.gov (United States)

    Nam, Ji-Yeon; Hien, Nguyen T. M.; Huyen, Nguyen T.; Han, Kiok; Chen, Xiang-Bai; Cheong, S. W.; Lee, D.; Noh, T. W.; Sung, N. H.; Cho, B. K.; Yang, In-Sang

    2014-03-01

    Results of Raman studies of magnetic phase transitions of hexagonal LuMnO3 single crystal and HoMnO3 thin films are compared directly with the results of magnetic measurements. Our results show that the temperature dependent Raman study of magnon scattering provides a simple and accurate method for investigating magnetic phase transitions, especially in HoMnO3 thin films. In single crystal, our optical method provides results as good as magnetization measurements.

  9. Importance of the hexagonal lipid phase in biological membrane organisation

    Directory of Open Access Journals (Sweden)

    Juliette eJouhet

    2013-12-01

    Full Text Available Abstract:Domains are present in every natural membrane. They are characterised by a distinctive protein and/or lipid composition. Their size is highly variable from the nano- to the micrometer scale. The domains confer specific properties to the membrane leading to original structure and function. The determinants leading to domain organisation are therefore important but remain obscure. This review presents how the ability of lipids to organize into hexagonal II or lamellar phases can promote particular local structures within membranes. Since biological membranes are composed of a mixture of lipids, each with distinctive biophysical properties, lateral and transversal sorting of lipids can promote creation of domains inside the membrane through local modulation of the lipid phase. Lipid biophysical properties have been characterized for long based on in vitro analyses using non-natural lipid molecules; their re-examinations using natural lipids might open interesting perspectives on membrane architecture occurring in vivo in various cellular and physiological contexts.

  10. Mechanism of the body-centered cubic--hexagonal close-packed phase transition in iron.

    Science.gov (United States)

    Bassett, W A; Huang, E

    1987-11-06

    The transition from body-centered cubic to hexagonal close-packed phase in iron has been studied in a diamond anvil cell with synchrotron radiation. The hexagonal close-packed phase, when it first appears, has a ratio of lattice parameters that is significantly larger than normal. This is attributed to a displacive mechanism that causes a distortion of the hexagonal close-packed structure in a body-centered cubic matrix. The hexagonal close-packed phase adjacent to a boundary with the body-centered cubic phase is stretched in the c direction and compressed in the a direction when it first forms.

  11. Phase boundary of the hexagonal-prism superconducting network in a magnetic field

    Institute of Scientific and Technical Information of China (English)

    金绍维; 李伟; 易佑民; 甄胜来; 缪胜清

    2002-01-01

    In this paper, we systematically study the phase boundary Tc(H ) of a hexagonal-prism superconducting network inan external magnetic field H of arbitrary magnitude and direction. The result indicates that the phase boundary of thehexagonal-prism superconducting circuit varies more sharply than that of the cubic circuit. The potential applicationsof the hexagonal-prism superconducting circuit are also discussed.

  12. High-pressure Al-rich hexagonal phases-What are their kin?

    DEFF Research Database (Denmark)

    Makovicky, Emil; Olsen, Lars Arnskov

    2008-01-01

    The hexagonal Al-rich high-pressure phases are members of a structural family with the same type of framework composed of double-ribbons of edge-sharing octahedra, but variably occupied trigonal and hexagonal channels. This family includes jaffeite, fluoborite, yeremeyevite, painite, and synthetic...

  13. Design considerations for quasi-phase-matching in doubly resonant lithium niobate hexagonal micro-resonators

    Science.gov (United States)

    Sono, Tleyane J.; Riziotis, Christos; Mailis, Sakellaris; Eason, Robert W.

    2017-09-01

    Fabrication capabilities of high optical quality hexagonal superstructures by chemical etching of inverted ferroelectric domains in lithium niobate platform suggests a route for efficient implementation of compact hexagonal microcavities. Such nonlinear optical hexagonal micro-resonators are proposed as a platform for second harmonic generation (SHG) by the combined mechanisms of total internal reflection (TIR) and quasi-phase-matching (QPM). The proposed scheme for SHG via TIR-QPM in a hexagonal microcavity can improve the efficiency and also the compactness of SHG devices compared to traditional linear-type based devices. A simple theoretical model based on six-bounce trajectory and phase matching conditions was capable for obtaining the optimal cavity size. Furthermore numerical simulation results based on finite difference time domain beam propagation method analysis confirmed the solutions obtained by demonstrating resonant operation of the microcavity for the second harmonic wave produced by TIR-QPM. Design aspects, optimization issues and characteristics of the proposed nonlinear device are presented.

  14. Surface modification-induced phase transformation of hexagonal close-packed gold square sheets

    KAUST Repository

    Fan, Zhanxi

    2015-03-13

    Conventionally, the phase transformation of inorganic nanocrystals is realized under extreme conditions (for example, high temperature or high pressure). Here we report the complete phase transformation of Au square sheets (AuSSs) from hexagonal close-packed (hcp) to face-centered cubic (fcc) structures at ambient conditions via surface ligand exchange, resulting in the formation of (100)f-oriented fcc AuSSs. Importantly, the phase transformation can also be realized through the coating of a thin metal film (for example, Ag) on hcp AuSSs. Depending on the surfactants used during the metal coating process, two transformation pathways are observed, leading to the formation of (100)f-oriented fcc Au@Ag core-shell square sheets and (110)h/(101)f-oriented hcp/fcc mixed Au@Ag nanosheets. Furthermore, monochromated electron energy loss spectroscopy reveals the strong surface plasmon resonance absorption of fcc AuSS and Au@Ag square sheet in the infrared region. Our findings may offer a new route for the crystal-phase and shape-controlled synthesis of inorganic nanocrystals. © 2015 Macmillan Publishers Limited. All rights reserved.

  15. Hexosome and hexagonal phases mediated by hydration and polymeric stabilizer.

    Science.gov (United States)

    Amar-Yuli, Idit; Wachtel, Ellen; Shoshan, Einav Ben; Danino, Dganit; Aserin, Abraham; Garti, Nissim

    2007-03-27

    In this research, we studied the factors that control formation of GMO/tricaprylin/water hexosomes and affect their inner structure. As a stabilizer of the soft particles dispersed in the aqueous phase, we used the hydrophilic nonionic triblock polymer Pluronic 127. We demonstrate how properties of the hexosomes, such as size, structure, and stability, can be tuned by their internal composition, polymer concentration, and processing conditions. The morphology and inner structure of the hexosomes were characterized by small-angle X-ray scattering, cryo-transmission electron microscope, and dynamic light scattering. The physical stability (to creaming, aggregation, and coalescence) of the hexosomes was further examined by the LUMiFuge technique. Two competing processes are presumed to take place during the formation of hexosomes: penetration of water from the continuous phase during dispersion, resulting in enhanced hydration of the head groups, and incorporation of the polymer chains into the hexosome structure while providing a stabilizing surface coating for the dispersed particles. Hydration is an essential stage in lyotropic liquid crystal (LLC) formation. The polymer, on the other hand, dehydrates the lipid heads, thereby introducing disorder into the LLC and reducing the domain size. Yet, a critical minimum polymer concentration is necessary in order to form stable nanosized hexosomes. These competing effects require the attention of those preparing hexosomes. The competition between these two processes can be controlled. At relatively high polymer concentrations (1-1.6 wt % of the total formulation of the soft particles), the hydration process seems to occur more rapidly than polymer adsorption. As a result, smaller and more stable soft particles with high symmetry were formed. On the other hand, when the polymer concentration is fixed at lower levels (<1.0 wt %), the homogenization process encourages only partial polymer adsorption during the dispersion

  16. Mn Nanowhiskers of a Novel Hexagonal Phase Grown from Hydrogen Activated Laves Phase Alloys

    Institute of Scientific and Technical Information of China (English)

    WU Er-Dong; GUO Xiu-Mei

    2008-01-01

    With the aid of hydrogenation/dehydrogenation, nanorod whiskers of transition metal Mn can grow spontaneously from Zr,1-x Ti,x MnCr Laves phase alloys at room temperature. The finding introduces a distinguishingly different element into metal whisker family, and provides a potential technique for fabrication of one-dimensional metal nanostructures. Moreover, it is found that the segregated Mn in whiskers forms a novel hexagonal structure, which partially fulfills the long predicted allotropic form and adds more complexity to the structures of Mn.

  17. Epitaxial relationships for hexagonal-to-cubic phase transition in a block copolymer mixture

    DEFF Research Database (Denmark)

    Schulz, M.F.; Bates, F.S.; Almdal, K.;

    1994-01-01

    Small-angle neutron scattering experiments have revealed an epitaxial relationship between the hexagonal cylinder phase, and a bicontinuous cubic phase with Ia3dBAR space group symmetry, in a poly(styrene)-poly(2-vinylpyridine) diblock copolymer mixture. Proximity to the order-disorder transition...

  18. Formation of long-lived resonances in hexagonal cavities by strong coupling of superscar modes

    Science.gov (United States)

    Song, Qinghai; Ge, Li; Wiersig, Jan; Cao, Hui

    2013-08-01

    The recent progresses in single crystalline wide bandgap hexagonal disk have stimulated intense research attention on pursuing ultraviolet (UV) laser diodes with low thresholds. While whispering-gallery modes based UV lasers have been successfully obtained in GaN, ZnO nanorods, and nanopillars, the reported thresholds are still very high, due to the low-quality (Q) factors of the hexagonal resonances. Here we demonstrate resonances whose Q factors can be more than two orders of magnitude higher than the hexagonal modes, promising the reduction of the energy consumption. The key to our finding is the avoided resonance crossing between superscar states along two sets of nearly degenerated triangle orbits, which leads to the formation of hexagram modes. The mode couplings suppress the field distributions at the corners and the deviations from triangle orbits simultaneously and therefore enhance the Q factors significantly.

  19. Lyotropic hexagonal columnar liquid crystals of large colloidal gibbsite platelets

    NARCIS (Netherlands)

    Mourad, M.C.D.; Petukhov, A.V.; Vroege, G.J.; Lekkerkerker, H.N.W.

    2010-01-01

    We report the formation of hexagonal columnar liquid crystal phases in suspensions of large (570 nm diameter), sterically stabilized, colloidal gibbsite platelets in organic solvent. In thin cells these systems display strong iridescence originating from hexagonally arranged columns that are

  20. Phase transformation in hexagonal ErMnO3 under high pressure

    Science.gov (United States)

    Lin, Chuanlong; Liu, Jing; Li, Xiaodong; Li, Yanchun; Chu, Shenqi; Xiong, Lun; Li, Rui

    2012-12-01

    The pressure-induced phase transition of the hexagonal manganite ErMnO3 has been investigated using the synchrotron x-ray diffraction technique up to 57.6 GPa in a diamond anvil cell. The hexagonal structure exhibits anisotropic compression behavior. The bulk modulus (B0) is 168(3) GPa with B0' = 4.0 (fixed). At room temperature, ErMnO3 undergoes a hexagonal-to-orthorhombic phase transition at ˜20.2 GPa, but coexists with the orthorhombic phase up to the highest pressure of 57.6 GPa. When laser-heated to 1500-2000 K, the hexagonal ErMnO3 transforms to a denser orthorhombic perovskite structure completely at ˜17 GPa, accompanied by ˜11% volume reduction. The distortion and tilts of the octahedra MnO6 in the orthorhombic structure decrease with increasing pressure. The bulk modulus of the orthorhombic structure is 214(4) GPa with B0' = 4.0 (fixed), larger than that of the hexagonal structure. The orthorhombic structure ErMnO3 is stable at least up to ˜45 GPa and can be quenched.

  1. Pivotal surfaces in inverse hexagonal and cubic phases of phospholipids and glycolipids.

    Science.gov (United States)

    Marsh, Derek

    2011-03-01

    Data on the location and dimensions of the pivotal surfaces in inverse hexagonal (H(II)) and inverse cubic (Q(II)) phases of phospholipids and glycolipids are reviewed. This includes the H(II) phases of dioleoyl phosphatidylethanolamine, 2:1 mol/mol mixtures of saturated fatty acids with the corresponding diacyl phosphatidylcholine, and glucosyl didodecylglycerol, and also the Q(II)(230/G) gyroid inverse cubic phases of monooleoylglycerol and glucosyl didodecylglycerol. Data from the inverse cubic phases are largely compatible with those from inverse hexagonal H(II)-phases. The pivotal plane is located in the hydrophobic region, relatively close to the polar-apolar interface. The area per lipid at the pivotal plane is similar in size to lipid cross-sectional areas found in the fluid lamellar phase (L(α)) of lipid bilayers. Copyright © 2011 Elsevier Ireland Ltd. All rights reserved.

  2. Gas-phase synthesis of hexagonal and cubic phases of aluminum nitride: A method and its advantages

    Science.gov (United States)

    Kudyakova, V. S.; Bannikov, V. V.; Elagin, A. A.; Shishkin, R. A.; Baranov, M. V.; Beketov, A. R.

    2016-03-01

    Experimental results obtained in AlN synthesis by the high-temperature gas-phase method and analysis of reaction products phase composition are briefly described. It is demonstrated for the first time that dispersed aluminum nitride can be synthesized by this method from AlF3 in both hexagonal and cubic modifications.

  3. Molecular dynamics modeling of defect formation in many-layer hexagonal boron nitride

    Energy Technology Data Exchange (ETDEWEB)

    Stephani, Kelly A., E-mail: ksteph@illinois.edu [Department of Mechanical Science and Engineering, University of Illinois at Urbana-Champaign, Urbana, IL 61801 (United States); Boyd, Iain D. [Department of Aerospace Engineering, University of Michigan, Ann Arbor, MI 48109 (United States)

    2015-12-15

    Molecular dynamics simulations are conducted to examine lattice defect formation in a hexagonal boron nitride lattice by high-energy xenon ion impact. This work seeks to characterize the production of defects which occur under ion irradiation. Lattice defect formation is first examined in single-layer hexagonal boron nitride. Energetic xenon ions over a range of 10 eV–10 keV are used to randomly impact the central lattice at an angle of 90° (orthogonal to the lattice basal plane). The resulting defects are analyzed for 5000 ion impacts, and results are reported for average single and double vacancy formation per impact. A similar study is conducted for a many-layer hexagonal boron nitride lattice, to assess the influence of additional layers in the formation of point defects as a function of incident ion energy. Ion impacts at both 90° and 45° are examined. The defects formed in the top layer of the many-layer lattice are qualitatively similar to the single layer results, but the presence of the bulk lattice is found to reduce the single vacancy probability in the top-most layer. Point defects are prominent in the lattice sub-layers with increasing ion energy. Orthogonal ion impacts are found to cause the most damage, as measured by the number of vacancy defects produced; the number of vacancies increases linearly with energy, while the number of defects in the oblique impact configuration reaches an asymptotic limit with increasing energy.

  4. Crystallization kinetics in liquid crystals with hexagonal precursor phases by calorimetry

    Energy Technology Data Exchange (ETDEWEB)

    Padmaja, Sunkara; Ajita, Narayanan; Potukuchi, Dakshina Murthy [Dept. of Physics, Jawaharlal Nehru Technological Univ., Kakinada (India); Srinivasulu, Maddasani; Girish, Sriram Ramchandra [Liquid Crystal Research Centre, Koneru Lakshmaiah Coll. of Engineering, Vaddeswaram (India); Pisipati, Venkata Gopala Krishna Murthy [Dept. of Chemistry, Manipal Inst. of Tech. (India)

    2010-08-15

    Design and characterization of Schiff based liquid crystalline nO.m compounds exhibiting hexagonal smectic phases are reported. Crystallization kinetics investigations are carried out in the liquid crystals (LCs) exhibiting hexagonal ordered orthogonal and tilted precursor LC phases by calorimetry. The Avrami theory is referred and results are analyzed. Influence of molecular ordering, structure, and dimensionality of the LC precursor phase on kinetics is studied. Effect of shape and flexibility of the molecule for nucleation and growth processes is investigated. Varying rate of kinetics reflects upon the transit of the system from constant type to independent type of nucleation. The trends in the Avrami parameter b and exponent n suggest sporadic nucleation. Crystal growth is interpreted as heterogeneous permeation of layered domains (or aggregates) formed by needle shaped calamitic molecules. Calorimetric observations at different crystallization temperatures CT and hold time t infer diffusion mediated crystallization. (orig.)

  5. Influence of strontium on the cubic to ordered hexagonal phase transformation in barium magnesium niobate

    Indian Academy of Sciences (India)

    M Thirumal; A K Ganguli

    2000-12-01

    Oxides of the type Ba3–SrMgNb2O9 were synthesized by the solid state route. The = 0 composition (Ba3MgNb2O9) was found to crystallize in a disordered (cubic) perovskite structure when sintered at 1000C. For higher Sr doping ( ≥ 0.5), there was clearly the presence of an ordered hexagonal phase indicated by the growth of superstructure reflections in the powder X-ray diffraction patterns. In all the compositions there was the presence of a minor amount of Ba5–SrNb4O15 phase which increased with Sr substitution up to = 1 and then it remained nearly constant at about 5%. Samples sintered at 1300C showed the hexagonally ordered phase for the entire range of composition (0 ≤ ≤ 3). The degree of ordering being considerably greater than in the 1000C heated samples as evidenced by several superstructure reflections.

  6. Phase-controlled synthesis and magnetic properties of cubic and hexagonal CoO nanocrystals

    Science.gov (United States)

    Qi, Qiongqiong; Chen, Yuanzhi; Wang, Laisen; Zeng, Deqian; Peng, Dong-Liang

    2016-11-01

    We report facile solution approaches for the phase-controlled synthesis of rock-salt cubic CoO (c-CoO) and wurtzite-type hexagonal CoO (h-CoO) nanocrystals. In the syntheses, the cobalt precursor cobalt (II) stearate is decomposed in 1-octadecene at 320 °C, and the crystalline phase of synthesized products depend critically on the amounts of H2O. While the presence of small amounts of H2O promotes the generation of c-CoO, h-CoO is obtained in the absence of H2O. The as-prepared c-CoO nanocrystals exhibit a multi-branched morphology with several short rods growing on the direction interlaced together whereas the h-CoO nanocrystals show a multi-rod structure with several rods growing on the same base facet along the c-axis. The formation mechanisms are discussed on the basis of FTIR spectrometry data and color changes of the reaction mixture. Finally the magnetic properties of as-prepared CoO nanocrystals are measured and the results show that c-CoO nanocrystals are intrinsically antiferromagnetic with a Néel temperature of about 300 K but the antiferromagnetic ordering is not distinct for the h-CoO nanocrystals. Weak ferromagnetic contributions are also observed for both c-CoO and h-CoO nanocrystals with obvious magnetic hysteresis at 5 and 300 K. The uncompensated spins that can be induced by crystalline defects such as cation-vacancy may account for the observed weak ferromagnetism.

  7. Ion-beam-assisted hexagonal diamond formation from C sub 6 sub 0 fullerene

    CERN Document Server

    Zhu, X D; Naramoto, H; Narumi, K; Miyashita, A; Miyashita, K

    2003-01-01

    Ions are commonly believed to be detrimental to diamond growth because of the high degree of lattice disorder induced by ion bombardments. In this paper, we examine the possibility of preparing diamond using thermally evaporated C sub 6 sub 0 and simultaneous bombardment with Ne sup + ions. It is found that the diamonds can be grown on Si wafers in the appropriate substrate temperature and ion energy ranges. Micro-Raman spectroscopy, x-ray diffractometry, and scanning electronic microscopy were employed to characterize the deposited specimen. These measurements provide definite evidence of the structure of nanosized hexagonal diamond. The mechanism responsible for the diamond formation is discussed.

  8. Step-Free GaN Hexagons Grown by Selective-Area Metalorganic Vapor Phase Epitaxy

    Science.gov (United States)

    Akasaka, Tetsuya; Kobayashi, Yasuyuki; Kasu, Makoto

    2009-09-01

    Selective-area metalorganic vapor phase epitaxy of GaN has been investigated using the optimized growth conditions for the layer (Frank-van der Merwe) growth and GaN-template substrates with low dislocation density. The surface of a GaN hexagon with 16-µm diameter has a single wide terrace over almost the whole area (step-free surface), when there are no screw-type dislocations in the finite area. Step-free GaN hexagons grew in the two-dimensional nucleus growth mode and had approximately an eight times lower growth rate than that of a GaN film grown in the step-flow mode under the growth conditions used in this study.

  9. Phase transition and magnetization of a hexagonal prismatic nanoisland with a ferrimagnetic spin configuration

    Science.gov (United States)

    Jiang, Wei; Wang, Ya-Ning

    2017-03-01

    Magnetic properties of a nanoisland with a ferrimagnetic spin configuration, described by the transverse Ising model, are studied by the effective-field theory with correlations. The hexagonal prismatic nanoisland consists of the bilayer with core-shell structure. The phase transition, the magnetization, the susceptibility and the internal energy of the system have been calculated for different values. A lot of novel features, such as the reentrant phenomenon, have been found in the phase transition diagrams of the nanoisland. They are heavily dependent on the exchange coupling, the single-ion anisotropy and the transverse field. These theoretical results may have guiding significance for preparing nanoisland experimentally.

  10. Comparison of Cellular Automaton and Phase Field Models to Simulate Dendrite Growth in Hexagonal Crystals

    Institute of Scientific and Technical Information of China (English)

    2012-01-01

    A cellular automaton (CA)-finite element (FE) model and a phase field (PF)-FE model were used to simulate equiaxed dendritic growth during the solidification of hexagonal metals. In the CA-FE model, the conservation equations of mass and energy were solved in order to calculate the temperature field, solute concentration, and the dendritic growth morphology. CA-FE simulation results showed reasonable agreement with the previously reported experimental data on secondary dendrite arm spacing (SDAS) vs cooling rate. In the PF model, a PF variable was used to distinguish solid and liquid phases similar to the conventional PF models for solidification of pure materials. Another PF variable was considered to determine the evolution of solute concentration. Validation of both models was performed by comparing the simulation results with the analytical model developed by Lipton-Glicksman-Kurz (LGK), showing quantitatively good agreement in the tip growth velocity at a given melt undercooling. Application to magnesium alloy AZ91 (approximated with the binary Mg-8.9 wt% AI) illustrates the difficulty of modeling dendrite growth in hexagonal systems using CA-FE regarding mesh-induced anisotropy and a better performance of PF-FE in modeling multiple arbitrarily-oriented dendrites growth.

  11. Formation and characteristics of AlGaN-based three-dimensional hexagonal nanopyramid semi-polar multiple quantum wells

    Science.gov (United States)

    Tian, Yingdong; Yan, Jianchang; Zhang, Yun; Zhang, Yonghui; Chen, Xiang; Guo, Yanan; Wang, Junxi; Li, Jinmin

    2016-05-01

    We demonstrated for the first time the formation and study of semi-polar AlGaN multiple-quantum-wells (MQWs) grown on highly regular hexagonal AlN nanopyramids. The AlN nanopyramids were obtained by a metal-organic chemical vapor phase deposition regrowth method on a well-ordered AlN nanorod array prepared by a top-down etching process. The growth mechanism of the AlN nanopyramids was ascribed to the slow growth of the (101&cmb.macr;1) semi-polar plane, which resulted from hydrogen passivation. Beneath the semi-polar facets, air voids were formed. This was attributed to the insufficient delivery of gas reactants to the bottom of the nanorods during the growth process. The polarization effect in semi-polar AlGaN MQWs was numerically calculated. The results showed that the internal electric field (IEF) in the semi-polar MQWs was remarkably reduced by 80% in comparison with c-plane MQWs. Power dependent photoluminescence indicated that the semi-polar AlGaN MQWs had negligible wavelength shifts that resulted from the reduced IEF, which was in accordance with theoretical predictions. In addition, epitaxial strain was greatly relieved in the AlN regrowth layer, which was revealed from the peak shift of the E2(high) phonon using micro-Raman spectroscopy. The advantages of AlGaN-based hexagonal nanopyramid semi-polar three dimensional nanostructures would lead to a large improvement of output power in UV-LEDs.

  12. Topological phase transition in hexagonal boron-nitride bilayers modulated by gate voltage

    Science.gov (United States)

    Jin, Guojun; Zhai, Xuechao

    2013-03-01

    We study the gate-voltage modulated electronic properties of hexagonal boron-nitride bilayers with two different stacking structures in the presence of intrinsic and Rashba spin-orbit interactions. Our analytical results show that there are striking cooperation effects arising from the spin-orbit interactions and the interlayer bias voltage. For realizing topological phase transition, in contrast to a gated graphene bilayer for increasing its energy gap, the energy gap of a boron-nitride bilayer is significantly reduced by an applied gate voltage. For the AA stacking-bilayer which has the inversion symmetry, a strong topological phase is found, and there is an interesting reentrant behavior from a normal phase to a topological phase and then to a normal phase again, characterized by the topological index. Therefore, the gate voltage modulated AA-boron nitride bilayer can be taken as a newcomer of the topological insulator family. For the AB stacking-bilayer which is lack of the inversion symmetry, it is always topologically trivial, but exhibits an unusual quantum Hall phase with four degenerate low-energy states localized at a single edge. It is suggested that these theoretical findings could be verified experimentally in the transport properties of boron-nitride bylayers. This research was supported by the NSFC (Nos. 60876065, 11074108), PAPD, and NBRPC (Nos. 2009CB929504, 2011CB922102).

  13. Stabilizing the hexagonal close packed structure of hard spheres with polymers: Phase diagram, structure, and dynamics

    Science.gov (United States)

    Edison, John R.; Dasgupta, Tonnishtha; Dijkstra, Marjolein

    2016-08-01

    We study the phase behaviour of a binary mixture of colloidal hard spheres and freely jointed chains of beads using Monte Carlo simulations. Recently Panagiotopoulos and co-workers predicted [Nat. Commun. 5, 4472 (2014)] that the hexagonal close packed (HCP) structure of hard spheres can be stabilized in such a mixture due to the interplay between polymer and the void structure in the crystal phase. Their predictions were based on estimates of the free-energy penalty for adding a single hard polymer chain in the HCP and the competing face centered cubic (FCC) phase. Here we calculate the phase diagram using free-energy calculations of the full binary mixture and find a broad fluid-solid coexistence region and a metastable gas-liquid coexistence region. For the colloid-monomer size ratio considered in this work, we find that the HCP phase is only stable in a small window at relatively high polymer reservoir packing fractions, where the coexisting HCP phase is nearly close packed. Additionally we investigate the structure and dynamic behaviour of these mixtures.

  14. Thermoelectric Hexagonal A-Mg-Si with A = Sr and Ba Zintl Phases

    Science.gov (United States)

    Kajitani, T.; Takahashi, K.; Saito, M.; Suzuki, H.; Kikuchi, S.; Kubouchi, M.; Hayashi, K.

    2016-10-01

    Hexagonal A-Mg-Si with A = Sr and Ba Zintl phases are promising candidates for p-type magnesium silicides usable with n-Mg2Si under 900 K. We synthesized p-type A-Mg-Si Zintl phases by the spark plasma synthesis procedure. Mg2Si and Mg2A powders were mixed at the ratio of 1- x/ x with x = 0.3-0.4. Two-step synthesis was performed at 850 K for 20 min and 1100 K for 20 min under uniaxial pressure at 30 MPa. Sintered pellets exhibited a stable p-type thermoelectric property. These pellets consisted of several unknown phases. We found two semiconductor phases, namely A2Mg4Si3 and A2Mg12Si7. The crystal structures of the 2/4/3- and 2/12/7-phases were Pbar{6}2m (No. 189)- and P63 /m (No. 176)-types, respectively. Sr0.70Mg2Si, Ba3Mg10Si7 and Sr3Mg10Si7 phases are newly found and characterized by a single crystal diffraction study. Previously found Sr2Mg4Si3 single phase polycrystalline 30φ × 10 mm pellets were successfully synthesized. The thermoelectric performance of the Sr2Mg4Si3 single phase sample was tested. The pellets exhibit p-type behavior from room temperature to 700 K. The thermal conductivity, κ, was almost constant at 1.1 W/mK from 350 K to 700 K.

  15. Hexagonal phase stabilization and magnetic orders of multiferroic L u1 -xS cxFe O3

    Science.gov (United States)

    Lin, L.; Zhang, H. M.; Liu, M. F.; Shen, Shoudong; Zhou, S.; Li, D.; Wang, X.; Yan, Z. B.; Zhang, Z. D.; Zhao, Jun; Dong, Shuai; Liu, J.-M.

    2016-02-01

    Hexagonal LuFe O3 has drawn a lot of research attention due to its contentious room-temperature multiferroicity. Due to the instability of hexagonal phase in the bulk form, most experimental studies focused on LuFe O3 thin films which can be stabilized by strain using proper substrates. Here we report on the hexagonal phase stabilization, magnetism, and magnetoelectric coupling of bulk LuFe O3 by partial Sc substitution of Lu. First, our first-principles calculations show that the hexagonal structure can be stabilized by partial Sc substitution, while the multiferroic properties, including the noncollinear magnetic order and geometric ferroelectricity, remain robustly unaffected. Therefore, L u1 -xS cxFe O3 can act as a platform to check the multiferroicity of LuFe O3 and related materials in the bulk form. Second, the magnetic characterizations on bulk L u1 -xS cxFe O3 demonstrate a magnetic anomaly (probable antiferromagnetic ordering) above room temperature, ˜425-445 K, followed by magnetic transitions in low temperatures (˜167-172 K). In addition, a magnetoelectric response is observed in the low-temperature region. Our study provides useful information on the multiferroic physics of hexagonal R Fe O3 and related systems.

  16. Watt loss in three-phase transformers with circular and hexagonal forming contours of twisted spatial magnetic core rods

    Directory of Open Access Journals (Sweden)

    E.A. Avdieieva

    2014-04-01

    Full Text Available For spatial three-phase axial electromagnetic systems with circular and hexagonal cross-section configurations of twisted butt-end magnetic core rods, analytical dependences for optimal geometrical relations determination over the transformer minimum watt loss criterion are obtained, comparative analysis of the systems energy efficiency made.

  17. Study of 18-Pulse Rectifier Utilizing Hexagon Connected 3-Phase to 9-Phase Transformer

    Directory of Open Access Journals (Sweden)

    Ahmad Saudi Samosir

    2008-04-01

    Full Text Available The 18-pulse converter, using Y or -connected differential autotransformer, is very interesting since it allows natural high power factor correction. The lowest input current harmonic components are the 17th and 19th. The Transformer is designed to feed three six-pulse bridge rectifiers displaced in phase by 200. This paper present a high power factor three-phase rectifier bases on 3-phase to 9-phase transformer and 18-pulse rectifier. The 9-phase polygon-connected transformer followed by 18-pulse diode rectifiers ensures the fundamental concept of natural power factor correction. Simulation results to verify the proposed concept are shown in this paper.

  18. First-principles study of the structural stability of cubic, tetragonal and hexagonal phases in Mn₃Z (Z=Ga, Sn and Ge) Heusler compounds.

    Science.gov (United States)

    Zhang, Delin; Yan, Binghai; Wu, Shu-Chun; Kübler, Jürgen; Kreiner, Guido; Parkin, Stuart S P; Felser, Claudia

    2013-05-22

    We investigate the structural stability and magnetic properties of the cubic, tetragonal and hexagonal phases of Mn3Z (Z=Ga, Sn and Ge) Heusler compounds using first-principles density-functional theory. We propose that the cubic phase plays an important role as an intermediate state in the phase transition from the hexagonal to the tetragonal phases. Consequently, Mn3Ga and Mn3Ge behave differently from Mn3Sn, because the relative energies of the cubic and hexagonal phases are different. This result agrees with experimental observations for these three compounds. The weak ferromagnetism of the hexagonal phase and the perpendicular magnetocrystalline anisotropy of the tetragonal phase obtained in our calculations are also consistent with experiment.

  19. First-principles study of the structural stability of cubic, tetragonal and hexagonal phases in Mn3Z (Z=Ga, Sn and Ge) Heusler compounds

    Science.gov (United States)

    Zhang, Delin; Yan, Binghai; Wu, Shu-Chun; Kübler, Jürgen; Kreiner, Guido; Parkin, Stuart S. P.; Felser, Claudia

    2013-05-01

    We investigate the structural stability and magnetic properties of the cubic, tetragonal and hexagonal phases of Mn3Z (Z=Ga, Sn and Ge) Heusler compounds using first-principles density-functional theory. We propose that the cubic phase plays an important role as an intermediate state in the phase transition from the hexagonal to the tetragonal phases. Consequently, Mn3Ga and Mn3Ge behave differently from Mn3Sn, because the relative energies of the cubic and hexagonal phases are different. This result agrees with experimental observations for these three compounds. The weak ferromagnetism of the hexagonal phase and the perpendicular magnetocrystalline anisotropy of the tetragonal phase obtained in our calculations are also consistent with experiment.

  20. Phase relations and chemical vapor transport of hexagonal indium tungsten bronze In{sub x}WO{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Steiner, Udo, E-mail: steiner@mw.htw-dresden.de

    2014-08-25

    Highlights: • Phase relations of hexagonal bronze In{sub x}WO{sub 3} with neighboring phases. • Chemical vapor transport experiments using NH{sub 4}Cl as transport agent. • Single crystals of In{sub x}WO{sub 3} up to a few mm in size were prepared. • Selective synthesis of crystals of the indium poor and indium rich phase boundary. - Abstract: Phase pure powder samples of hexagonal indium tungsten bronze In{sub x}WO{sub 3} (x = 0.25–0.35) were synthesized by solid state reaction at 1173 K. The phase relations of In{sub x}WO{sub 3} with neighboring binary and ternary phases were determined in the phase diagram In–W–O. Systematic chemical vapor transport experiments were carried out on source materials with compositions corresponding to miscellaneous two-phase and three-phase regions using NH{sub 4}X (X = Cl, Br, I) as transport agent. Crystals of hexagonal indium tungsten bronze were deposited beside In{sub 2}W{sub 3}O{sub 12} with composition corresponding to the indium poor phase boundary and dimensions up to a few mm in a temperature gradient 1173 K → 1073 K starting from ternary mixtures In{sub x}WO{sub 3}/In{sub 2}W{sub 3}O{sub 12}/In{sub 0.02}WO{sub 3}. Sole deposition of In{sub x}WO{sub 3} single crystals with composition x ≈ 0.33 was observed from ternary mixtures In{sub x}WO{sub 3}/W{sub 18}O{sub 49}/WO{sub 2} with a migration rate of about 0.5 mg/h (transport agent NH{sub 4}Cl)

  1. The effect of hydrostatic pressure on the physical properties of magnesium arsenide in cubic and hexagonal phases

    Science.gov (United States)

    Mokhtari, Ali; Sedighi, Matin

    2010-04-01

    Full potential-linearized augmented plane wave (FP-LAPW) method within density functional theory (DFT) was applied to study the structural and electronic properties of the magnesium arsenide in both cubic and hexagonal phases. The exchange-correlation functional was approximated as a generalized gradient functional introduced by Perdew-Burke-Ernzerhof (GGA96) and Engel-Vosko (EV-GGA). The lattice parameters, bulk modulus and its pressure derivative, cohesive energy, band structures and effective mass of electrons and holes (EME and EMH) were obtained and compared to the available experimental and theoretical results. A phase transition was predicted at pressure of about 1.63 GPa from the cubic to the hexagonal phase. The effect of hydrostatic pressure on the behavior of the electronic properties such as band gap, valence bandwidths, anti-symmetry gap (the energy gap between two parts of the valence bands), EME and EMH were investigated using both GGA96 and EV-GGA methods. High applied pressure can decrease (increase) the holes mobility of cubic (hexagonal) phase of this compound.

  2. Structural and optical properties of Cu-doped CdTe films with hexagonal phase grown by pulsed laser deposition

    Directory of Open Access Journals (Sweden)

    F. de Moure-Flores

    2012-06-01

    Full Text Available Cu-doped CdTe thin films were prepared by pulsed laser deposition on Corning glass substrates using powders as target. Films were deposited at substrate temperatures ranging from 100 to 300 °C. The X-ray diffraction shows that both the Cu-doping and the increase in the substrate temperature promote the presence of the hexagonal CdTe phase. For a substrate temperature of 300 °C a CdTe:Cu film with hexagonal phase was obtained. Raman and EDS analysis indicate that the films grew with an excess of Te, which indicates that CdTe:Cu films have p-type conductivity.

  3. Phase stability and magnetic behavior of hexagonal phase of N2-O2 system with kagome lattice under high pressure and low temperature

    Science.gov (United States)

    Akahama, Y.; Ishihara, D.; Yamashita, H.; Fujihisa, H.; Hirao, N.; Ohishi, Y.

    2016-08-01

    The pressure-temperature (P -T ) phase diagram of N2-O2 mixture with a composition of N2-48 mol % O2 has been investigated using x-ray diffraction and the phase stability of a hexagonal phase (space group: P 6 /mmm), with the kagome lattice examined under high-pressure and low-temperature conditions. While the phase appears as a low-temperature phase of the cubic phase (P m 3 n ) with the structure of γ -O2 or δ -N2 and is stable in a wide range of pressures and temperatures, it transforms to lower symmetry monoclinic or orthorhombic phases at lower temperature, accompanied with a distortion of the kagome lattice. Based on Rietveld refinements, the monoclinic and orthorhombic phases are found to be in the P 21/a and Cmmm space groups, respectively. In magnetization measurements, a magnetic transition is observed with a relatively large drop of magnetization, corresponding to the cubic-to-hexagonal phase transition. This suggests that the hexagonal phase has a certain magnetic ordered state that arises from the molecular magnetic moment of O2.

  4. Hexagonal versus perovskite phase of manganite RMnO3 (R=Y,Ho,Er,Tm,Yb,Lu)

    Science.gov (United States)

    Zhou, J.-S.; Goodenough, J. B.; Gallardo-Amores, J. M.; Morán, E.; Alario-Franco, M. A.; Caudillo, R.

    2006-07-01

    The floating-zone method and high-pressure synthesis have been used to obtain the hexagonal and the perovskite RMnO3 (R=Y,Ho,Er,Tm,Yb,Lu) compounds. We have refined the crystal structure and characterized the compounds with measurements of magnetic susceptibility χ(T) and thermal conductivity κ(T) . The systematic change of κ(T) below TN found in all members of the hexagonal RMnO3 family shows that some spin-independent bond-length fluctuation plays an important role in the suppression of κ(T) below TN as well as in the paramagnetic phase. The responsible soft vibrational mode is identified. In contrast, the perovskite RMnO3 shows a phonon-like κ(T) below room temperature, but with an anomalously large critical scattering at TN . A phase diagram of transition temperatures versus the R3+ -ion radius for both hexagonal and perovskite phases is also given.

  5. Distinguishing cubic and hexagonal phases within InGaN/GaN microstructures using electron energy loss spectroscopy.

    Science.gov (United States)

    Griffiths, I J; Cherns, D; Albert, S; Bengoechea-Encabo, A; Angel Sanchez, M; Calleja, E; Schimpke, T; Strassburg, M

    2016-05-01

    3D InGaN/GaN microstructures grown by metal organic vapor phase epitaxy (MOVPE) and molecular beam epitaxy (MBE) have been extensively studied using a range of electron microscopy techniques. The growth of material by MBE has led to the growth of cubic GaN material. The changes in these crystal phases has been investigated by Electron Energy Loss Spectroscopy, where the variations in the fine structure of the N K-edge shows a clear difference allowing the mapping of the phases to take place. GaN layers grown for light emitting devices sometimes have cubic inclusions in the normally hexagonal wurtzite structures, which can influence the device electronic properties. Differences in the fine structure of the N K-edge between cubic and hexagonal material in electron energy loss spectra are used to map cubic and hexagonal regions in a GaN/InGaN microcolumnar device. The method of mapping is explained, and the factors limiting spatial resolution are discussed.

  6. Distinguishing cubic and hexagonal phases within InGaN/GaN microstructures using electron energy loss spectroscopy

    Science.gov (United States)

    CHERNS, D; ALBERT, S.; BENGOECHEA‐ENCABO, A.; ANGEL SANCHEZ, M.; CALLEJA, E.; SCHIMPKE, T.; STRASSBURG, M.

    2015-01-01

    Summary 3D InGaN/GaN microstructures grown by metal organic vapor phase epitaxy (MOVPE) and molecular beam epitaxy (MBE) have been extensively studied using a range of electron microscopy techniques. The growth of material by MBE has led to the growth of cubic GaN material. The changes in these crystal phases has been investigated by Electron Energy Loss Spectroscopy, where the variations in the fine structure of the N K‐edge shows a clear difference allowing the mapping of the phases to take place. GaN layers grown for light emitting devices sometimes have cubic inclusions in the normally hexagonal wurtzite structures, which can influence the device electronic properties. Differences in the fine structure of the N K‐edge between cubic and hexagonal material in electron energy loss spectra are used to map cubic and hexagonal regions in a GaN/InGaN microcolumnar device. The method of mapping is explained, and the factors limiting spatial resolution are discussed. PMID:26366483

  7. Stabilisation of late transition metal and noble metal films in hexagonal and body centred tetragonal phases by epitaxial growth

    Energy Technology Data Exchange (ETDEWEB)

    Hueger, E.

    2005-08-26

    In this work ultrathin metallic films with a crystal phase different to their natural bulk structure were produced by hetero-epitaxial growth on metallic substrates. A further aim of this work was to understand the initiation, growth and stability of crystal phase modifications of these films. there exist cases where the films turn beyond the pseudomorphic-growth to a crystal phase different from their natural bulk structure. The present work presents and discusses such a case in addition to the general phenomenon of pseudomorphic-growth. In particular it is shown that metals whose natural phase is face centred cubic (fcc) can be grown in body centred tetragonal (bct) or hexagonal close packed (hcp) phases in the form of thin films on (001) surfaces of appropriate substrates. The growth behavior, electron diffraction analysis, appearance conditions, geometric fit considerations, examples and a discussion of the phase stability of non-covered films and superlattices is given reviewing all epitaxial-systems whose diffraction pattern can be explained by the hexagonal or pseudomorphic bct phase. (orig.)

  8. Epitaxial growth of hexagonal tungsten bronze Cs x WO3 films in superconducting phase region exceeding bulk limit

    Science.gov (United States)

    Soma, Takuto; Yoshimatsu, Kohei; Ohtomo, Akira

    2016-07-01

    We report epitaxial synthesis of superconducting Cs x WO3 (x = 0.11, 0.20, and 0.31) films on Y-stabilized ZrO2 (111) substrates. The hexagonal crystal structure was verified not only for the composition within the stable region of the bulk (x = 0.20 and 0.31), but also for the out-of-range composition (x = 0.11). The onset of the superconducting transition was recorded at 5.8 K for x = 0.11. We found a strong correlation between the superconducting transition temperature (T C) and the c-axis length, irrespective of the Cs content. These results indicated that the hidden superconducting phase region of hexagonal tungsten bronze is accessible using epitaxial synthesis of lightly doped films.

  9. Fast relaxation of a hexagonal Poiseuille shear-induced near-surface phase in a threadlike micellar solution.

    Science.gov (United States)

    Hamilton, W A; Butler, P D; Magid, L J; Han, Z; Slawecki, T M

    1999-08-01

    The dynamics of near-surface conformations in complex fluids under flow should dramatically affect their rheological properties. We have made the first measurements resolving the decay kinetics of a hexagonal phase induced in a threadlike polyionic micellar system under Poiseuille shear near a quartz surface. Upon cessation of shearing flow, this minimum interference crystalline phase formed within approximately 20 microm of the surface "melts" to a metastable two-dimensional liquid of aligned micelles in approximately 0.7 s. This is some three orders of magnitude shorter than the time required for bulk (Couette) shear-aligned micelles in this system to reach a fully entangled state.

  10. High/low-moment phase transition in hexagonal Mn-Fe-P-Si compounds

    NARCIS (Netherlands)

    Dung, N.H.; Zhang, L.; Ou, Z.Q.; Zhao, L.; Van Eijck, L.; Mulders, A.M.; Avdeev, M.; Suard, E.; Van Dijk, N.H.; Brück, E.

    2012-01-01

    Using high-resolution neutron diffraction measurements for Mn-rich hexagonal Mn-Fe-P-Si compounds, we show that the substitution of Mn for Fe on the 3f sites results in a linear decrease of the Fe/Mn(3f) magnetic moments, while the Mn(3g) magnetic moments remain constant. With increasing

  11. Formation of Hexagonal-Close Packed (HCP) Rhodium as a Size Effect.

    Science.gov (United States)

    Huang, Jing Lu; Li, Zhi; Duan, Hao Hong; Cheng, Zhi Ying; Li, Ya Dong; Zhu, Jing; Yu, Rong

    2017-01-18

    Previous studies on the structural and functional properties of rhodium are based on the face-centered-cubic (fcc) structure in the bulk form. Here we report the first discovery of the hexagonal-close packed (hcp) rhodium in the nanoparticle form. The hcp Rh can be directly synthesized by solvothermal reaction or by electron-beam induced decomposition of Rh monolayers. The hcp Rh nanoparticles are stable under electron beam irradiation. Compared with the fcc structure, the hcp Rh nanoparticles show a large lattice expansion (6% larger atomic volume). The first-principles calculations suggest that the lower surface energy of hcp Rh leads to the size effect in the crystal structure.

  12. Microemulsion-mediated synthesis of cobalt (pure fcc and hexagonal phases) and cobalt-nickel alloy nanoparticles.

    Science.gov (United States)

    Ahmed, Jahangeer; Sharma, Shudhanshu; Ramanujachary, Kandalam V; Lofland, Samuel E; Ganguli, Ashok K

    2009-08-15

    By choosing appropriate microemulsion systems, hexagonal cobalt (Co) and cobalt-nickel (1:1) alloy nanoparticles have been obtained with cetyltrimethylammonium bromide as a cationic surfactant at 500 degrees C. This method thus stabilizes the hcp cobalt even at sizes (fcc cobalt is predicted to be stable. On annealing the hcp cobalt nanoparticles in H(2) at 700 degrees C we could transform them to fcc cobalt nanoparticles. Microscopy studies show the formation of spherical nanoparticles of hexagonal and cubic forms of cobalt and Co-Ni (1:1) alloy nanoparticles with the average size of 4, 8 and 20 nm, respectively. Electrochemical studies show that the catalytic property towards oxygen evolution is dependent on the applied voltage. At low voltage (less than 0.65 V) the Co (hexagonal) nanoparticles are superior to the alloy (Co-Ni) nanoparticles while above this voltage the alloy nanoparticles are more efficient catalysts. The nanoparticles of cobalt (hcp and fcc) and alloy (Co-Ni) nanoparticles show ferromagnetism. The saturation magnetization of Co-Ni nanoparticles is reduced compared to the bulk possibly due to surface oxidation.

  13. Hexagonal-to-cubic phase transformation in composite thin films induced by FePt nanoparticles located at PS/PEO interfaces.

    Science.gov (United States)

    Aissou, Karim; Fleury, Guillaume; Pecastaings, Gilles; Alnasser, Thomas; Mornet, Stéphane; Goglio, Graziella; Hadziioannou, Georges

    2011-12-06

    The organization process of asymmetric poly(styrene-block-ethylene oxide) (PS-b-PEO) copolymer thin films blended with FePt nanoparticles is studied. In a first step, it is shown that FePt nanoparticles stabilized by oleic acid ligands are distributed within the PS matrix phase, whereas the same particles partially covered with short dopamine-terminated-methoxy poly(ethylene oxide) (mPEO-Dopa) are located at PS/PEO interfaces. The swelling of PS domains, induced by FePt_oleic acid nanoparticles during the solvent annealing process, results in formation of a disordered microstructure in comparison to the well-organized hexagonally close-packed (HCP) cylinder phase formed in the neat PS-b-PEO copolymer. The evolution of the microstructure of PS-b-PEO/FePt_mPEO-Dopa composite has been investigated for different solvent annealing treatments. Under high-humidity conditions during the vapor annealing process, the addition of FePt nanoparticles results in formation of spheres in the film split into terraces. The upper and lower terraces are occupied by spheres organized in an unusual square and HCP phases, respectively. Under low-humidity conditions, undulated PEO cylinders oriented parallel to substrate are formed in the presence of FePt nanoparticles. In this case, we observe that most of the nanoparticles accumulate within the core of topological defects, which induces a low nanoparticle concentration at the PS/PEO interfaces and so stabilizes an intermediate undulated cylinder phase.

  14. Fast relaxation of a hexagonal Poiseuille shear-induced near-surface phase in a threadlike micellar solution

    Energy Technology Data Exchange (ETDEWEB)

    Hamilton, W.A. [Solid State Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831-6393 (United States); Butler, P.D.; Slawecki, T.M. [National Institute of Standards and Technology, Gaithersburg, Maryland 20899 (United States); Magid, L.J.; Han, Z. [Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996 (United States)

    1999-08-01

    The dynamics of near-surface conformations in complex fluids under flow should dramatically affect their rheological properties. We have made the first measurements resolving the decay kinetics of a hexagonal phase induced in a threadlike polyionic micellar system under Poiseuille shear near a quartz surface. Upon cessation of shearing flow, this minimum interference crystalline phase formed within {approximately}20 {mu}m of the surface {open_quotes}melts{close_quotes} to a metastable two-dimensional liquid of aligned micelles in {approximately}0.7 s. This is some three orders of magnitude shorter than the time required for bulk (Couette) shear-aligned micelles in this system to reach a fully entangled state. {copyright} {ital 1999} {ital The American Physical Society}

  15. Hexagonal-Rod Growth Mechanism and Kinetics of the Primary Cu6Sn5 Phase in Liquid Sn-Based Solder

    Science.gov (United States)

    Zhang, Z. H.; Cao, H. J.; Yang, H. F.; Li, M. Y.; Yu, Y. X.

    2016-11-01

    A hexagonal-rod growth mechanism is proposed to describe the growth behavior of the primary Cu6Sn5 phase in liquid Sn-based solder. After Sn-6.5 at.%Cu solder had been maintained at 250°C for 10 h, a large number of hexagonal-rod-type Cu6Sn5 grains were found to have separated within it. Our observations show that these hexagonal rods had side facets in the { 10overline{1} 0}_{η } family and round ends close to the {0002}η family. Moreover, the nucleation of the hexagonal rods was studied, and the corresponding growth kinetics found to be governed by a Cu-supply-controlled mechanism rather than an interfacial-reaction-controlled or Cu-diffusion-limited mechanism. More importantly, the anisotropic growth of the Cu6Sn5 phase was confirmed to be the dominant reason for production of these primary hexagonal rods with high aspect ratio. This may represent an avenue for synthesis of nanosized Cu6Sn5 single crystals for use as anode materials in lithium-ion batteries. Additionally, our Cu6Sn5 hexagonal-rod growth mechanism may provide insight into morphological and kinetic studies on interfacial Cu6Sn5 grains and similar intermetallics.

  16. Shear-induced phase transition of nanocrystalline hexagonal boron nitride to wurtzitic structure at room temperature and lower pressure.

    Science.gov (United States)

    Ji, Cheng; Levitas, Valery I; Zhu, Hongyang; Chaudhuri, Jharna; Marathe, Archis; Ma, Yanzhang

    2012-11-20

    Disordered structures of boron nitride (BN), graphite, boron carbide (BC), and boron carbon nitride (BCN) systems are considered important precursor materials for synthesis of superhard phases in these systems. However, phase transformation of such materials can be achieved only at extreme pressure-temperature conditions, which is irrelevant to industrial applications. Here, the phase transition from disordered nanocrystalline hexagonal (h)BN to superhard wurtzitic (w)BN was found at room temperature under a pressure of 6.7 GPa after applying large plastic shear in a rotational diamond anvil cell (RDAC) monitored by in situ synchrotron X-ray diffraction (XRD) measurements. However, under hydrostatic compression to 52.8 GPa, the same hBN sample did not transform to wBN but probably underwent a reversible transformation to a high-pressure disordered phase with closed-packed buckled layers. The current phase-transition pressure is the lowest among all reported direct-phase transitions from hBN to wBN at room temperature. Usually, large plastic straining leads to disordering and amorphization; here, in contrast, highly disordered hBN transformed to crystalline wBN. The mechanisms of strain-induced phase transformation and the reasons for such a low transformation pressure are discussed. Our results demonstrate a potential of low pressure-room temperature synthesis of superhard materials under plastic shear from disordered or amorphous precursors. They also open a pathway of phase transformation of nanocrystalline materials and materials with disordered and amorphous structures under extensive shear.

  17. Shear-induced phase transition of nanocrystalline hexagonal boron nitride to wurtzitic structure at room temperature and lower pressure

    Science.gov (United States)

    Ji, Cheng; Levitas, Valery I.; Zhu, Hongyang; Chaudhuri, Jharna; Marathe, Archis; Ma, Yanzhang

    2012-01-01

    Disordered structures of boron nitride (BN), graphite, boron carbide (BC), and boron carbon nitride (BCN) systems are considered important precursor materials for synthesis of superhard phases in these systems. However, phase transformation of such materials can be achieved only at extreme pressure–temperature conditions, which is irrelevant to industrial applications. Here, the phase transition from disordered nanocrystalline hexagonal (h)BN to superhard wurtzitic (w)BN was found at room temperature under a pressure of 6.7 GPa after applying large plastic shear in a rotational diamond anvil cell (RDAC) monitored by in situ synchrotron X-ray diffraction (XRD) measurements. However, under hydrostatic compression to 52.8 GPa, the same hBN sample did not transform to wBN but probably underwent a reversible transformation to a high-pressure disordered phase with closed-packed buckled layers. The current phase-transition pressure is the lowest among all reported direct-phase transitions from hBN to wBN at room temperature. Usually, large plastic straining leads to disordering and amorphization; here, in contrast, highly disordered hBN transformed to crystalline wBN. The mechanisms of strain-induced phase transformation and the reasons for such a low transformation pressure are discussed. Our results demonstrate a potential of low pressure–room temperature synthesis of superhard materials under plastic shear from disordered or amorphous precursors. They also open a pathway of phase transformation of nanocrystalline materials and materials with disordered and amorphous structures under extensive shear. PMID:23129624

  18. Formation of quasicrystalline phase in Al70-x Ga x Pd17Mn13 alloys

    Science.gov (United States)

    Yadav, T. P.; Singh, Devinder; Shahi, Rohit R.; Shaz, M. A.; Tiwari, R. S.; Srivastava, O. N.

    2011-07-01

    In the present investigation, the formation and stability of icosahedral phase in Al70- x Ga x Pd17Mn13 alloys has been explored using X-ray diffraction, scanning, transmission electron microscopy and energy dispersive X-ray analysis. Cast alloys and melt-spun ribbons with x = 2.5, 5, 7.5, 10, 12.5, 15 and 20 have been investigated. In both cases, the alloys up to 5 at% Ga exhibit the formation of pure icosahedral phase. However, for x ≥5 at% Ga content, the cast alloy exhibits the formation of multiphase material, consisting of an icosahedral phase along with AlPd-type B2 and ξ‧ crystalline (orthorhombic structure with unit cell a = 23.5 Å, b = 16.6 Å and c = 12.4 Å) phases. In the case of the melt spun ribbon for x = 5 at% Ga, only an icosahedral phase has been found, but for 15 > x > 5 at% Ga, an icosahedral phase is the majority phase with AlPd-type B2 phase being the minority component. For x = 15 at% Ga, a Al3Pd2-type hexagonal phase together with a small amount of quasicrystalline phase is formed. However, for x = 20, only a hexagonal Al3Pd2 phase results.

  19. Ab initio density functional theory investigation of the structural, electronic and optical properties of Ca{sub 3}Sb{sub 2} in hexagonal and cubic phases

    Energy Technology Data Exchange (ETDEWEB)

    Arghavani Nia, Borhan, E-mail: b.arghavani@gmail.com [Department of Physics, Kermanshah Branch, Islamic Azad University, Kermanshah (Iran, Islamic Republic of); Sedighi, Matin [Department of Physics, Kermanshah Branch, Islamic Azad University, Kermanshah (Iran, Islamic Republic of); Shahrokhi, Masoud [Young Researchers and Elite Club, Kermanshah Branch, Islamic Azad University, Kermanshah (Iran, Islamic Republic of); Moradian, Rostam [Nano-Science and Nano-Technology Research Center, Razi University, Kermanshah (Iran, Islamic Republic of); Computational Physics Science Research Laboratory, Department of Nano-Science, Institute for Studies in Theoretical Physics and Mathematics (IPM), P.O. Box 19395-1795, Tehran (Iran, Islamic Republic of)

    2013-11-15

    A density functional theory study of structural, electronical and optical properties of Ca{sub 3}Sb{sub 2} compound in hexagonal and cubic phases is presented. In the exchange–correlation potential, generalized gradient approximation (PBE-GGA) has been used to calculate lattice parameters, bulk modulus, cohesive energy, dielectric function and energy loss spectra. The electronic band structure of this compound has been calculated using the above two approximations as well as another form of PBE-GGA, proposed by Engle and Vosko (EV-GGA). It is found that the hexagonal phase of Ca{sub 3}Sb{sub 2} has an indirect gap in the Γ→N direction; while in the cubic phase there is a direct-gap at the Γ point in the PBE-GGA and EV-GGA. Effects of applying pressure on the band structure of the system studied and optical properties of these systems were calculated. - Graphical abstract: A density functional theory study of structural, electronic and optical properties of Ca{sub 3}Sb{sub 2} compound in hexagonal and cubic phases is presented. Display Omitted - Highlights: • Physical properties of Ca{sub 3}Sb{sub 2} in hexagonal and cubic phases are investigated. • It is found that the hexagonal phase is an indirect gap semiconductor. • Ca{sub 3}Sb{sub 2} is a direct-gap semiconductor at the Γ point in the cubic phase. • By increasing pressure the semiconducting band gap and anti-symmetry gap are decreased.

  20. Magnetic phase transformations of face-centered cubic and hexagonal close-packed Co at zero Kelvin.

    Science.gov (United States)

    Saal, James E; Shang, ShunLi; Wang, Yi; Liu, Zi-Kui

    2010-03-10

    The 0 K pressure-induced magnetic phase transformations of face-centered cubic (FCC) and hexagonal close packed (HCP) Co have been examined using first-principles calculations. Issues of fitting an equation of state to the first-principles energy versus volume data points containing a magnetic transformation and comparing to experimental phase equilibria are discussed. It is found that a fitting scheme employing only data where the magnetic moment decreases linearly with volume offers a physically meaningful behavior for the equation of state at metastable volumes. From this fitting, the ferromagnetic to nonmagnetic transformations with increasing pressure at 0 K are at 77 GPa and 123 GPa for FCC and HCP, respectively, and are first order and second order, respectively, on the basis of an unambiguous measure proposed in the paper. In addition to the HCP/FCC structure transformation at 99 GPa, another transformation at negative pressures is predicted, at - 31 GPa. These results are shown to be consistent with the extrapolations of the experimental pressure-temperature phase diagram to 0 K.

  1. Magnetic phase transformations of face-centered cubic and hexagonal close-packed Co at zero Kelvin

    Energy Technology Data Exchange (ETDEWEB)

    Saal, James E; Shang Shunli; Wang Yi; Liu Zikui, E-mail: jes531@psu.ed [Department of Materials Science and Engineering, The Pennsylvania State University, University Park, PA 16802 (United States)

    2010-03-10

    The 0 K pressure-induced magnetic phase transformations of face-centered cubic (FCC) and hexagonal close packed (HCP) Co have been examined using first-principles calculations. Issues of fitting an equation of state to the first-principles energy versus volume data points containing a magnetic transformation and comparing to experimental phase equilibria are discussed. It is found that a fitting scheme employing only data where the magnetic moment decreases linearly with volume offers a physically meaningful behavior for the equation of state at metastable volumes. From this fitting, the ferromagnetic to nonmagnetic transformations with increasing pressure at 0 K are at 77 GPa and 123 GPa for FCC and HCP, respectively, and are first order and second order, respectively, on the basis of an unambiguous measure proposed in the paper. In addition to the HCP/FCC structure transformation at 99 GPa, another transformation at negative pressures is predicted, at - 31 GPa. These results are shown to be consistent with the extrapolations of the experimental pressure-temperature phase diagram to 0 K.

  2. Annealing behavior of hexagonal phase content in cubic GaN thin films grown on GaAs (001) by MOCVD

    Institute of Scientific and Technical Information of China (English)

    孙小玲; 杨辉; 王玉田; 李国华; 郑联喜; 李建斌; 徐大鹏; 王占国

    1999-01-01

    The annealing behavior of the hexagonal phase content in cubic GaN (c-GaN) thin films grown on GaAs (001) by MOCVD is reported. C-GaN thin films are grown on GaAs (001) substrates by metalorganic chemical vapor deposition (MOCVD). High temperature annealing is employed to treat the as-grown c-GaN thin films. The characterization of the c-GaN films is investigated by photoluminescence (PL) and Raman scattering spectroscopy. The change conditions of the hexagonal phase content in the metastable c-GaN are reported. There is a boundary layer existing in the c-GaN/GaAs film. When being annealed at high temperature, the intensity of the TOB and LOB phonon modes from the boundary layer weakens while that of the E2 phonon mode from the hexagonal phase increases. The content change of hexagonal phase has closer relationship with annealing temperature than with annealing time period.

  3. Orientation relationships between icosahedral clusters in hexagonal MgZn2 and monoclinic Mg4Zn7 phases in Mg-Zn(-Y) alloys

    Science.gov (United States)

    Rosalie, Julian M.; Somekawa, Hidetoshi; Singh, Alok; Mukai, Toshiji

    2011-07-01

    Intermetallic precipitates formed in heat-treated and aged Mg-Zn and Mg-Zn-Y alloys have been investigated via electron microscopy. Coarse spheroidal precipitates formed on deformation twin boundaries contained domains belonging to either the MgZn2 hexagonal Laves phase or the monoclinic Mg4Zn7 phase. Both phases are structurally related to the quasi-crystalline phase formed in Mg-Zn-Y alloys, containing icosahedrally coordinated zinc atoms arranged as a series of broad rhombohedral units. This rhombohedral arrangement was also visible in intragranular precipitates where local regions with the structures of hexagonal MgZn2 and Mg4Zn7 were found. The orientation adopted by the MgZn2 and Mg4Zn7 phases in twin-boundary and intragranular precipitates was such that the icosahedral clusters were aligned similarly. These results highlight the close structural similarities between the precipitates of the Mg-Zn-Y alloy system.

  4. Solvated crystals based on [6,6]-phenyl-C61-butyric acid methyl ester (PCBM) with the hexagonal structure and their phase transformation.

    Science.gov (United States)

    Zheng, Lidong; Han, Yanchun

    2012-02-09

    This work focuses on the structural exploration of micro-sized crystals based on a well-known methanofullerene, [6,6]-phenyl-C(61)-butyric acid methyl ester (PCBM). We have succeeded in producing PCBM crystals with the hexagonal symmetry through the liquid-liquid interfacial precipitation (LLIP) method. We found that smaller but more regular PCBM crystals tend to form in the oversaturated PCBM solutions with solvents of lower solubility for PCBM, such as tetrahydrofuran (THF) and 1,4-dioxane. The structure of the produced crystals also shows a dependence on the solvents, which can be attributed to the incorporation of different solvent molecules into PCBM crystals. Under thermal annealing, for the first time, we have observed a crystalline to crystalline phase transformation of these hexagonal PCBM crystals. Along with the phase transformation, the morphology of the crystals has also been transformed from the hexagon to long needles. In addition, the needlelike crystals arrange themselves with a relative angle of 60° to each other, which implies an intrinsic structural correlation between needlelike and hexagonal crystals.

  5. Ab initio density functional theory investigation of the structural, electronic and optical properties of Ca3Sb2 in hexagonal and cubic phases

    Science.gov (United States)

    Arghavani Nia, Borhan; Sedighi, Matin; Shahrokhi, Masoud; Moradian, Rostam

    2013-11-01

    A density functional theory study of structural, electronical and optical properties of Ca3Sb2 compound in hexagonal and cubic phases is presented. In the exchange-correlation potential, generalized gradient approximation (PBE-GGA) has been used to calculate lattice parameters, bulk modulus, cohesive energy, dielectric function and energy loss spectra. The electronic band structure of this compound has been calculated using the above two approximations as well as another form of PBE-GGA, proposed by Engle and Vosko (EV-GGA). It is found that the hexagonal phase of Ca3Sb2 has an indirect gap in the Γ→N direction; while in the cubic phase there is a direct-gap at the Γ point in the PBE-GGA and EV-GGA. Effects of applying pressure on the band structure of the system studied and optical properties of these systems were calculated.

  6. Optical properties, lattice dynamics, and structural phase transition in hexagonal 2 H -BaMn O3 single crystals

    Science.gov (United States)

    Stanislavchuk, T. N.; Litvinchuk, A. P.; Hu, Rongwei; Jeon, Young Hun; Ji, Sung Dae; Cheong, S.-W.; Sirenko, A. A.

    2015-10-01

    Optical properties and lattice dynamics of hexagonal 2 H -BaMn O3 single crystals are studied experimentally in a wide temperature range by means of rotating analyzer ellipsometry and Raman scattering. The magnitude of the direct electronic band gap is found to be Eg=3.2 eV . At room temperature the far-infrared (IR) ellipsometry spectra reveal six IR-active phonons; two of them are polarized along the c axis and four are polarized within the a-b plane. Seven phonon modes are identified in the Raman scattering experiments. Group theoretical mode analysis and complementary density functional theory lattice dynamics calculations are consistent with the 2 H -BaMn O3 structure belonging to the polar P 63m c space group at room temperature. All observed vibrational modes are assigned to specific eigenmodes of the lattice. The neutron diffraction measurements reveal a structural phase transition upon cooling below TC=130 ±5 K , which is accompanied by a lattice symmetry change from P 63m c to P 63c m . Simultaneously, at temperatures below TC several additional IR- and Raman-active modes are detected in experimental spectra. This confirms the occurrence of a structural transition, which is possibly associated with the appearance of electrical polarization along the c axis and a previously known tripling of the primitive cell volume at low temperatures.

  7. Hexagonal boron nitride nanosheets as adsorbents for solid-phase extraction of polychlorinated biphenyls from water samples.

    Science.gov (United States)

    Jia, Shiliang; Wang, Zhenhua; Ding, Ning; Elaine Wong, Y-L; Chen, Xiangfeng; Qiu, Guangyu; Dominic Chan, T-W

    2016-09-14

    The adsorptive potential of hexagonal boron nitride nanosheets (h-BNNSs) for solid-phase extraction (SPE) of pollutants was investigated for the first time. Seven indicators of polychlorinated biphenyls (PCBs) were selected as target analytes. The adsorption of PCBs on the surface of the h-BNNSs in water was simulated by the density functional theory and molecular dynamics. The simulation results indicated that the PCBs are adsorbed on the surface by π-π, hydrophobic, and electrostatic interactions. The PCBs were extracted with an h-BNNS-packed SPE cartridge, and eluted by dichloromethane. Gas chromatography-tandem mass spectrometry working in the multiple reaction monitor mode was used for the sample quantification. The effect of extraction parameters, including the flow rate, pH value, breakthrough volume, and the ionic strength, were investigated. Under the optimal working conditions, the developed method showed low limits of detection (0.24-0.50 ng L(-1); signal-to-noise ratio = 3:1), low limits of quantification (0.79-1.56 ng L(-1); signal-to-noise ratio = 10:1), satisfactory linearity (r > 0.99) within the concentration range of 2-1000 ng L(-1), and good precision (relative standard deviation results demonstrate that h-BNNSs have high analytical potential in the enrichment of pollutants.

  8. Why Hexagonal Basalt Columns?

    Science.gov (United States)

    Hofmann, Martin; Anderssohn, Robert; Bahr, Hans-Achim; Weiß, Hans-Jürgen; Nellesen, Jens

    2015-10-09

    Basalt columns with their preferably hexagonal cross sections are a fascinating example of pattern formation by crack propagation. Junctions of three propagating crack faces rearrange such that the initial right angles between them tend to approach 120°, which enables the cracks to form a pattern of regular hexagons. To promote understanding of the path on which the ideal configuration can be reached, two periodically repeatable models are presented here involving linear elastic fracture mechanics and applying the principle of maximum energy release rate. They describe the evolution of the crack pattern as a transition from rectangular start configuration to the hexagonal pattern. This is done analytically and by means of three-dimensional finite element simulation. The latter technique reproduces the curved crack path involved in this transition.

  9. Polythiophene/hexagonally ordered silica nanocomposite coating as a solid-phase microextraction fiber for the determination of polycyclic aromatic hydrocarbons in water.

    Science.gov (United States)

    Abolghasemi, Mir Mahdi; Yousefi, Vahid

    2014-01-01

    A highly porous fiber coated with polythiophene/hexagonally ordered silica nanocomposite was prepared for solid-phase microextraction (SPME). The prepared nanomaterial was immobilized onto a stainless-steel wire for the fabrication of the SPME fiber. Polythiophene/hexagonally ordered silica nanocomposite fibers were used for the extraction of some polycyclic aromatic hydrocarbons from water samples. The extracted analytes were transferred to the injection port of a gas chromatograph using a laboratory-designed SPME device. The results obtained prove the ability of the polythiophene/hexagonally ordered silica material as a new fiber for the sampling of organic compounds from water samples. This behavior is due most probably to the increased surface area of the polythiophene/hexagonally ordered silica nanocomposite. A one-at-a-time optimization strategy was applied for optimizing the important extraction parameters such as extraction temperature, extraction time, ionic strength, stirring rate, and desorption temperature and time. Under the optimum conditions, the LOD of the proposed method is 0.1-3 pg/mL for analysis of polycyclic aromatic hydrocarbons from aqueous samples, and the calibration graphs were linear in a concentration range of 0.001-20 ng/mL (R(2) > 0.990) for most of the polycyclic aromatic hydrocarbons. The single fiber repeatability and fiber-to-fiber reproducibility were less than 8.6 and 19.1% (n = 5), respectively.

  10. Synthesis of Single Hexagonal-Phase AlN Nanocrystallines by a Liquid-Solid Metathetical Reaction in an Organic Solution

    Institute of Scientific and Technical Information of China (English)

    YAN Guojun; CHEN Guangde; LU Huiming; GUO Lei

    2008-01-01

    A liquid-solid metathetical reaction method (LSMRM) of synthesizing AlN nanocrystallines is presented. AlN nanocrystallines made through LSMRM are characterized by X-ray diffractions (XRD), X-ray photoelectron spectroscopy (XPS), transmission electron microscopy (TEM), Fourier transformation infrared (FT-IR) spectroscopy, and Raman spectroscopy. The results show that the samples are single hexagonal-phase AlN and the size of the AlN samples is about tens of nanometer.

  11. Gas-Phase Infrared; JCAMP Format

    Science.gov (United States)

    SRD 35 NIST/EPA Gas-Phase Infrared; JCAMP Format (PC database for purchase)   This data collection contains 5,228 infrared spectra in the JCAMP-DX (Joint Committee for Atomic and Molecular Physical Data "Data Exchange") format.

  12. Phase transitions induced on hexagonal manganites by the incorporation of aliovalent cations on A or B lattice sites

    Directory of Open Access Journals (Sweden)

    Moure, C.

    1999-10-01

    Full Text Available The phase transition to perovskite-type structure, that occurs in some hexagonal manganites when foreign cations are incorporated into solid solution, has been studied. Several solid solution series belonging to the Y(Mn, NiO3, (Er, CaMnO3, (Y, CaMnO3, systems have been prepared by solid state reaction between the corresponding oxides. The crystalline structure of the different solid solutions has been established. The behaviour of the (Gd, CaMnO3 system has been taken as a reference. The obtained results are discussed as a function of the tolerance factor and the Mn3+/Mn4+ ratio. The transition to perovskite structure is governed by this Mn3+/Mn4+ ratio rather than the increase of the tolerance factor.

    Se ha estudiado la transición de fase a estructura de tipo perovskita que ocurre en algunas manganitas hexagonales cuando se incorporan iones aliovalentes formando soluciones sólidas. Se han preparado soluciones sólidas pertenecientes a los sistemas Y(Mn, NiO3, (Er, CaMnO3, (Y, CaMnO3 por reacción en estado sólido entre los óxidos. Se ha determinado la estructura cristalina de los diferentes compuestos, y los resultados se comparan con los observados en los correspondientes al sistema (Gd, CaMnO3. Los resultados se discuten en función del factor de tolerancia y de la razón Mn3+/Mn4+. La transición es gobernada por dicha razón más bien que por la variación del factor de tolerancia.

  13. Tuning the morphology, luminescence and magnetic properties of hexagonal-phase NaGdF4: Yb, Er nanocrystals via altering the addition sequence of the precursors

    Science.gov (United States)

    Zhao, Shuwen; Xia, Donglin; Zhao, Ruimin; Zhu, Hao; Zhu, Yiru; Xiong, Yuda; Wang, Youfa

    2017-01-01

    Hexagonal-phase NaGdF4: Yb, Er upconversion nanocrystals (UCNCs) with tunable morphology and properties were successfully prepared via a thermal decomposition method. The influences of the adding sequence of the precursors on the morphology, chemical composition, luminescence and magnetic properties were investigated by transmission electron microscopy (TEM), inductively coupled plasma-atomic emission spectrometry (ICP-AES), upconversion (UC) spectroscopy, and a vibrating sample magnetometer (VSM). It was found that the resulting nanocrystals, with different sizes ranging from 24 to 224 nm, are in the shape of spheres, hexagonal plates and flakes; moreover, the composition percentage of Yb3+-Er3+ and Gd3+ ions was found to vary in a regular pattern with the adding sequence. Furthermore, the intensity ratios of emission colors (f g/r, f g/p), and the magnetic mass susceptibility of hexagonal-phase NaGdF4: Yb, Er nanocrystals change along with the composition of the nanocrystals. A positive correlation between the susceptibility and f g/r of NaGdF4: Yb, Er was proposed. The decomposition processes of the precursors were investigated by a thermogravimetric (TG) analyzer. The result indicated that the decomposition of the resolved lanthanide trifluoroacetate is greatly different from lanthanide trifluoroacetate powder. It is of tremendous help to recognize the decomposition process of the precursors and to understand the related reaction mechanism.

  14. The formation of hexagonal-shaped InGaN-nanodisk on GaN-nanowire observed in plasma source molecular beam epitaxy

    KAUST Repository

    Ng, Tien Khee

    2014-03-08

    We report on the properties and growth kinetics of defect-free, photoluminescence (PL) efficient mushroom-like nanowires (MNWs) in the form of ~30nm thick hexagonal-shaped InGaN-nanodisk on GaN nanowires, coexisting with the conventional rod-like InGaN-on-GaN nanowires (RNWs) on (111)-silicon-substrate. When characterized using confocal microscopy (CFM) with 458nm laser excitation, while measuring spontaneous-emission at fixed detection wavelengths, the spatial intensity map evolved from having uniform pixelated emission, to having only an emission ring, and then a round emission spot. This corresponds to the PL emission with increasing indium composition; starting from emission mainly from the RNW, and then the 540 nm emission from one MNWs ensemble, followed by the 590 nm emission from a different MNW ensemble, respectively. These hexagonal-shaped InGaN-nano-disks ensembles were obtained during molecular-beam-epitaxy (MBE) growth. On the other hand, the regular rod-like InGaN-on-GaN nanowires (RNWs) were emitting at a shorter peak wavelength of 490 nm. While the formation of InGaN rod-like nanowire is well-understood, the formation of the hexagonal-shaped InGaN-nanodisk-on-GaN-nanowire requires further investigation. It was postulated to arise from the highly sensitive growth kinetics during plasma-assisted MBE of InGaN at low temperature, i.e. when the substrate temperature was reduced from 800 °C (GaN growth) to <600 °C (InGaN growth), during which sparsely populated metal-droplet formation prevails and further accumulated more indium adatoms due to a higher cohesive bond between metallic molecules. © (2014) COPYRIGHT Society of Photo-Optical Instrumentation Engineers (SPIE). Downloading of the abstract is permitted for personal use only.

  15. Formation of Ion Phase-Space Vortexes

    DEFF Research Database (Denmark)

    Pécseli, Hans; Trulsen, J.; Armstrong, R. J.

    1984-01-01

    The formation of ion phase space vortexes in the ion two stream region behind electrostatic ion acoustic shocks are observed in a laboratory experiment. A detailed analysis demonstrates that the evolution of such vortexes is associated with ion-ion beam instabilities and a nonlinear equation for ...

  16. Raman study of the antiferromagnetic phase transitions in hexagonal Y MnO3 and LuMnO3

    Science.gov (United States)

    Vermette, J.; Jandl, S.; Mukhin, A. A.; Ivanov, V. Yu; Balbashov, A.; Gospodinov, M. M.; Pinsard-Gaudart, L.

    2010-09-01

    The A1, E1 and E2 Raman active modes in hexagonal Y MnO3 and LuMnO3 single crystals are studied as a function of temperature and compared with previous measurements. In addition to anharmonicity, some phonon frequencies show below TN anomalous temperature dependences that reflect the atomic displacements while some other phonon frequencies are more sensitive to the spin-phonon coupling.

  17. Phase transitions and dielectric properties of a hexagonal ABX3 perovskite-type organic-inorganic hybrid compound: [C3H4NS][CdBr3].

    Science.gov (United States)

    Liao, Wei-Qiang; Ye, Heng-Yun; Zhang, Yi; Xiong, Ren-Gen

    2015-06-21

    A new organic-inorganic hexagonal perovskite-type compound with the formula ABX3, thiazolium tribromocadmate(ii) (1), in which thiazolium cations are situated in the space between the one-dimensional chains of face-sharing CdBr(6) octahedra, has been successfully synthesized. Systematic characterizations including differential scanning calorimetry measurements, variable-temperature structural analyses, and dielectric measurements reveal that it undergoes two structural phase transitions, at 180 and 146 K. These phase transitions are accompanied by remarkable dielectric relaxation and anisotropy. The thiazolium cations remain orientationally disordered during the two phase transition processes. The origins of the phase transitions at 180 and 146 K are ascribed to the slowing down and reorientation of the molecular motions of the cations, respectively. Moreover, the dielectric relaxation process well described by the Cole-Cole equation and the prominent dielectric anisotropy are also connected with the dynamics of the dipolar thiazolium cations.

  18. First-principles study of the electronic structure of PbF{sub 2} in the cubic, orthorhombic, and hexagonal phases

    Energy Technology Data Exchange (ETDEWEB)

    Jiang Huitian [Department of Physics, Michigan Technological University, Houghton, MI 49931 (United States); Orlando, Roberto [Dipartimento di Scienze e Tecnologie Avanzate, Universita del Piemonte Orientale, C. so Borsalino 54, I-15100 Alessandria (Italy); Blanco, Miguel A [Departamento de QuImica Fisica y Analitica, Universidad de Oviedo, 33006-Oviedo (Spain); Pandey, Ravindra [Department of Physics, Michigan Technological University, Houghton, MI 49931 (United States)

    2004-05-12

    The results of electronic structure calculations for PbF{sub 2} in ambient and high-pressure phases are reported here. We employ the linear combination of atomic orbital-density functional theory approximation using the CRYSTAL program package whose capabilities were expanded to include the so-called soft-core pseudopotentials with higher-order components (e.g. d, f, and g) of the angular momentum terms for heavier atoms in the periodic table. The band structure and density of states of the cubic, orthorhombic, and hexagonal phases were calculated. A direct band gap at X is predicted for the cubic phase, whereas an indirect band gap is predicted for the high-pressure phases. The density of states reveals hybridization features involving Pb s and F p orbitals in the upper valence band of PbF{sub 2}.

  19. Phase Formation Behavior in Ultrathin Iron Oxide.

    Science.gov (United States)

    Jõgi, Indrek; Jacobsson, T Jesper; Fondell, Mattis; Wätjen, Timo; Carlsson, Jan-Otto; Boman, Mats; Edvinsson, Tomas

    2015-11-17

    Nanostructured iron oxides, and especially hematite, are interesting for a wide range of applications ranging from gas sensors to renewable solar hydrogen production. A promising method for deposition of low-dimensional films is atomic layer deposition (ALD). Although a potent technique, ALD of ultrathin films is critically sensitive to the substrate and temperature conditions where initial formation of islands and crystallites influences the properties of the films. In this work, deposition at the border of the ALD window forming a hybrid ALD/pulsed CVD (pCVD) deposition is utilized to obtain a deposition less sensitive to the substrate. A thorough analysis of iron oxide phases formation on two different substrates, Si(100) and SiO2, was performed. Films between 3 and 50 nm were deposited and analyzed with diffraction techniques, high-resolution Raman spectroscopy, and optical spectroscopy. Below 10 nm nominal film thickness, island formation and phase dependent particle crystallization impose constraints for deposition of phase pure iron oxides on non-lattice-matching substrates. Films between 10 and 20 nm thickness on SiO2 could effectively be recrystallized into hematite whereas for the corresponding films on Si(100), no recrystallization occurred. For films thicker than 20 nm, phase pure hematite can be formed directly with ALD/pCVD with very low influence of the substrate on either Si or SiO2. For more lattice matched substrates such as SnO2:F, Raman spectroscopy indicated formation of the hematite phase already for films with 3 nm nominal thickness and clearly for 6 nm films. Analysis of the optical properties corroborated the analysis and showed a quantum confined blue-shift of the absorption edge for the thinnest films.

  20. Structural and electronic properties of non-magnetic intermetallic YAuX (X = Ge and Si) in hexagonal and cubic phases

    Indian Academy of Sciences (India)

    A Lekhal; F Z Benkhelifa; S Méçabih; B Abbar; B Bouhafs

    2016-02-01

    The structural and electronic properties of non-magnetic intermetallic YAuX (X = Ge and Si) crystallized in hexagonal phase have been investigated using the full potential linearized augmented-plane wave (FPLAPW) method based on the density functional theory (DFT), within the generalized gradient approximation (GGA). The calculated lattice parameters were in good agreement with experiment. Also, the structural and electronic properties of the non-magnetic half-Heusler YAuPb compound including the artificial YAuX (X = Ge and Si) calculated in cubic phase were determined. It was found that the half-Heusler YAuPb compound presented metallic character. The results showed that YAuGe in cubic phase is a semiconductor whereas the cubic YAuSi is an isolator.

  1. Experimental Observation of Travelling Hexagon Patterns in Dielectric Barrier Discharge

    Institute of Scientific and Technical Information of China (English)

    董丽芳; 贺亚峰; 尹增谦; 柴志方

    2003-01-01

    Travelling hexagon patterns have been observed in dielectric barrier discharge in an air-argon mixture. The phase diagram of hexagon pattern appearance as functions of applied voltage and air concentration is given. The spatial frequency of hexagon pattern increases with increasing applied voltage and air concentration. The current waveforms of hexagon pattern also vary with the air concentration. The drift velocity of travelling hexagon pattern changes from 4mm/s to 18mm/s.

  2. Structural, bonding, and electronic properties of the hexagonal ferroelectric and paraelectric phases of LuMnO3 compound: A density functional theory study

    Science.gov (United States)

    Sousa, A. M.; Coutinho, W. S.; Lima, A. F.; Lalic, M. V.

    2015-02-01

    We have investigated the structural, bonding, and electronic properties of both ferroelectric (FE) and paraelectric (PE) phases of the hexagonal LuMnO3 compound using calculations based on density functional theory. The structural properties have been determined by employing the generalized gradient approximation with Perdew-Burke-Ernzerhof and Wu-Cohen parameterization. The bonding and electronic properties have been treated by recently developed modified Becke-Johnson exchange potential, which succeeded to open a band gap for both PE and FE phases, in agreement with experimental predictions. The Bader's topological analysis of electronic density showed that the character of the Lu-O axial bonds changes when the crystal exhibits the PE → FE structural transition. This fact is in agreement with experimental findings. The covalent character of the Lu-O bond significantly increases due to orbital hybridization between the Lu 5dz2 and O 2pz-states. This bonding mechanism causes the ferroelectricity in the hexagonal LuMnO3 compound.

  3. Role of Mn doping for obtaining of hexagonal phase in Ba0.98Zn0.02TiO3 ceramics

    Science.gov (United States)

    Das, S. K.; Roul, B. K.

    2016-08-01

    This paper reports the observation of hexagonal phase of barium titanate by Mn doping and its effect on dielectric and magnetic properties. Ceramic samples of Ba0.98Zn0.02Ti1-xMnxO3 (where, x= 0.04, 0.06 and 0.08) were prepared by traditional solid-state reaction route. The hexagonal phase is stabilized in the composition Ba0.98Zn0.02Ti0.92Mn0.08O3 and a very feeble M-H loop is also observed in that composition. This induced magnetism is expected due to the exchange interactions between magnetic polarons formed by oxygen vacancies with Mn ions. The dielectric constant as well as the ferroelectric to paraelectric transition temperature is systematically decreased with increasing of Mn doping concentration. Further to that, the temperature dependent dielectric constant curve is also broadened at transition temperature with increasing of Mn concentration. However, the ferroelectric to paraelectric transition temperature is well above room temperature.

  4. Semiclassical TEM image formation in phase space

    Energy Technology Data Exchange (ETDEWEB)

    Lubk, Axel; Röder, Falk

    2015-04-15

    Current developments in TEM such as high-resolution imaging at low acceleration voltages and large fields of view, the ever larger capabilities of hardware aberration correction and the systematic shaping of electron beams require accurate descriptions of TEM imaging in terms of wave optics. Since full quantum mechanic solutions have not yet been established for, e.g., the theory of aberrations, we are exploring semiclassical image formation in the TEM from the perspective of quantum mechanical phase space, here. Firstly, we use two well-known semiclassical approximations, Miller's semiclassical algebra and the frozen Gaussian method, for describing the wave optical generalization of arbitrary geometric aberrations, including nonisoplanatic and slope aberrations. Secondly, we demonstrate that the Wigner function representation of phase space is well suited to also describe incoherent aberrations as well as the ramifications of partial coherence due to the emission process at the electron source. We identify a close relationship between classical phase space and Wigner function distortions due to aberrations as well as classical brightness and quantum mechanical purity. - Highlights: • We discuss several semiclassical approximations to describe image formation in the TEM. • We provide laws how aberrations modify quantum mechanical phase space. • We exhibit the close relation between quantum mechanical purity and axial brightness.

  5. An Explanation for Saturn's Hexagon

    Science.gov (United States)

    Kohler, Susanna

    2015-08-01

    For over three decades, weve been gathering observations of the mysterious hexagonal cloud pattern encircling Saturns north pole. Now, researchers believe they have a model that can better explain its formation.Fascinating GeometrySaturns northern Hexagon is a cloud band circling Saturns north pole at 78 N, first observed by the Voyager flybys in 198081. This remarkable pattern has now persisted for more than a Saturn year (29.5 Earth years).Eight frames demonstrating the motion within Saturns Hexagon. Click to watch the animation! The view is from a reference frame rotating with Saturn. [NASA/JPL-Caltech/SSI/Hampton University]Observations by Voyager and, more recently, Cassini have helped to identify many key characteristics of this bizarre structure. Two interesting things weve learned are:The Hexagon is associated with an eastward zonal jet moving at more than 200 mph.The cause of the Hexagon is believed to be a jet stream, similar to the ones that we experience on Earth. The path of the jet itself appears to follow the hexagons outline.The Hexagon rotates at roughly the same rate as Saturns overall rotation.While we observe individual storms and cloud patterns moving at different speeds within the Hexagon, the vertices of the Hexagon move at almost exactly the same rotational speed as that of Saturn itself.Attempts to model the formation of the Hexagon with a jet stream have yet to fully reproduce all of the observed features and behavior. But now, a team led by Ral Morales-Juberas of the New Mexico Institute of Mining and Technology believes they have created a model that better matches what we see.Simulating a Meandering JetThe team ran a series of simulations of an eastward, Gaussian-profile jet around Saturns pole. They introduced small perturbations to the jet and demonstrated that, as a result of the perturbations, the jet can meander into a hexagonal shape. With the initial conditions of the teams model, the meandering jet is able to settle into a

  6. Role of electronic correlation in high-low temperature phase transition of hexagonal nickel sulfide: a comparative density functional theory study with and without correction for on-site Coulomb interaction.

    Science.gov (United States)

    Zhang, Wei-Bing; Li, Jie; Tang, Bi-Yu

    2013-06-28

    The structural, electronic, magnetic, and elastic properties of hexagonal nickel sulfide (NiS) have been investigated comparatively by Density Functional theory (DFT) and DFT plus correction for on-site Coulomb interaction (DFT+U), in which two different exchange correlation functionals local density approximations (LDA) and general gradient approximations (GGA) in the form of Perdew-Burke-Ernzerhof (PBE) are used. Our results indicate LDA and PBE methods predict hexagonal NiS to be a paramagnetic metal whereas LDA(PBE)+U calculations with reasonable on-site Coulomb interaction energy give the antiferromagnetic insulating state of low temperature hexagonal NiS successfully. Meanwhile, compared with LDA(PBE) results, LDA(PBE)+U methods give larger lattice parameters, crystal volume, and shear constant c44, consistent with the experimental picture during high-low temperature phase transition of hexagonal NiS, in which an increase of the shear constant c44 and lattice parameters were found in the low-temperature antiferromagnetic phase. The present DFT and DFT+U calculations provide a reasonable description for the properties of high temperature and low temperature hexagonal NiS respectively, which indicates that electronic correlation is responsible for this high-low temperature phase transition.

  7. Semiclassical TEM image formation in phase space.

    Science.gov (United States)

    Lubk, Axel; Röder, Falk

    2015-04-01

    Current developments in TEM such as high-resolution imaging at low acceleration voltages and large fields of view, the ever larger capabilities of hardware aberration correction and the systematic shaping of electron beams require accurate descriptions of TEM imaging in terms of wave optics. Since full quantum mechanic solutions have not yet been established for, e.g., the theory of aberrations, we are exploring semiclassical image formation in the TEM from the perspective of quantum mechanical phase space, here. Firstly, we use two well-known semiclassical approximations, Miller's semiclassical algebra and the frozen Gaussian method, for describing the wave optical generalization of arbitrary geometric aberrations, including nonisoplanatic and slope aberrations. Secondly, we demonstrate that the Wigner function representation of phase space is well suited to also describe incoherent aberrations as well as the ramifications of partial coherence due to the emission process at the electron source. We identify a close relationship between classical phase space and Wigner function distortions due to aberrations as well as classical brightness and quantum mechanical purity. Copyright © 2014 Elsevier B.V. All rights reserved.

  8. Hexagonal Close-Packed ^4{He} as Crystalline Multilayered Polytype: An Alternative for `Supersolid' or `Glassy-Like' Phase

    Science.gov (United States)

    Chishko, K. A.; Antsygina, T. N.; Poltavskaya, M. I.

    2017-01-01

    We apply the model of a crystalline polytype built of close-packed 2D monoatomic basal planes with triangular lattice to interpret the anomalous thermodynamical and mechanical properties of solid hexagonal close-packed (HCP) ^4{He} . The polytype is a 3D stack of the basal planes, and its structure can be built from the simplest periodic packing (HCP, FCC, 4H, 5H, 6R, ldots etc.) up to random stacking fault system (RSFS) totally aperiodic in only c-direction perpendicular to the basal planes. RSFS is a crystal without microscopic translation symmetry along c-axis, i.e., entirely disordered in only one spatial direction. Despite of packing disorder, c-direction remains the crystallographic axis of third order at arbitrary sequence of the 2D plates in the whole stack. In a long-wave limit the HCP polytype can be treated as 3D anisotropic continuum, as a result its phonon spectrum and Helmholtz free energy have been calculated. The temperature dependence of the phonon pressure is calculated theoretically and compared with experimental data. A quantitative agreement between the theory and the experiment is achieved. Mechanical properties of ^4{He} crystals in the framework of the polytype model are briefly discussed.

  9. Synthesis of erbium,ytterbium-doped hexagonal phase sodium yttrium fluoride nanoparticles and application to ligand exchange and energy transfer studies

    Science.gov (United States)

    Goel, Vishya

    Nanoparticles containing rare earth ions have the ability to absorb and convert infrared light into visible light. The purpose of this work is to synthesize rare earth ion-doped NaYF4 nanoparticles in their most efficient form, the hexagonal phase. These nanoparticles are then used in ligand exchange and energy transfer studies. The synthesis procedure produces gram scale quantities of nanoparticles. Such a scale is important for reproducibility and application of these materials. Oleylamine-capped NaYF4 nanoparticles were synthesized and were doped with 2 % Er3+ and 20 % Yb3+ using a thermal decomposition method. The procedure was optimized in terms of precursor concentration and injection rate. The samples were characterized using photoluminescence spectroscopy, transmission electron microscopy, and X-ray diffraction. Photoluminescence spectra were collected using infrared excitation (980 nm). Control of the temperature and injection resulted in 15 nm (diameter) hexagonal phase NaYF4:Er3+,Yb3+ nanoparticles capped with oleylamine. The nanoparticles exhibited bright emission in the red (640 nm) and green (540 nm) portions of the visible spectrum. The surface of the nanoparticles was modified with decanoic acid, dodecanedioic acid, or dodecane sulfonic acid using a ligand exchange reaction. Energy transfer was studied from the oleylamine-capped nanoparticles to the fluorophores Nile Red, 4-(dicyanomethylene)-2-t-butyl-6(1,1,7,7-tetramethyljulolidyl-9-enyl)-4H-pyran, and poly(2-methoxy-5-(2-ethylhexyloxy)-1,4-phenylene vinylene). Successful surface ligand exchange was achieved and the preliminary exploration of upconverting nanoparticles as an energy transfer donor was performed.

  10. Formation of Omega-like Nanocrystalline in the Melt-Spun Nd85Al15 Alloy by Phase Transformation

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    Microstructure and subsequent phase transformations on heating of the melt-spun Nd85Al15 alloy have been studied by X-ray diffraction, transmission electron microscopy and differential scanning calorimetry. The melt-spunNds5Al15 alloy shows two-stage transformation processes as follows: amorphous+72 nm supersaturated bcc-Nd(Al)solid solution→7 nm omega-like phase→AlNd3+hexagonal Nd. The activation energies for the first and secondtransformation were found to be 100 k J/mol and 188 k J/mol, respectively. The formation mechanism of nanoscaleomega-like phase is discussed.

  11. Prediction of a hexagonal SiO2 phase affecting stabilities of MgSiO3 and CaSiO3 at multimegabar pressures.

    Science.gov (United States)

    Tsuchiya, Taku; Tsuchiya, Jun

    2011-01-25

    Ultrahigh-pressure phase relationship of SiO(2) silica in multimegabar pressure condition is still quite unclear. Here, we report a theoretical prediction on a previously uncharacterized stable structure of silica with an unexpected hexagonal Fe(2)P-type form. This phase, more stable than the cotunnite-type structure, a previously postulated postpyrite phase, was discovered to stabilize at 640 GPa through a careful structure search by means of ab initio density functional computations over various structure models. This is the first evidential result of the pressure-induced phase transition to the Fe(2)P-type structure among all dioxide compounds. The crystal structure consists of closely packed, fairly regular SiO(9) tricapped trigonal prisms with a significantly compact lattice. Additional investigation further elucidates large effects of this phase change in SiO(2) on the stability of MgSiO(3) and CaSiO(3) at multimegabar pressures. A postperovskite phase of MgSiO(3) breaks down at 1.04 TPa along an assumed adiabat of super-Earths and yields Fe(2)P-type SiO(2) and CsCl (B2)-type MgO. CaSiO(3) perovskite, on the other hand, directly dissociates into SiO(2) and metallic CaO, skipping a postperovskite polymorph. Predicted ultrahigh-pressure and temperature phase diagrams of SiO(2), MgSiO(3), and CaSiO(3) indicate that the Fe(2)P-type SiO(2) could be one of the dominant components in the deep mantles of terrestrial exoplanets and the cores of gas giants.

  12. High pressure synthesis of a hexagonal close-packed phase of the high-entropy alloy CrMnFeCoNi

    Energy Technology Data Exchange (ETDEWEB)

    Tracy, Cameron L.; Park, Sulgiye; Rittman, Dylan R.; Zinkle, Steven J.; Bei, Hongbin; Lang, Maik; Ewing, Rodney C.; Mao, Wendy L.

    2017-05-25

    High-entropy alloys, near-equiatomic solid solutions of five or more elements, represent a new strategy for the design of materials with properties superior to those of conventional alloys. However, their phase space remains constrained, with transition metal high-entropy alloys exhibiting only face- or body-centered cubic structures. Here, we report the high-pressure synthesis of a hexagonal close-packed phase of the prototypical high-entropy alloy CrMnFeCoNi. This martensitic transformation begins at 14 GPa and is attributed to suppression of the local magnetic moments, destabilizing the initial fcc structure. Similar to fcc-to-hcp transformations in Al and the noble gases, the transformation is sluggish, occurring over a range of >40 GPa. However, the behaviour of CrMnFeCoNi is unique in that the hcp phase is retained following decompression to ambient pressure, yielding metastable fcc-hcp mixtures. This demonstrates a means of tuning the structures and properties of high-entropy alloys in a manner not achievable by conventional processing techniques.

  13. High pressure synthesis of a hexagonal close-packed phase of the high-entropy alloy CrMnFeCoNi

    Science.gov (United States)

    Tracy, Cameron L.; Park, Sulgiye; Rittman, Dylan R.; Zinkle, Steven J.; Bei, Hongbin; Lang, Maik; Ewing, Rodney C.; Mao, Wendy L.

    2017-05-01

    High-entropy alloys, near-equiatomic solid solutions of five or more elements, represent a new strategy for the design of materials with properties superior to those of conventional alloys. However, their phase space remains constrained, with transition metal high-entropy alloys exhibiting only face- or body-centered cubic structures. Here, we report the high-pressure synthesis of a hexagonal close-packed phase of the prototypical high-entropy alloy CrMnFeCoNi. This martensitic transformation begins at 14 GPa and is attributed to suppression of the local magnetic moments, destabilizing the initial fcc structure. Similar to fcc-to-hcp transformations in Al and the noble gases, the transformation is sluggish, occurring over a range of >40 GPa. However, the behaviour of CrMnFeCoNi is unique in that the hcp phase is retained following decompression to ambient pressure, yielding metastable fcc-hcp mixtures. This demonstrates a means of tuning the structures and properties of high-entropy alloys in a manner not achievable by conventional processing techniques.

  14. Growth and properties of ultra-violet emitting aligned zinc oxide nanocones with hexagonal caps.

    Science.gov (United States)

    Umar, Ahmad; Al Hajry, A; Al-Ghamdi, A A; Al-Heniti, S

    2010-10-01

    Ultraviolet-emitting, single-crystalline aligned zinc oxide (ZnO) nanocones with hexagonal caps were grown on silicon substrate via simple non-catalytic thermal evaporation process. High-purity metallic zinc powder and oxygen were used as source materials for zinc and oxygen, respectively. The detailed structural characterizations confirmed that the formed products are single-crystalline, possess a wurtzite hexagonal phase and grown along the c-axis direction. Raman-active optical-phonon E2(high) mode at 437 cm(-1) with sharp and strong UV emission at 385 nm in room-temperature photoluminescence (PL) spectrum demonstrated that the as-grown ZnO nanocones with hexagonal caps possess good-crystal quality with the excellent optical properties. Finally, a plausible growth mechanism for the formation of as-grown ZnO nanocones with hexagonal caps was also proposed.

  15. Influence of NaOH on the formation and morphology of Bi{sub 2}Te{sub 3} nanostructures in a solvothermal process: From hexagonal nanoplates to nanorings

    Energy Technology Data Exchange (ETDEWEB)

    Liang Yujie [School of Science, Minzu University of China, Beijing 100081 (China); Wang, Wenzhong, E-mail: wzhwang@aphy.iphy.ac.cn [School of Science, Minzu University of China, Beijing 100081 (China); School of Physical Electronics, University of Electronic Science and Technology of China, Chengdu 610054 (China); Zeng Baoqing [School of Physical Electronics, University of Electronic Science and Technology of China, Chengdu 610054 (China); Zhang Guling [School of Science, Minzu University of China, Beijing 100081 (China); He Qingyu [Institute of Electronic Information Material and Apparatus, Laboratory of Quantum Information Technology, School of Physics and Telecommunication Engineering, South China Normal University, Guangzhou 510006 (China); Fu Junli [School of Science, Minzu University of China, Beijing 100081 (China)

    2011-09-15

    Highlights: {yields} Bi{sub 2}Te{sub 3} nanoplates and nanorings were synthesized by a simple solvothermal process. {yields} NaOH is not necessary for Bi{sub 2}Te{sub 3} nanostructure growth in a solvothermal process. {yields} Hexagonal Bi{sub 2}Te{sub 3} nanoplates were achieved with NaOH concentrations of 5-7 M. {yields} Hexagonal Bi{sub 2}Te{sub 3} nanorings were fabricated with NaOH concentrations of 9-11 M. {yields} Bi{sub 2}Te{sub 3} nanorings were fabricated by dissolving the inner part of the nanoplates with NaOH. - Abstarct: Hexagonal bismuth telluride (Bi{sub 2}Te{sub 3}) nanoplates and nanorings were synthesized by a simple solvothermal process. The composition, morphology and size of the as-prepared products were investigated by X-ray diffraction and transmission electron microscopy in detail. The systemically experiments have been performed to investigate the effect of alkaline additive NaOH on composition and morphology of Bi{sub 2}Te{sub 3} nanostructures. The results indicate that alkaline additive NaOH is not necessary for the formation of Bi{sub 2}Te{sub 3} nanostructures in a solvothermal process. However, NaOH plays an important role in determining the morphology and size of Bi{sub 2}Te{sub 3} nanostructures. When the experiment was carried out with NaOH concentration ranging from 5 to 7 M, hexagonal Bi{sub 2}Te{sub 3} nanoplates with edge length of 140-280 nm were synthesized. When the experiment was carried out at higher NaOH concentration of 9-11 M, hexagonal Bi{sub 2}Te{sub 3} nanorings were fabricated by dissolving the inner part of the hexagonal nanoplates with NaOH for the first time. A possible formation mechanism has been proposed based on the experimental results and analysis. This work may open a new rational route for the synthesis of hexagonal Bi{sub 2}Te{sub 3} nanorings which may have some scientific and technological applications in various functional devices.

  16. Solid-state 13C NMR study of banana liquid crystals - 3: Alkyl-tail-group packing environments of an acute-angle bent-core molecule in the hexagonal columnar and cubic phases

    Science.gov (United States)

    Kurosu, Hiromichi; Endo, Yumi; Kimura, Saori; Hashimoto, Tomoko; Harada, Motoi; Lee, Eun-Woo; Sone, Masato; Watanabe, Junji; Kang, Sungmin

    2016-02-01

    Solid-state 13C nuclear magnetic resonance (NMR) measurements were performed on the hexagonal columnar and cubic phases of an acute-angle banana-shaped molecule, N(1,7)-S30. In the hexagonal columnar phase, three peaks appear at the NMR chemical shifts assigned to the internal methylene carbons of alkyl tails, indicating that the two alkyl tails have different packing structures, and one of the tails has two different conformations within a single molecule. Combined cross-polarization/magic-angle spinning and pulse saturation transfer/magic-angle spinning measurements show that one of the alkyl chains is located inside and the other is located outside the columnar structure. In the cubic phase, pulse saturation transfer/magic-angle spinning measurement shows that only one peak appears at the NMR chemical shifts assigned to the internal methylene carbons of alkyl tails, indicating that both of the alkyl chains are located outside the cubic structure.

  17. Strain phase separation: Formation of ferroelastic domain structures

    Science.gov (United States)

    Xue, Fei; Li, Yongjun; Gu, Yijia; Zhang, Jinxing; Chen, Long-Qing

    2016-12-01

    Phase decomposition is a well-known process leading to the formation of two-phase mixtures. Here we show that a strain imposed on a ferroelastic crystal promotes the formation of mixed phases and domains, i.e., strain phase separation with local strains determined by a common tangent construction on the free energy versus strain curves. It is demonstrated that a domain structure can be understood using the concepts of domain/phase rule, lever rule, and coherent and incoherent strain phase separation, in a complete analogy to phase decomposition. The proposed strain phase separation model is validated using phase-field simulations and experimental observations of PbTi O3 and BiFe O3 thin films as examples. The proposed model provides a simple tool to guide and design domain structures of ferroelastic systems.

  18. One-Step Preparation of Silver Hexagonal Microsheets as Electrically Conductive Adhesive Fillers for Printed Electronics.

    Science.gov (United States)

    Ren, Hu-Ming; Guo, Ying; Huang, Sheng-Yun; Zhang, Kai; Yuen, Matthew M F; Fu, Xian-Zhu; Yu, Shuhui; Sun, Rong; Wong, Ching-Ping

    2015-06-24

    A facile one-step solution-phase chemical reduction method has been developed to synthesize Ag microsheets at room temperature. The morphology of Ag sheets is a regular hexagon more than 1 μm in size and about 200 nm in thickness. The hexagonal Ag microsheets possess a smoother and straighter surface compared with that of the commercial Ag micrometer-sized flakes prepared by ball milling for electrically conductive adhesives (ECAs). The function of the reagents and the formation mechanism of Ag hexagonal microsheets are also investigated. For the polyvinylpyrrolidone (PVP) and citrate facet-selective capping, the Ag atoms freshly reduced by N2H4 would orientationally grow alone on the {111} facet of Ag seeds, with the synergistically selective etching of irregular and small Ag particles by H2O2, to form Ag hexagonal microsheets. The hexagonal Ag microsheet-filled epoxy adhesives, as electrically conductive materials, can be easily printed on various substrates such as polyethylene terephthalate (PET), epoxy, glass, and flexible papers. The hexagonal Ag microsheet filled ECAs demonstrate lower bulk resistivity (approximately 8 × 10(-5) Ω cm) than that of the traditional Ag micrometer-sized-flake-filled ECAs with the same Ag content of 80 wt % (approximately 1.2 × 10(-4) Ω cm).

  19. Solvent effect in monoclinic to hexagonal phase transformation in LaPO{sub 4}:RE (RE=Dy{sup 3+}, Sm{sup 3+}) nanoparticles: Photoluminescence study

    Energy Technology Data Exchange (ETDEWEB)

    Phaomei, Ganngam [Department of Chemistry, Manipur University, Manipur 795003 (India); Rameshwor Singh, W., E-mail: dr.rmsingh@yahoo.co.i [Department of Chemistry, Manipur University, Manipur 795003 (India); Ningthoujam, R.S., E-mail: rsn@barc.gov.i [Chemistry Division, Bhabha Atomic Research Center, Mumbai 400085 (India)

    2011-06-15

    Nanosized phosphor materials, LaPO{sub 4}:RE (RE=Dy{sup 3+}, Sm{sup 3+}) have been synthesized using water, dimethyl sulfoxide (DMSO), ethylene glycol (EG) and mixed solvents at a relatively low temperature of 150 {sup o}C. X-ray diffraction (XRD) study reveals that as-prepared nanoparticles prepared in DMSO and EG are well crystalline and correspond to monoclinic phase. In the mixed water-DMSO or water-EG solvents, XRD patterns are in good agreement with hexagonal phase, but transformed to monoclinic phase at higher temperature of 900 {sup o}C. TEM images show well-dispersed and rice-shaped nanoparticles of diameter 5-10 nm, length of 13-37 nm for Dy{sup 3+}-doped LaPO{sub 4} and diameter of 25-35 nm, length of 73-82 nm for Sm{sup 3+}-doped LaPO{sub 4}. Dy{sup 3+}-doped LaPO{sub 4} shows two prominent emission peaks at 480 and 572 nm corresponding to {sup 4}F{sub 9/2}{yields}{sup 6}H{sub 15/2} (magnetic dipole) and {sup 4}F{sub 9/2}{yields}{sup 6}H{sub 13/2} (electric dipole) transitions, respectively. Similarly, for Sm{sup 3+}-doped LaPO{sub 4}, three prominent emission peaks at 561, 597 and 641 nm were observed corresponding to {sup 4}G{sub 5/2}{yields}{sup 6}H{sub 5/2}, {sup 4}G{sub 5/2}{yields}{sup 6}H{sub 7/2} (magnetic dipole) and {sup 4}G{sub 5/2}{yields}{sup 6}H{sub 9/2} (electric dipole) transitions, respectively. The luminescence intensity of the sample prepared in EG is more than that of DMSO or mixed solvents. Enhancement of luminescence is also observed after heat-treatment at 900 {sup o}C due to removal of quencher such as water, organic moiety and surface defects/dangling bonds. The samples are re-dispersible in polar solvent and can be incorporated in polymer film. - Research highlights: Nanomaterials. Optical properties. Luminescence materials.

  20. Polytypic phase formation in DyAl3 by rapid solidification

    Science.gov (United States)

    Xu, Yan; Altounian, Z.; Muir, W. B.

    1991-01-01

    Amorphous ribbons of AlxDy100-x, 93≳x≳85, were obtained by melt spinning. During crystallization, in addition to Al, four different metastable crystalline phases of DyAl3 were observed. These phases are, in order of appearance, the high-pressure face-centered cubic phase, γ-DyAl3 and three polytypic rhombohedral phases, β-DyAl3, β'-DyAl3, and α'-DyAl3. It is the first time that the β' phase in rare-earth trialuminides and the α' phase in Dy-Al alloy system have been observed. It is shown that all these phases are associated with the polytypic packing of the hexagonal DyAl3 atomic layers. The relative stability of the phases is found to be related to the hexagonal to cubic stacking ratio in the structure.

  1. Gel phase formation in dilute triblock copolyelectrolyte complexes

    Science.gov (United States)

    Srivastava, Samanvaya; Andreev, Marat; Levi, Adam E.; Goldfeld, David J.; Mao, Jun; Heller, William T.; Prabhu, Vivek M.; de Pablo, Juan J.; Tirrell, Matthew V.

    2017-02-01

    Assembly of oppositely charged triblock copolyelectrolytes into phase-separated gels at low polymer concentrations (formation of a dilute phase of individual micelles is prevented in polyelectrolyte complexation-driven assembly of triblock copolyelectrolytes. Gel phases form and phase separate almost instantaneously on solvation of the copolymers. Furthermore, molecular models of self-assembly demonstrate the presence of oligo-chain aggregates in early stages of copolyelectrolyte assembly, at experimentally unobservable polymer concentrations. Our discoveries contribute to the fundamental understanding of the structure and pathways of complexation-driven assemblies, and raise intriguing prospects for gel formation at extraordinarily low concentrations, with applications in tissue engineering, agriculture, water purification and theranostics.

  2. Analysis of phase formation in multi-component alloys

    Energy Technology Data Exchange (ETDEWEB)

    Raghavan, R.; Hari Kumar, K.C. [Department of Metallurgical and Materials Engineering, Indian Institute of Technology Madras, Chennai (India); Murty, B.S., E-mail: murty@iitm.ac.in [Department of Metallurgical and Materials Engineering, Indian Institute of Technology Madras, Chennai (India)

    2012-12-15

    Highlights: Black-Right-Pointing-Pointer CALPHAD approach appears to predict BCC phase formation more accurately than FCC phase formation. Black-Right-Pointing-Pointer Solid solution is favored when the {Delta}S{sub config}/{Delta}S{sub fusion} > 1 for equiatomic alloys. Black-Right-Pointing-Pointer Solid solution is favored when the {Delta}S{sub config}/{Delta}S{sub fusion} > 1.2 for non-equiatomic alloys. Black-Right-Pointing-Pointer BCC phase is favored when atomic size difference is larger, as reflected by a higher value of {Delta}S{sub {sigma}}/k. Black-Right-Pointing-Pointer FCC and BCC phase formation appears to be governed mainly by {Delta}H{sub mix} and {Delta}S{sub {sigma}}/k, respectively. - Abstract: An attempt has been made to predict phase formation using a CALPHAD-based approach for a large number of compositions that are known to form FCC, BCC and a mixture of FCC and BCC phases. The stable phase is assumed to be the first phase that is formed upon cooling from liquid state with the highest driving force. The driving force for other phases at the transition for various compositions is also presented. A comparison between the parametric approach of phase prediction by study of thermodynamic and topological parameters on one hand and the CALPHAD approach on the other is also presented. CALPHAD approach appears to predict BCC phase formation much more accurately than the FCC phase formation. The results indicate that solid solution formation in multicomponent alloys is favored when the ratio of {Delta}S{sub config}/{Delta}S{sub fusion} is greater than 1 and 1.2 for equiatomic and non-equiatomic alloys, respectively. The results also point out that BCC phase is favored when the atomic size difference is larger, which is reflected by a higher value of {Delta}S{sub {sigma}}/k. Formation of FCC phase appears to be governed mainly by {Delta}H{sub mix}, while BCC phase governed by {Delta}S{sub {sigma}}/k, which is representative of strain in the structure.

  3. Phase behavior and structure formation of hairy-rod supramolecules

    NARCIS (Netherlands)

    Subbotin, A; Stepanyan, R; Knaapila, M; Ikkala, O; ten Brinke, G

    2003-01-01

    Phase behavior and microstructure formation of rod and coil molecules, which can associate to form hairy-rod polymeric supramolecules, are addressed theoretically. Association induces considerable compatibility enhancement between the rod and coil molecules and various microscopically ordered struct

  4. Co-phasing the planet formation imager

    Science.gov (United States)

    Petrov, Romain G.; Boskri, Abdelkarim; Elhalkouj, Thami; Monnier, John; Ireland, Michael; Kraus, Stefan

    2016-08-01

    The Planet Formation Imager (PFI) is a project for a very large optical interferometer intended to obtain images of the planet formation process at scales as small as the Hill sphere of giant exoplanets. Its main science instruments will work in the thermal infrared but it will be cophased in the near infrared, where it requires also some capacity for scientific imaging. PFI imaging and resolution specifications imply an array of 12 to 20 apertures and baselines up to a few kilometers cophased at near infrared coherent magnitudes as large as 10. This paper discusses various cophasing architectures and the corresponding minimum diameter of individual apertures, which is the dominant element of PFI cost estimates. From a global analysis of the possible combinations of pairwise fringe sensors, we show that conventional approaches used in current interferometers imply the use of prohibitively large telescopes and we indicate the innovative strategies that would allow building PFI with affordable apertures smaller than 2 m in diameter. The approach with the best potential appears to be Hierarchical Fringe Tracking based on "two beams spatial filters" that cophase pairs of neighboring telescopes with all the efficiency of a two telescopes fringe tracker and transmit most of the flux as if it was produced by an unique single mode aperture to cophase pairs of pairs and then pairs of groups of apertures. We consider also the adaptation to PFI of more conventional approaches such as a combination of GRAVITY like fringe trackers or single or multiple chains of 2T fringe trackers.

  5. Soliton formation in the FFLO phase

    Science.gov (United States)

    Croitoru, M. D.; Buzdin, A. I.

    2016-12-01

    There is increasing body of experimental evidences of the Fulde-Ferrell-Larkin-Ovchinnikov (FFLO) phase in quasi-low-dimensional organic and heavy-fermion superconductors. The emergence of the FFLO phase has been demonstrated mainly based on a thermodynamic quantity or microscopically with spin polarization distribution that exhibit anomalies within the superconducting state in the presence of the in-plane magnetic field. However, the direct observation of superconducting order parameter modulation is so far (still) missing. Within the quasiclassical approach and Ginzburg-Landau formalism we study how the orbital effect of the in-plane field influences the FFLO instability in quasi-one-dimensional superconductors with a sufficiently weak interlayer coupling locking the magnetic flux to Josephson-type vortices. By making use of the continuum limit approximation of the Frenkel-Kontorova model for competing periodicities, we find and characterize the locking behavior of the modulation wave vector, when it remains equal to the magnetic length through some range of values of the external field.

  6. Thermally induced fluid reversed hexagonal (H(II)) mesophase.

    Science.gov (United States)

    Amar-Yuli, Idit; Wachtel, Ellen; Shalev, Deborah E; Moshe, Hagai; Aserin, Abraham; Garti, Nissim

    2007-12-06

    In the present study we characterized the microstructures of the Lc and HII phases in a glycerol monooleate (GMO)/tricaprylin (TAG)/water mixture as a function of temperature. We studied the factors that govern the formation of a low-viscosity HII phase at relatively elevated temperatures (>35 degrees C). This phase has very valuable physical characteristics and properties. The techniques used were differential scanning calorimetry (DSC), wide- and small-angle X-ray scattering (WAXS and SAXS, respectively), NMR (self-diffusion and (2)H NMR), and Fourier transform infrared (FTIR) spectroscopies. The reverse hexagonal phase exhibited relatively rapid flow of water in the inner channels within the densely packed cylindrical aggregates of GMO with TAG molecules located in the interstices. The existence of two water diffusion peaks reflects the existence of both mobile water and hydration water at the GMO-water interface (hydrogen exchange between the GMO hydroxyls and water molecules). Above 35 degrees C, the sample became fluid yet hexagonal symmetry was maintained. The fluidity of the HII phase is explained by a significant reduction in the domain size and also perhaps cylinder length. This phenomenon was characterized by higher mobility of the GMO, lower mobility of the water, and a significant dehydration process.

  7. Gel phase formation in dilute triblock copolyelectrolyte complexes

    Energy Technology Data Exchange (ETDEWEB)

    Srivastava, Samanvaya; Andreev, Marat; Levi, Adam E.; Goldfeld, David J.; Mao, Jun; Heller, William T.; Prabhu, Vivek M.; de Pablo, Juan J.; Tirrell, Matthew V.

    2017-02-23

    Assembly of oppositely charged triblock copolyelectrolytes into phase-separated gels at low polymer concentrations (<1% by mass) has been observed in scattering experiments and molecular dynamics simulations. Here we show that in contrast to uncharged, amphiphilic block copolymers that form discrete micelles at low concentrations and enter a phase of strongly interacting micelles in a gradual manner with increasing concentration, the formation of a dilute phase of individual micelles is prevented in polyelectrolyte complexation-driven assembly of triblock copolyelectrolytes. Gel phases form and phase separate almost instantaneously on solvation of the copolymers. Furthermore, molecular models of self-assembly demonstrate the presence of oligo-chain aggregates in early stages of copolyelectrolyte assembly, at experimentally unobservable polymer concentrations. Our discoveries contribute to the fundamental understanding of the structure and pathways of complexation-driven assemblies, and raise intriguing prospects for gel formation at extraordinarily low concentrations, with applications in tissue engineering, agriculture, water purification and theranostics.

  8. Effect of alteration phase formation on the glass dissolution rate

    Energy Technology Data Exchange (ETDEWEB)

    Ebert, W.L.

    1997-10-01

    The dissolution rates of many glasses have been observed to increase upon the formation of certain alteration phases. It is important to understand the mechanism by which alteration phases affect glass corrosion behavior and the glass dissolution rate to reliably predict whether or not similar effects will occur in a disposal environment and the impact of phase formation on the long-term performance of waste glass. While solid state transformation of a glass to thermodynamically more stable phases in kinetically prohibitive, contact by water provides an energetically favorable pathway for this transformation to occur by a dissolution-reprecipitation mechanism. The kinetics of the transformation depends on the dissolution kinetics of the glass and the precipitation kinetics of the alteration phases. The rates of these two processes are linked primarily through the solution activity of orthosilicic acid (and perhaps also that of an aluminum-bearing species).

  9. Matchings in hexagonal cacti

    Directory of Open Access Journals (Sweden)

    E. J. Farrell

    1987-01-01

    Full Text Available Explicit recurrences are derived for the matching polynomials of the basic types of hexagonal cacti, the linear cactus and the star cactus and also for an associated graph, called the hexagonal crown. Tables of the polynomials are given for each type of graph. Explicit formulae are then obtained for the number of defect-d matchings in the graphs, for various values of d. In particular, formulae are derived for the number of perfect matchings in all three types of graphs. Finally, results are given for the total number of matchings in the graphs.

  10. Hydrothermal synthesis of hexagonal-phase NaYF4: Er, Yb with different shapes for application as photovoltaic up-converters

    Institute of Scientific and Technical Information of China (English)

    Wang Dong-Feng; Zhang Xiao-Dan; Liu Yong-Juan; Wu Chun-Ya; Zhang Cun-Shan; Wei Chang-Chun; Zhao Ying

    2013-01-01

    Hexagonalβ-NaYF4 co-doped with Yb3+ and Er3+ is directly synthesized under mild conditions using a hydrothermal method.The variation of the ratio of Ln3+ to F and ethylenediaminetetraacetic acid (EDTA) causes the shape of the microcrystal to change from microplate to microcolumn.The NaYF4 powder is mixed with polydimethylsiloxane (PDMS)to create an up-converter for thin film amorphous silicon solar cells so as to evaluate the effectiveness of the synthesized material as an up-converter.In order to overcome the difficulty in measuring the effectiveness of up-conversion material,a new method of using near infrared illumination to measure the short circuit current densities of solar cells both with and without up-converters is developed.An up-converter with pure hexagonal NaYF4:yb3+/Er3+ microcrystal produces a high current output.Emission intensity data obtained by photoluminescence suggest that pure hexagonal NaYF4:yb3+/Er3+ microcrystals are more efficient than nanocrystals when used as up-converting phosphors.

  11. Formation of nano quasicrystalline and crystalline phases by mechanical alloying

    Energy Technology Data Exchange (ETDEWEB)

    Shamah, A.M.; Ibrahim, S. [Faculty of Petroleum and Mining Engineering, Suez Canal University, Suez (Egypt); Hanna, F.F., E-mail: fariedhanna@yahoo.com [Faculty of Petroleum and Mining Engineering, Suez Canal University, Suez (Egypt)

    2011-02-03

    Research highlights: > Mechanical alloying (MA) is an important method to investigate the formation of nano sized quasicrystalline phases in Al{sub 86}Cr{sub 14}, Al{sub 84}Fe{sub 16} and Al{sub 62.5}Cu{sub 25}Fe{sub 12.5} compounds. The second part of the present work is an attempt to examine the possibility of formation of the i-phase of the Al{sub 62.5}Cu{sub 25}Fe{sub 12.5}, which lies in the region of the perfect i-phase in the ternary phase diagram, by rapid solidification method. To perform the obtained quasi phase mechanical alloying and heat treatment at the rapid solidified sample were done. - Abstract: In the present work, the formation of nano quasicrystalline icosahedral phase in Al{sub 86}Cr{sub 14}, Al{sub 84}Fe{sub 16} and Al{sub 62.5}Cu{sub 25}Fe{sub 12.5} alloys has been investigated by mechanical alloying. Mixtures of quasicrystalline and related crystalline phases have been observed under various milling conditions. The X-ray diffraction, differential thermal analysis and electrical resistivity techniques have been used for characterization and physical property measurements. The particle size was calculated by X-ray profile using Williamson-Hall plot method and it was found to be 25-50 nm size.

  12. Controlling nickel silicide phase formation by Si implantation damage

    Energy Technology Data Exchange (ETDEWEB)

    Guihard, M.; Turcotte-Tremblay, P. [Departement de Physique, Universite de Montreal, Montreal (Canada); Gaudet, S.; Coia, C. [Departement de Genie Physique, Ecole Polytechnique de Montreal, Montreal (Canada); Roorda, S. [Departement de Physique, Universite de Montreal, Montreal (Canada); Desjardins, P. [Departement de Genie Physique, Ecole Polytechnique de Montreal, Montreal (Canada); Lavoie, C. [IBM T.J. Watson Research Center, Yorktown Heights, New York (United States); Schiettekatte, F. [Departement de Physique, Universite de Montreal, Montreal (Canada)], E-mail: francois.schiettekatte@umontreal.ca

    2009-05-01

    In the context of fabrication process of contacts in CMOS integrated circuits, we studied the effect of implantation-induced damage on the Ni silicide phase formation sequence. The device layers of Silicon-on-insulator samples were implanted with 30 or 60 keV Si ions at several fluences up to amorphization. Next, 10 or 30 nm Ni layers were deposited. The monitoring of annealing treatments was achieved with time-resolved X-ray diffraction (XRD) technique. Rutherford Backscattering Spectrometry and pole figure XRD were also used to characterize some intermediate phase formations. We show the existence of an implantation threshold (1 ions/nm{sup 2}) from where the silicidation behaviour changes significantly, the formation temperature of the disilicide namely shifting abruptly from 800 to 450 deg. C. It is also found that the monosilicide formation onset temperature for the thinner Ni deposits increases linearly by about 30 deg. C with the amount of damage.

  13. Phase coexistence in ferroelectric solid solutions: Formation of monoclinic phase with enhanced piezoelectricity

    Directory of Open Access Journals (Sweden)

    Xiaoyan Lu

    2016-10-01

    Full Text Available Phase morphology and corresponding piezoelectricity in ferroelectric solid solutions were studied by using a phenomenological theory with the consideration of phase coexistence. Results have shown that phases with similar energy potentials can coexist, thus induce interfacial stresses which lead to the formation of adaptive monoclinic phases. A new tetragonal-like monoclinic to rhombohedral-like monoclinic phase transition was predicted in a shear stress state. Enhanced piezoelectricity can be achieved by manipulating the stress state close to a critical stress field. Phase coexistence is universal in ferroelectric solid solutions and may provide a way to optimize ultra-fine structures and proper stress states to achieve ultrahigh piezoelectricity.

  14. Formative pluripotency: the executive phase in a developmental continuum.

    Science.gov (United States)

    Smith, Austin

    2017-02-01

    The regulative capability of single cells to give rise to all primary embryonic lineages is termed pluripotency. Observations of fluctuating gene expression and phenotypic heterogeneity in vitro have fostered a conception of pluripotency as an intrinsically metastable and precarious state. However, in the embryo and in defined culture environments the properties of pluripotent cells change in an orderly sequence. Two phases of pluripotency, called naïve and primed, have previously been described. In this Hypothesis article, a third phase, called formative pluripotency, is proposed to exist as part of a developmental continuum between the naïve and primed phases. The formative phase is hypothesised to be enabling for the execution of pluripotency, entailing remodelling of transcriptional, epigenetic, signalling and metabolic networks to constitute multi-lineage competence and responsiveness to specification cues.

  15. Multi-Phase Galaxy Formation and Quasar Absorption Systems

    OpenAIRE

    Maller, Ariyeh H.

    2005-01-01

    The central problem of galaxy formation is understanding the cooling and condensation of gas in dark matter halos. It is now clear that to match observations this requires further physics than the simple assumptions of single phase gas cooling. A model of multi-phase cooling (Maller & Bullock 2004) can successfully account for the upper cutoff in the masses of galaxies and provides a natural explanation of many types of absorption systems (Mo & Miralda-Escude 1996). Absorption systems are our...

  16. Atomic scale modelling of hexagonal structured metallic fission product alloys.

    Science.gov (United States)

    Middleburgh, S C; King, D M; Lumpkin, G R

    2015-04-01

    Noble metal particles in the Mo-Pd-Rh-Ru-Tc system have been simulated on the atomic scale using density functional theory techniques for the first time. The composition and behaviour of the epsilon phases are consistent with high-entropy alloys (or multi-principal component alloys)-making the epsilon phase the only hexagonally close packed high-entropy alloy currently described. Configurational entropy effects were considered to predict the stability of the alloys with increasing temperatures. The variation of Mo content was modelled to understand the change in alloy structure and behaviour with fuel burnup (Mo molar content decreases in these alloys as burnup increases). The predicted structures compare extremely well with experimentally ascertained values. Vacancy formation energies and the behaviour of extrinsic defects (including iodine and xenon) in the epsilon phase were also investigated to further understand the impact that the metallic precipitates have on fuel performance.

  17. Hexagonal OsB{sub 2}: Sintering, microstructure and mechanical properties

    Energy Technology Data Exchange (ETDEWEB)

    Xie, Zhilin [Department of Mechanical and Aerospace Engineering, University of Central Florida, Orlando, FL 32816 (United States); Lugovy, Mykola [Department of Mechanical and Aerospace Engineering, University of Central Florida, Orlando, FL 32816 (United States); Institute for Problems of Materials Science, 3 Krzhizhanivskii Str., Kyiv 03142 (Ukraine); Orlovskaya, Nina, E-mail: Nina.Orlovskaya@ucf.edu [Department of Mechanical and Aerospace Engineering, University of Central Florida, Orlando, FL 32816 (United States); Graule, Thomas; Kuebler, Jakob [Empa, Swiss Federal Laboratories for Materials Science and Technology, Laboratory for High Performance Ceramics, CH-8600 Dubendorf (Switzerland); Mueller, Martin [Laboratory of Mechanical Metallurgy, EPFL, CH-1015 Lausanne (Switzerland); Gao, Huili [Department of Mechanical Engineering, Texas A& M University, College Station, TX 77843 (United States); Radovic, Miladin [Department of Materials Science and Engineering, Texas A& M University, College Station, TX 77843 (United States); Cullen, David A. [Materials Science & Technology Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831 (United States)

    2015-06-15

    Highlights: • ReB{sub 2}-type hexagonal OsB{sub 2} powder has been densified by spark plasma sintering. • The sintered OsB{sub 2} contains ∼80 wt.% hexagonal and ∼20 wt.% orthorhombic phases. • The average grain size of the sintered OsB{sub 2} sample was 0.56 ± 0.26 μm. • H = 31 ± 9 GPa and E = 574 ± 112 GPa measured by nanoindentation. - Abstract: The metastable high pressure ReB{sub 2}-type hexagonal OsB{sub 2} bulk ceramics was produced by spark plasma sintering. The phase composition, microstructure, and mechanical behavior of the sintered OsB{sub 2} were studied by X-ray diffraction, optical microscopy, TEM, SEM, EDS, and nanoindentation. The produced ceramics was rather porous and contained a mixture of hexagonal (∼80 wt.%) and orthorhombic (∼20 wt.%) phases as identified by X-ray diffraction and EBSD analysis. Two boron-rich phases, which do not contain Os, were also identified by TEM and SEM/EDS analysis. Nanoindentation measurements yielded a hardness of 31 ± 9 GPa and Young’s modulus of 574 ± 112 GPa, indicating that the material is rather hard and very stiff; however, it is very prone to crack formation and propagation, which is indicative of a very brittle nature of this material. Improvements in the sintering regime are required in order to produce dense, homogeneous and single phase hexagonal OsB{sub 2} bulk ceramics.

  18. Field-induced magnetic phase transitions and correlated electronic states in the hexagonal RAgGE and RPtIn series

    Energy Technology Data Exchange (ETDEWEB)

    Morosan, Emilia [Iowa State Univ., Ames, IA (United States)

    2005-01-01

    The present work was initially motivated by the desire to continue the study of complex metamagnetism in relation to the crystal structure of various compounds; this study already included tetragonal compounds like HoNi2B2C (Canfield 1997b; Kalatsky 1998) and DyAgSb2 (Myers 1999), in which the rare earths occupy unique tetragonal positions. We intended to find hexagonal systems suited for such a study, with complex metamagnetic properties, and the search for extremely anisotropic hexagonal compounds turned into a rewarding exploration. We identified and grew most of the heavy rare earth members of two isostructural series, RAgGe and RPtIn, both belonging to the hexagonal Fe2P family of materials. In each of these series we found one compound, TmAgGe, and TbPtIn respectively, that was suitable for a simple study of angular dependent metamagnetism: they had three rare earth ions in the unit cell, positioned at a unique crystallographic site with orthorhombic point symmetry. The magnetization of both TmAgGe and TbPtIn was extremely anisotropic, with larger values for the in-plane orientation of the applied field than in the axial direction. Complex metamagnetic transitions existed for field within the ab-plane, and, similar to the case of the tetragonal compounds RNi2B2C and DyAgSb2, they depended on the field orientation within the basal plane. We were thus able to develop a two-dimensional model, the three co-planar Ising-like systems model, which described well the angular dependence of the metamagnetic transitions in the TmAgGe and TbPtIn hexagonal compounds. Having three magnetic moments in the hexagonal unit cell, in orthorhombic point symmetry positions, added to the complexity of the analysis compared to the case of tetragonal compounds having one rare earth atom per unit cell, in tetragonal point symmetry. However, the three co-planar Ising-like systems model yielded complex, but

  19. Accretion disks before (?) the main planet formation phase

    NARCIS (Netherlands)

    Dominik, C.

    2009-01-01

    Protoplanetary disks are the sites of planet formation and therefore one of the foremost targets of future facilities in astronomy. In this review, I will discuss the main options for using JWST and concurrent facilities to study the early, gas-rich, massive phases of protoplanetary disks. We discus

  20. Sigma phase formation kinetics in stainless steel laminate composites

    Energy Technology Data Exchange (ETDEWEB)

    Wenmen, D.W.; Olson, D.L.; Matlock, D.K. [Colorado School of Mines, Golden, CO (United States)] [and others

    1994-12-31

    Stainless steel laminate composites were made to simulate weld microstructures. The use of laminates with variations in chemical composition allows for one dimensional analysis of phase transformation associated with the more complex three-dimensional solidification experience of weld metal. Alternate layers of austenitic (304L and 316L) and ferritic (Ebrite) stainless steels allowed for the study of sigma phase formation at the austenite-ferrite interface in duplex stainless steel. Two austenitic stainless steels, 304L (18.5Cr-9.2Ni-0.3Mo) and 316L (16.2Cr-10.1Ni-2.6Mo), and one ferritic stainless steel, Ebrite (26.3Cr-0Ni-1.0Mo) were received in the form of sheet which was laboratory cold rolled to a final thickness of 0.25 mm (0.030 in.). Laminate composites were prepared by laboratory hot rolling a vacuum encapsulated compact of alternating layers of the ferrite steel with either 304L or 316L stainless steel sheets. Laminate composite specimens, which simulate duplex austenite-ferrite weld metal structure, were used to establish the kinetics of nucleation and growth of sigma phase. The factors affecting sigma phase formation were identified. The effects of time, temperature, and transport of chromium and nickel were evaluated and used to establish a model for sigma phase formation in the austenite-ferrite interfacial region. Information useful for designing stainless steel welding consumables to be used for high temperature service was determined.

  1. Hexagonal quartz resonator

    Science.gov (United States)

    Peters, Roswell D. M.

    1982-01-01

    A generally flat, relatively thin AT-cut piezoelectric resonator element structured to minimize the force-frequency effect when mounted and energized in a housing. The resonator is in the form of an equilateral hexagon with the X crystallographic axis of the crystal passing through one set of opposing corners with mounting being effected at an adjacent set of corners respectively .+-.60.degree. away from the X axis which thereby results in a substantially zero frequency shift of the operating frequency.

  2. Hexagonalization of Correlation Functions

    CERN Document Server

    Fleury, Thiago

    2016-01-01

    We propose a nonperturbative framework to study general correlation functions of single-trace operators in $\\mathcal{N}=4$ supersymmetric Yang-Mills theory at large $N$. The basic strategy is to decompose them into fundamental building blocks called the hexagon form factors, which were introduced earlier to study structure constants using integrability. The decomposition is akin to a triangulation of a Riemann surface, and we thus call it hexagonalization. We propose a set of rules to glue the hexagons together based on symmetry, which naturally incorporate the dependence on the conformal and the R-symmetry cross ratios. Our method is conceptually different from the conventional operator product expansion and automatically takes into account multi-trace operators exchanged in OPE channels. To illustrate the idea in simple set-ups, we compute four-point functions of BPS operators of arbitrary lengths and correlation functions of one Konishi operator and three short BPS operators, all at one loop. In all cases,...

  3. Star formation and gas phase history of the cosmic web

    Science.gov (United States)

    Snedden, Ali; Coughlin, Jared; Phillips, Lara Arielle; Mathews, Grant; Suh, In-Saeng

    2016-01-01

    We present a new method of tracking and characterizing the environment in which galaxies and their associated circumgalactic medium evolve. We have developed a structure finding algorithm that uses the rate of change of the density gradient to self-consistently parse and follow the evolution of groups/clusters, filaments and voids in large-scale structure simulations. We use this to trace the complete evolution of the baryons in the gas phase and the star formation history within each structure in our simulated volume. We vary the structure measure threshold to probe the complex inner structure of star-forming regions in poor clusters, filaments and voids. We find that the majority of star formation occurs in cold, condensed gas in filaments at intermediate redshifts (z ˜ 3). We also show that much of the star formation above a redshift z = 3 occurs in low-contrast regions of filaments, but as the density contrast increases at lower redshift, star formation switches to the high-contrast regions, or inner parts, of filaments. Since filaments bridge the void and cluster regions, it suggests that the majority of star formation occurs in galaxies in intermediate density regions prior to the accretion on to groups/clusters. We find that both filaments and poor clusters are multiphase environments distinguishing themselves by different distributions of gas phases.

  4. Clustering of O–X, X = (Ag, Al, Ga, Sn, Sc, Zn, Zr) point defects in hexagonal Ti: Formation mechanism and ductility variations

    Energy Technology Data Exchange (ETDEWEB)

    Kwasniak, P., E-mail: piotr.kwasniak@inmat.pw.edu.pl; Muzyk, M.; Garbacz, H.; Kurzydlowski, K.J.

    2015-03-15

    The interactions of prime interstitial and alloying elements in hexagonal Ti were investigated using a density functional theory calculations. The binding energies of oxygen with all substitution elements whose solubility limit in α-Ti is greater than 3 at% were calculated. The investigations performed reveal no attraction between Zn, Zr, Ag and O, and strong O–Sc and O–Sn binding. It was found that the O–X clustering mechanism is based on a direct and long-range O–X interaction, both controlled by valence structure and electronegativity of substitational elements. The single crystal and isotropic elastic constants together with Pugh's plasticity criterion were calculated for Ti with multiple point defects to evaluate their impact on mechanical properties. The results obtained reveal that a low concentration of O improves ductility in Ti + Sc solid solutions and increases the brittleness of Ti + Sn alloys. The diverse effect on ductility is due to different chemical bond types in the vicinity of O. The results show that the interstitial-substitational elements clustering effect may be used to optimize mechanical properties of α-Ti alloys. - Highlights: • DFT calculations were performed to investigate the point defects binding in α-Ti. • Sn and Sc exhibit the highest attraction to O in α-Ti lattice. • O–X interaction is controlled by short- and long range interactions. • Oxygen can suppress or enhance ductility of α-Ti-X solid solutions.

  5. Simulating the Phases of the Moon Shortly After Its Formation

    CERN Document Server

    Noordeh, Emil; Cuk, Matija

    2015-01-01

    The leading theory for the origin of the Moon is the giant impact hypothesis, in which the Moon was formed out of the debris left over from the collision of a Mars-sized body with the Earth. Soon after its formation, the orbit of the Moon may have been very different than it is today. We have simulated the phases of the Moon in a model for its formation wherein the Moon develops a highly elliptical orbit with its major axis tangential to the Earth's orbit. This note describes these simulations and their pedagogical value.

  6. Phase formation during the carbothermic reduction of eudialyte concentrate

    Science.gov (United States)

    Krasikov, S. A.; Upolovnikova, A. G.; Sitnikova, O. A.; Ponomarenko, A. A.; Agafonov, S. N.; Zhidovinova, S. V.; Maiorov, D. V.

    2013-07-01

    The phase transformations of eudialyte concentrate during the carbothermic reduction in the temperature range 25-2000°C are studied by thermodynamic simulation, differential thermal analysis, and X-ray diffraction. As the temperature increases to 1500°C, the following phases are found to form sequentially: iron and manganese carbides, free iron, niobium carbide, iron silicides, silicon and titanium carbides, and free silicon. Strontium, yttrium, and uranium in the temperature range under study are not reduced and are retained in an oxide form, and insignificant reduction of zirconium oxides with the formation of carbide ZrC is possible only at temperatures above 1500°C.

  7. Nonlinear dynamic theory for photorefractive phase hologram formation

    Science.gov (United States)

    Kim, D. M.; Shah, R. R.; Rabson, T. A.; Tittle, F. K.

    1976-01-01

    A nonlinear dynamic theory is developed for the formation of photorefractive volume phase holograms. A feedback mechanism existing between the photogenerated field and free-electron density, treated explicitly, yields the growth and saturation of the space-charge field in a time scale characterized by the coupling strength between them. The expression for the field reduces in the short-time limit to previous theories and approaches in the long-time limit the internal or photovoltaic field. Additionally, the phase of the space charge field is shown to be time-dependent.

  8. Enabling Technologies for Direct Detection Optical Phase Modulation Formats

    Science.gov (United States)

    Xu, Xian

    Phase modulation formats are believed to be one of the key enabling techniques for next generation high speed long haul fiber-optic communication systems due to the following main advantages: (1) with a balanced detection, a better receiver sensitivity over conventional intensity modulation formats, e.g., a ˜3-dB sensitivity improvement using differential phase shift keying (DPSK) and a ˜1.3-dB sensitivity improvement using differential quadrature phase shift keying (DQPSK); (2) excellent robustness against fiber nonlinearities; (3) high spectrum efficiency when using multilevel phase modulation formats, such as DQPSK. As the information is encoded in the phase of the optical field, the phase modulation formats are sensitive to the phase-related impairments and the deterioration induced in the phase-intensity conversion. This consequently creates new challenging issues. The research objective of this thesis is to depict some of the challenging issues and provide possible solutions. The first challenge is the cross-phase modulation (XPM) penalty for the phase modulated channels co-propagating with the intensity modulated channels. The penalty comes from the pattern dependent intensity fluctuations of the neighboring intensity modulated channels being converted into phase noise in the phase modulation channels. We propose a model to theoretically analyze the XPM penalty dependence on the walk off effect. From this model, we suggest that using fibers with large local dispersion or intentionally introducing some residual dispersion per span would help mitigate the XPM penalty. The second challenge is the polarization dependent frequency shift (PDf) induced penalty during the phase-intensity conversion. The direct detection DPSK is usually demodulated in a Mach-Zehnder delay interferometer (DI). The polarization dependence of DI introduces a PDf causing a frequency offset between the laser's frequency and the transmissivity peak of DI, degrading the demodulated DPSK

  9. Carbon-assisted chemical vapor deposition of hexagonal boron nitride

    Science.gov (United States)

    Ismach, Ariel; Chou, Harry; Mende, Patrick; Dolocan, Andrei; Addou, Rafik; Aloni, Shaul; Wallace, Robert; Feenstra, Randall; Ruoff, Rodney S.; Colombo, Luigi

    2017-06-01

    We show that in a low-pressure chemical vapor deposition (CVD) system, the residual oxygen and/or air play a crucial role in the mechanism of the growth of hexagonal boron nitride (h-BN) films on Ni foil ‘enclosures’. Hexagonal-BN films grow on the Ni foil surface via the formation of an intermediate boric-oxide (BO x ) phase followed by a thermal reduction of the BO x by a carbon source (either amorphous carbon powder or methane), leading to the formation of single- and bi-layer h-BN. Low energy electron microscopy (LEEM) and diffraction (LEED) were used to map the number of layers over large areas; Raman spectroscopy, time-of-flight secondary ion mass spectrometry (ToF-SIMS), x-ray photoelectron spectroscopy (XPS) and scanning tunneling microscopy (STM) were used to characterize the structure and physical quality of the ultra-thin h-BN film. The growth procedure reported here leads to a better understanding and control of the synthesis of ultra-thin h-BN films.

  10. Simulating the Phases of the Moon Shortly after Its Formation

    Science.gov (United States)

    Noordeh, Emil; Hall, Patrick; Cuk, Matija

    2014-01-01

    The leading theory for the origin of the Moon is the giant impact hypothesis, in which the Moon was formed out of the debris left over from the collision of a Mars sized body with the Earth. Soon after its formation, the orbit of the Moon may have been very different than it is today. We have simulated the phases of the Moon in a model for its…

  11. Hexagonal graphene quantum dots

    KAUST Repository

    Ghosh, S.

    2016-12-05

    We study hexagonal graphene quantum dots, using density functional theory, to obtain a quantitative description of the electronic properties and their size dependence, considering disk and ring geometries with both armchair and zigzag edges. We show that the electronic properties of quantum dots with armchair edges are more sensitive to structural details than those with zigzag edges. As functions of the inner and outer radii, we find in the case of armchair edges that the size of the band gap follows distinct branches, while in the case of zigzag edges it changes monotonically. This behaviour is further analyzed by studying the ground state wave function and explained in terms of its localisation.

  12. Phase separation dynamics during Myxococcus xanthus fruiting body formation

    Science.gov (United States)

    Liu, Guannan; Bahar, Fatmagul; Patch, Adam; Thutupalli, Shashi; Yllanes, David; Marchetti, M. Cristina; Welch, Roy; Shaevitz, Joshua

    Many living systems take advantage of collective behavior for group survival. We use the soil-dwelling bacterium Myxococcus xanthus as a model to study out-of-equilibrium phase separation during fruiting body formation. M. xanthus cells have the ability to glide on solid surfaces and reverse their direction periodically. When starved, M. xanthus cells aggregate together and form structures called fruiting bodies, inside of which cells sporulate to survive stressful conditions. We show that at high cell density the formation of fruiting bodies is a phase separation process. From experimental data that combines single-cell tracking, population-scale imaging, mutants, and drug applications, we construct the phase diagram of M. xanthus in the space of Péclet number and cell density. When wild type cells are starved, we find that they actively increase their Péclet number by modulating gliding speed and reversal frequency which induces a phase separation from a gas-like state to an aggregated fruiting body state.

  13. Polytypic phase formation in DyAl sub 3 by rapid solidification

    Energy Technology Data Exchange (ETDEWEB)

    Xu, Y.; Altounian, Z.; Muir, W.B. (Centre for the Physics of Materials and the Department of Physics, McGill University, 3600 University Street, Montreal, Quebec H3A 2T8, Canada (CA))

    1991-01-14

    Amorphous ribbons of Al{sub {ital x}}Dy{sub 100{minus}{ital x}}, 93{gt}{ital x}{gt}85, were obtained by melt spinning. During crystallization, in addition to Al, four different metastable crystalline phases of DyAl{sub 3} were observed. These phases are, in order of appearance, the high-pressure face-centered cubic phase, {gamma}-DyAl{sub 3} and three polytypic rhombohedral phases, {beta}-DyAl{sub 3}, {beta}{prime}-DyAl{sub 3}, and {alpha}{prime}-DyAl{sub 3}. It is the first time that the {beta}{prime} phase in rare-earth trialuminides and the {alpha}{prime} phase in Dy-Al alloy system have been observed. It is shown that all these phases are associated with the polytypic packing of the hexagonal DyAl{sub 3} atomic layers. The relative stability of the phases is found to be related to the hexagonal to cubic stacking ratio in the structure.

  14. Spectral evidence of spinodal decomposition, phase transformation and molecular nitrogen formation in supersaturated TiAlN films upon annealing

    Energy Technology Data Exchange (ETDEWEB)

    Endrino, J.L., E-mail: jlendrino@icmm.csic.es [Instituto de Ciencia de Materiales de Madrid, Consejo Superior de Investigaciones Cientificas, E-28049 Madrid (Spain); Arhammar, C. [Sandvik Tooling AB, R and D, Lerkrogsvaegen 13, 126 80 Stockholm (Sweden); Gutierrez, A. [Departamento de Fisica Aplicada and Instituto de Ciencia de Materiales Nicolas Cabrera, Universidad Autonoma de Madrid, E-28049 Madrid (Spain); Gago, R. [Instituto de Ciencia de Materiales de Madrid, Consejo Superior de Investigaciones Cientificas, E-28049 Madrid (Spain); Horwat, D. [Institut Jean Lamour, Ecole des Mines de Nancy, Parc de Saurupt, 54042 Nancy (France); Soriano, L. [Departamento de Fisica Aplicada and Instituto de Ciencia de Materiales Nicolas Cabrera, Universidad Autonoma de Madrid, E-28049 Madrid (Spain); Fox-Rabinovich, G. [McMaster University, Hamilton, Ontario, Canada L8S 4L7 (Canada); Martin y Marero, D. [Departamento de Fisica Aplicada and Instituto de Ciencia de Materiales Nicolas Cabrera, Universidad Autonoma de Madrid, E-28049 Madrid (Spain); Fundacion Parque Cientifico de Madrid, Campus de Cantoblanco, 28049 Madrid (Spain); Centro de Microanalisis de Materiales, Universidad Autonoma de Madrid, 28049 Madrid (Spain); Guo, J. [Advanced Light Source, Lawrence Berkeley National Laboratory, 1 Cyclotron Rd., Berkeley, CA 94720 (United States); Rubensson, J.-E. [Department of Physics and Astronomy, Uppsala University, Box 516, S-75120 Uppsala (Sweden); Andersson, J. [Angstrom Laboratory, Uppsala University, S-75121 Uppsala (Sweden)

    2011-09-15

    Thermal treatment of supersaturated Ti{sub 1-x}Al{sub x}N films (x {approx} 0.67) with a dominant ternary cubic-phase were performed in the 700-1000 {sup o}C range. Grazing incidence X-ray diffraction (GIXRD) shows that, for annealing temperatures up to 800 {sup o}C, the film structure undergoes the formation of coherent cubic AlN (c-AlN) and TiN (c-TiN) nanocrystallites via spinodal decomposition and, at higher temperatures ({>=}900 {sup o}C), GIXRD shows that the c-AlN phase transforms into the thermodynamically more stable hexagonal AlN (h-AlN). X-ray absorption near-edge structure (XANES) at the Ti K-edge is consistent with spinodal decomposition taking place at 800 deg. while Al K-edge and N K-edge XANES and X-ray emission data show the nucleation of the h-AlN phase at temperatures >800 deg. C, in agreement with the two-step decomposition process for rock-salt structured TiAlN, which was also supported by X-ray diffraction patterns and first-principle calculations. Further, the resonant inelastic X-ray scattering technique near the N K-edge revealed that N{sub 2} is formed as a consequence of the phase transformation process.

  15. Discrete breathers in hexagonal dusty plasma lattices.

    Science.gov (United States)

    Koukouloyannis, V; Kourakis, I

    2009-08-01

    The occurrence of single-site or multisite localized vibrational modes, also called discrete breathers, in two-dimensional hexagonal dusty plasma lattices is investigated. The system is described by a Klein-Gordon hexagonal lattice characterized by a negative coupling parameter epsilon in account of its inverse dispersive behavior. A theoretical analysis is performed in order to establish the possibility of existence of single as well as three-site discrete breathers in such systems. The study is complemented by a numerical investigation based on experimentally provided potential forms. This investigation shows that a dusty plasma lattice can support single-site discrete breathers, while three-site in phase breathers could exist if specific conditions, about the intergrain interaction strength, would hold. On the other hand, out of phase and vortex three-site breathers cannot be supported since they are highly unstable.

  16. Effect of secondary phase formation on the carbonation of olivine.

    Science.gov (United States)

    King, Helen E; Plümper, Oliver; Putnis, Andrew

    2010-08-15

    Large-scale olivine carbonation has been proposed as a potential method for sequestering CO(2) emissions. For in situ carbonation techniques, understanding the relationship between the formation of carbonate and other phases is important to predict the impact of possible passivating layers on the reaction. Therefore, we have conducted reactions of olivine with carbonated saline solutions in unstirred batch reactors. Altering the reaction conditions changed the Mg-carbonate morphology. We propose that this corresponded to changes in the ability of the system to precipitate hydromagnesite or magnesite. During high-temperature reactions (200 degrees C), an amorphous silica-enriched phase was precipitated that was transformed to lizardite as the reaction progressed. Hematite was also precipitated in the initial stages of these reactions but dissolved as the reaction proceeded. Comparison of the experimental observations with reaction models indicates that the reactions are governed by the interfacial fluid composition. The presence of a new Mg-silicate phase and the formation of secondary products at the olivine surface are likely to limit the extent of olivine to carbonate conversion.

  17. Defect Formation in First Order Phase Transitions with Damping

    CERN Document Server

    Ferrera, A

    1998-01-01

    Within the context of first order phase transitions in the early universe, we study the influence of a coupling between the (global U(1)) scalar driving the transition and the rest of the matter content of the theory. The effect of the coupling on the scalar is simulated by introducing a damping term in its equations of motion, as suggested by recent results in the electroweak phase transition. After a preceeding paper, in which we studied the influence that this coupling has in the dynamics of bubble collisions and topological defect formation, we proceed in this paper to quantify the impact of this new effects on the probability of defect creation per nucleating bubble.

  18. Investigating materials formation with liquid-phase and cryogenic TEM

    Science.gov (United States)

    de Yoreo, J. J.; N. A. J. M., Sommerdijk

    2016-08-01

    The recent advent of liquid-phase transmission electron microscopy (TEM) and advances in cryogenic TEM are transforming our understanding of the physical and chemical mechanisms underlying the formation of materials in synthetic, biological and geochemical systems. These techniques have been applied to study the dynamic processes of nucleation, self-assembly, crystal growth and coarsening for metallic and semiconductor nanoparticles, (bio)minerals, electrochemical systems, macromolecular complexes, and organic and inorganic self-assembling systems. New instrumentation and methodologies that are currently on the horizon promise new opportunities for advancing the science of materials synthesis.

  19. Pattern Formation in the Turing-Hopf Codimension-2 Phase Space in a Reaction-Diffusion System

    Institute of Scientific and Technical Information of China (English)

    YUAN Xu-Jin; SHAO Xin; LIAO Hui-Min; OUYANG Qi

    2009-01-01

    We systematically investigate the behaviour of pattern formation in a reaction-diffusion system when the system is located near the Turing-Hopf codimension-2 point in phase space. The chloride-iodide-malonic acid (CIMA) reaction is used in this study. A phase diagram is obtained using the concentration of polyvinyl alcohol (PVA) and malonic acid (MA) as control parameters. It is found that the Turing-Hopf mixed state appears only in a small vicinity near the codimension-2 point, and has the form of hexagonal pattern overlapped with anti-target wave; the boundary line separating the Thring state and the wave state is independent of the concentration of MA, only relies on the concentration of PVA. The corresponding numerical simulation using the Lengyel-Epstein (LE) model gives a similar phase diagram as the experiment; it reproduces most patterns observed in the experiment. However, the mixed state we obtain in simulation only appears in the anti-wave tip area, implying that the 3-D effect in the experiments may change the pattern forming behaviour in the codimension-2 regime.

  20. PRISMA—A formation flying project in implementation phase

    Science.gov (United States)

    Persson, Staffan; Veldman, Sytze; Bodin, Per

    2009-11-01

    The PRISMA project for autonomous formation flying and rendezvous has passed its critical design review in February-March 2007. The project comprises two satellites which are an in-orbit testbed for Guidance, Navigation and Control (GNC) algorithms and sensors for advanced formation flying and rendezvous. Several experiments involving GNC algorithms, sensors and thrusters will be performed during a 10 month mission with launch planned for the second half of 2009. The project is run by the Swedish Space Corporation (SSC) in close cooperation with the German Aerospace Center (DLR), the French Space Agency (CNES) and the Technical University of Denmark (DTU). Additionally, the project also will demonstrate flight worthiness of two novel motor technologies: one that uses environmentally clean and non-hazardous propellant, and one that consists of a microthruster system based on MEMS technology. The project will demonstrate autonomous formation flying and rendezvous based on several sensors—GPS, RF-based and vision based—with different objectives and in different combinations. The GPS-based onboard navigation system, contributed by DLR, offers relative orbit information in real-time in decimetre range. The RF-based navigation instrument intended for DARWIN, under CNES development, will be tested for the first time on PRISMA, both for instrument performance, but also in closed loop as main sensor for formation flying. Several rendezvous and proximity manoeuvre experiments will be demonstrated using only vision based sensor information coming from the modified star camera provided by DTU. Semi-autonomous operations ranging from 200 km to 1 m separation between the satellites will be demonstrated. With the project now in the verification phase particular attention is given to the specific formation flying and rendezvous functionality on instrument, GNC-software and system level.

  1. Droplets Formation and Merging in Two-Phase Flow Microfluidics

    Directory of Open Access Journals (Sweden)

    Hao Gu

    2011-04-01

    Full Text Available Two-phase flow microfluidics is emerging as a popular technology for a wide range of applications involving high throughput such as encapsulation, chemical synthesis and biochemical assays. Within this platform, the formation and merging of droplets inside an immiscible carrier fluid are two key procedures: (i the emulsification step should lead to a very well controlled drop size (distribution; and (ii the use of droplet as micro-reactors requires a reliable merging. A novel trend within this field is the use of additional active means of control besides the commonly used hydrodynamic manipulation. Electric fields are especially suitable for this, due to quantitative control over the amplitude and time dependence of the signals, and the flexibility in designing micro-electrode geometries. With this, the formation and merging of droplets can be achieved on-demand and with high precision. In this review on two-phase flow microfluidics, particular emphasis is given on these aspects. Also recent innovations in microfabrication technologies used for this purpose will be discussed.

  2. Phase separation like dynamics during Myxococcus xanthus fruiting body formation

    Science.gov (United States)

    Liu, Guannan; Thutupalli, Shashi; Wigbers, Manon; Shaevitz, Joshua

    2015-03-01

    Collective motion exists in many living organisms as an advantageous strategy to help the entire group with predation, forage, and survival. However, the principles of self-organization underlying such collective motions remain unclear. During various developmental stages of the soil-dwelling bacterium, Myxococcus xanthus, different types of collective motions are observed. In particular, when starved, M. xanthus cells eventually aggregate together to form 3-dimensional structures (fruiting bodies), inside which cells sporulate in response to the stress. We study the fruiting body formation process as an out of equilibrium phase separation process. As local cell density increases, the dynamics of the aggregation M. xanthus cells switch from a spatio-temporally random process, resembling nucleation and growth, to an emergent pattern formation process similar to a spinodal decomposition. By employing high-resolution microscopy and a video analysis system, we are able to track the motion of single cells within motile collective groups, while separately tuning local cell density, cell velocity and reversal frequency, probing the multi-dimensional phase space of M. xanthus development.

  3. Droplets formation and merging in two-phase flow microfluidics.

    Science.gov (United States)

    Gu, Hao; Duits, Michel H G; Mugele, Frieder

    2011-01-01

    Two-phase flow microfluidics is emerging as a popular technology for a wide range of applications involving high throughput such as encapsulation, chemical synthesis and biochemical assays. Within this platform, the formation and merging of droplets inside an immiscible carrier fluid are two key procedures: (i) the emulsification step should lead to a very well controlled drop size (distribution); and (ii) the use of droplet as micro-reactors requires a reliable merging. A novel trend within this field is the use of additional active means of control besides the commonly used hydrodynamic manipulation. Electric fields are especially suitable for this, due to quantitative control over the amplitude and time dependence of the signals, and the flexibility in designing micro-electrode geometries. With this, the formation and merging of droplets can be achieved on-demand and with high precision. In this review on two-phase flow microfluidics, particular emphasis is given on these aspects. Also recent innovations in microfabrication technologies used for this purpose will be discussed.

  4. Synthesis, characterization, shape evolution, and optical properties of copper sulfide hexagonal bifrustum nanocrystals

    Energy Technology Data Exchange (ETDEWEB)

    Jia Baorui; Qin Mingli, E-mail: qinml@mater.ustb.edu.cn [University of Science and Technology Beijing, School of Materials Science and Engineering (China); Jiang Xuezhi [North Heavy Industry Group, Special Steel Works (China); Zhang Zili; Zhang Lin; Liu Ye; Qu Xuanhui [University of Science and Technology Beijing, School of Materials Science and Engineering (China)

    2013-03-15

    The hexagonal bifrustum-shaped copper sulfide (CuS) nanocrystals were selectively and facilely synthesized by a hydrothermal method for the first time at 120 Degree-Sign C. The products were characterized by X-ray diffraction, field emission scanning electron microscopy, energy dispersive X-ray spectroscopy, transmission electron microscopy, ultraviolet-visible (UV-Vis) spectroscopy, and photoluminescence spectroscopy. The results showed that the CuS hexagonal bifrustum nanocrystal was bounded by two top hexagons with edge length of about 50-70 nm and twelve lateral trapezoids with a base of about 100 nm and that the length of each hexagonal bifrustum was about 250 nm. Tetradecylamine (TDA), as an effective capping agent, was found to be critical for this special shape. Using different amounts of TDA, two kinds of CuS hexagonal bifrustum nanocrystals were obtained: 'lender hexagonal bifrustum' and 'pancake hexagonal bifrustum.' Furthermore, we studied the formation mechanism of hexagonal bifrustum, which is related to the intrinsic crystalline structure of CuS and Ostwald ripening. And, the results revealed that the CuS nanocrystal evolved from hexagonal plate to hexagonal bifrustum and finally to hexagonal bipyramid as the heating time increased. The UV-Vis absorption spectrum showed that these CuS hexagonal bifrustum nanocrystals exhibited strong absorption in the near-infrared region and had a potential application for photothermal therapy and photocatalysis.

  5. Synthesis of silicon carbide hexagonal nanoprisms

    Science.gov (United States)

    Wu, R. B.; Yang, G. Y.; Pan, Y.; Chen, J. J.

    2007-02-01

    SiC hexagonal nanoprisms have been prepared by a reaction of multiwall carbon nanotubes and Si vapor in an Astro furnace at 1450 °C for 3 h. The polytype, morphology, crystal structure of the nanoprisms were studied by X-ray powder diffraction, scanning electron microscopy and high resolution transmission electron microscopy, showing their hexagonal nanoprism shapes with a 3C-SiC single crystal structure with a diameter of about 100 nm and 2 μm in length. The photoluminescence spectrum of the nanoprisms exhibits a significant blue-shift relative to bulk 3C-SiC and other nanostructured SiC. The possible growth mechanism that controls the nanostructure formation is also analysed.

  6. Bifurcation theory for hexagonal agglomeration in economic geography

    CERN Document Server

    Ikeda, Kiyohiro

    2014-01-01

    This book contributes to an understanding of how bifurcation theory adapts to the analysis of economic geography. It is easily accessible not only to mathematicians and economists, but also to upper-level undergraduate and graduate students who are interested in nonlinear mathematics. The self-organization of hexagonal agglomeration patterns of industrial regions was first predicted by the central place theory in economic geography based on investigations of southern Germany. The emergence of hexagonal agglomeration in economic geography models was envisaged by Krugman. In this book, after a brief introduction of central place theory and new economic geography, the missing link between them is discovered by elucidating the mechanism of the evolution of bifurcating hexagonal patterns. Pattern formation by such bifurcation is a well-studied topic in nonlinear mathematics, and group-theoretic bifurcation analysis is a well-developed theoretical tool. A finite hexagonal lattice is used to express uniformly distri...

  7. Preparation and characterization of hexagonal close-packed Ni nanoparticles

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    Hexagonal close-packed Ni nanoparticles were synthesized using a heat-treating technique with the precursors prepared by the sol-gel method.The synthesis condition,structure,and morphology of the samples were characterized and analysed by thermogravimetric analysis (TG),differential thermal analysis (DTA),X-ray diffraction (XRD) and transmission electron microscopy (TEM).Results indicate that the hexagonal close packed Ni nanoparticles were synthesized at a heat-treating temperature of 300℃.The cell constants are calculated at a=0.2652 nm and c=0.4334 nm.The average grain size of the hexagonal close-packed Ni particles evaluated by Scherrer equation is about 12 nm.The phase transformation from a hexagonal close-packed Ni to a face-centered cubic Ni structure occurred when the heat-treating temperature was increased.

  8. Glycolthermal synthesis and characterization of hexagonal CdS round microparticles in flower-like clusters

    Energy Technology Data Exchange (ETDEWEB)

    Phuruangrat, Anukorn, E-mail: phuruangrat@hotmail.com [Department of Materials Science and Technology, Faculty of Science, Prince of Songkla University, Hat Yai, Songkhla 90112 (Thailand); Ekthammathat, Nuengruethai [Department of Chemistry, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Thongtem, Titipun, E-mail: ttpthongtem@yahoo.com [Department of Chemistry, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Materials Science Research Center, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Thongtem, Somchai [Department of Physics and Materials Science, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Materials Science Research Center, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand)

    2011-10-13

    Highlights: > CdS as one of II-VI semiconducting materials. > Lab-made Teflon-lined stainless steel autoclaves enable us to form hexagonal CdS. > By 100-200 deg. C processing, round microparticles in flower clusters were synthesized. > A promising material for multiple potential applications. - Abstract: Hexagonal CdS round microparticles in flower-like clusters were synthesized by glycolthermal reactions of CdCl{sub 2} and thiourea as cadmium and sulphur sources in 1,2-propylene glycol (PG) at 100-200 deg. C for 10-30 h. Phase and morphology were detected using X-ray diffraction (XRD), and scanning and transmission electron microscopy (SEM, TEM). The products were pure phase of hexagonal wurtzite CdS. The quantitative elemental analysis of Cd:S ratio was detected using energy dispersive X-ray (EDX) analyzer. Raman spectrometer revealed the presence of fundamental and overtone modes at 296 and 595 cm{sup -1}, corresponding to the strong 1LO and weak 2LO modes, respectively. Photonic properties were investigated using UV-visible and photoluminescence (PL) spectroscopy. They showed the same absorption at 493-498 nm, and emission at 431 nm due to the excitonic recombination process. A possible formation mechanism was also proposed, according to experimental results.

  9. Layered graphene structure of a hexagonal carbon

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Bin, E-mail: beenchang@nuaa.edu.cn

    2013-06-01

    Experiments show that there is a novel hexagonal carbon polymorph restricted to the space group of P-62c, but the detailed atomic structure is not determined. Here we set carbon atoms occupying P-62c 4f or P-62c 2c and 2d Wyckoff positions, and calculate the total energy of the different cell structures changing the internal parameter by first-principles calculations, which demonstrates that the stable structures in energy (at local minima) are hexagonal carbon (P-62c 2c and 2d) and hexagonal diamond (P-62c 4f, z=1/16). The calculated bulk modulus 437±16 GPa and interlayer distance 2.062 Å of the layered graphene structure P-62c 2c and 2d are in good agreement with those of the proposed new carbon, which indicates that P-62c 2c and 2d is a possible precursor or intermediate hard phase during the structural transformation of carbon.

  10. Structure and hydrogen storage properties of the hexagonal Laves phase Sc(Al{sub 1-x}Ni{sub x}){sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Sahlberg, Martin, E-mail: Martin.sahlberg@kemi.uu.se [Department of Chemistry, The Angstroem Laboratory, Uppsala University, Box 538, SE-751 21 Uppsala (Sweden); Angstroem, Jonas, E-mail: jonas.angstrom@kemi.uu.se [Department of Chemistry, The Angstroem Laboratory, Uppsala University, Box 538, SE-751 21 Uppsala (Sweden); Zlotea, Claudia, E-mail: claudia.zlotea@icmpe.cnrs.fr [Chimie Metallurgique des Terres Rares, Institut de Chimie et des Materiaux de Paris Est, UMR 7182, CNRS, 2-8 rue Henri Dunant, 94320 Thiais Cedex (France); Beran, Premysl, E-mail: pberan@ujf.cas.cz [Nuclear Physics Institute, Academy of Sciences of the Czech Republic, 25068 Rez (Czech Republic); Latroche, Michel, E-mail: michel.latroche@glvt-cnrs.fr [Chimie Metallurgique des Terres Rares, Institut de Chimie et des Materiaux de Paris Est, UMR 7182, CNRS, 2-8 rue Henri Dunant, 94320 Thiais Cedex (France); Pay Gomez, Cesar, E-mail: Cesar.paygomez@kemi.uu.se [Department of Chemistry, The Angstroem Laboratory, Uppsala University, Box 538, SE-751 21 Uppsala (Sweden)

    2012-12-15

    The crystal structures of hydrogenated and unhydrogenated Sc(Al{sub 1-x}Ni{sub x}){sub 2} Laves phases have been studied by combining several diffraction techniques and it is shown that hydrogen is situated interstitially in the A{sub 2}B{sub 2}-sites, which have the maximum number of scandium neighbours. The hydrogen absorption/desorption behaviour has also been investigated. It is shown that a solid solution of hydrogen forms in the mother compound. The hydrogen storage capacity exceeds 1.7 H/f.u. at 374 K, and the activation energy of hydrogen desorption was determined to 4.6 kJ/mol H{sub 2}. It is shown that these compounds share the same local coordination as Frank-Kasper-type approximants and quasicrystals, which opens up the possibility of finding many new hydride phases with these types of crystal structures. - Graphical abstract: The structure of ScNiAlDx, Sc atoms are shown in purple and Ni/Al atoms in blue and the iso-surfaces of deuterium in yellow. Revealed from refinements of neutron powder diffraction data. Highlights: Black-Right-Pointing-Pointer The crystal structure of ScNiAl and ScNiAlDx is reported. Black-Right-Pointing-Pointer We show the hydrogen storage properties of Sc(Al{sub 1-x}Ni{sub x}){sub 2}. Black-Right-Pointing-Pointer We discuss the possibility to store hydrogen in quasicrystals.

  11. Hexagonal tessellations in image algebra

    Science.gov (United States)

    Eberly, David H.; Wenzel, Dennis J.; Longbotham, Harold G.

    1990-11-01

    In image algebra '' the concept of a coordinate set X is general in that such a set is simply a subset of ndimensional Euclidean space . The standard applications in 2-dimensional image processing use coordinate sets which are rectangular arrays X 72 x ZZm. However some applications may require other geometries for the coordinate set. We look at three such related applications in the context of image algebra. The first application is the modeling of photoreceptors in primate retinas. These receptors are inhomogeneously distributed on the retina. The largest receptor density occurs in the center of the fovea and decreases radially outwards. One can construct a hexagonal tessellation of the retina such that each hexagon contains approximately the same number of receptors. The resulting tessellation called a sunflower heart2 consists of concentric rings of hexagons whose sizes increase as the radius of the ring increases. The second application is the modeling of the primary visual . The neurons are assumed to be uniformly distributed as a regular hexagonal lattice. Cortical neural image coding is modeled by a recursive convolution of the retinal neural image using a special set of filters. The third application involves analysis of a hexagonally-tessellated image where the pixel resolution is variable .

  12. On Processing Hexagonally Sampled Images

    Science.gov (United States)

    2011-07-01

    Definition Addition Negation Subtraction Scalar Multiplication                  2121 2121 21 2 aacc aarr aa pp1...coordinate system for addressing a hexagonal grid that provides support for efficient image processing • Efficient ASA methods were shown for gradient

  13. Hexagons and Interfaces in a Vibrated Granular Layer

    CERN Document Server

    Aranson, I S; Vinokur, V M

    1998-01-01

    The order parameter model based on parametric Ginzburg-Landau equation is used to describe high acceleration patterns in vibrated layer of granular material. At large amplitude of driving both hexagons and interfaces emerge. Transverse instability leading to formation of ``decorated'' interfaces and labyrinthine patterns, is found. Additional sub-harmonic forcing leads to controlled interface motion.

  14. Formation of ζ phase in Cu-Ge peritectic alloys

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    Rapid growth behavior of ζ phase has been investigated in the undercooling experiments of Cu-14%Ge, Cu-15%Ge, Cu-18.5%Ge and Cu-22%Ge alloys. Alloys of the four compositions obtain the maximum undercoolings of 202 K(0.17TL), 245 K(0.20TL), 223 K(0.20TL) and 176 K(0.17TL), respectively. As the content of Ge increases, the microstructural transition of "α(Cu) dendrite + ζ peritectic phase → ζ peritectic phase → ζ dendrite + (ε+ζ ) eutectic" takes place in the alloy at small undercooling, while the microstructural transition of "fragmented α (Cu) dendrite +ζperitectic phase → ζ peritectic phase → ζ dendrite + ε phase" happens in the alloy at large undercooling. EDS analysis of the Ge content in ζ peritectic phase indicates that undercooling enlarges the solid solubility of α dendrite, which leads to a decrease in the Ge content in ζ phase as undercooling increases. In the Cu-18.5%Ge alloy composed of ζ peritectic phase, the Ge content in ζ phase increases when undercooling increases, which is due to the restraint of the Ge enrichment on the grain boundaries by high undercooling effect.

  15. Synthesis and magnetic properties of hexagonal Y(Mn,Cu)O{sub 3} multiferroic materials

    Energy Technology Data Exchange (ETDEWEB)

    Jeuvrey, L., E-mail: laurent.jeuvrey@univ-rennes1.fr [Sciences Chimiques de Rennes, UMR-CNRS 6226, Universite de Rennes 1, 35042 Rennes cedex (France); Pena, O. [Sciences Chimiques de Rennes, UMR-CNRS 6226, Universite de Rennes 1, 35042 Rennes cedex (France); Moure, A.; Moure, C. [Electroceramics Department, Instituto de Ceramica y Vidrio, CSIC, C/Kelsen 5, 28049, Madrid (Spain)

    2012-03-15

    Single-phase hexagonal-type solid solutions based on the multiferroic YMnO{sub 3} material were synthesized by a modified Pechini process. Copper doping at the B-site (YMn{sub 1-x}Cu{sub x}O{sub 3}; x<0.15) and self-doping at the A-site (Y{sub 1+y}MnO{sub 3}; y<0.10) successfully maintained the hexagonal structure. Self-doping was limited to y(Y)=2 at% and confirmed that excess yttrium avoids formation of ferromagnetic manganese oxide impurities but creates vacancies at the Mn site. Chemical substitution at the B-site inhibits the geometrical frustration of the Mn{sup 3+} two-dimensional lattice. The magnetic transition at T{sub N} decreases from 70 K down to 49 K, when x(Cu) goes from 0 to 15 at%. Weak ferromagnetic Mn{sup 3+}-Mn{sup 4+} interactions created by the substitution of Mn{sup 3+} by Cu{sup 2+}, are visible through the coercive field and spontaneous magnetization but do not modify the overall magnetic frustration. Presence of Mn{sup 3+}-Mn{sup 4+} pairs leads to an increase of the electrical conductivity due to thermally-activated small-polaron hopping mechanisms. Results show that local ferromagnetic interactions can coexist within the frustrated state in the hexagonal polar structure. - Highlights: Black-Right-Pointing-Pointer Hexagonal-type solid solutions of Y(Mn,Cu)O{sub 3} synthesized by Pechini process. Black-Right-Pointing-Pointer Chemical substitution at B site inhibits geometrical magnetic frustration. Black-Right-Pointing-Pointer Magnetic transition decreases with Cu-doping. Black-Right-Pointing-Pointer Local ferromagnetic Mn-Mn interactions coexist with the frustrated state.

  16. Formation of porous crystals via viscoelastic phase separation

    Science.gov (United States)

    Tsurusawa, Hideyo; Russo, John; Leocmach, Mathieu; Tanaka, Hajime

    2017-10-01

    Viscoelastic phase separation of colloidal suspensions can be interrupted to form gels either by glass transition or by crystallization. With a new confocal microscopy protocol, we follow the entire kinetics of phase separation, from homogeneous phase to different arrested states. For the first time in experiments, our results unveil a novel crystallization pathway to sponge-like porous crystal structures. In the early stages, we show that nucleation requires a structural reorganization of the liquid phase, called stress-driven ageing. Once nucleation starts, we observe that crystallization follows three different routes: direct crystallization of the liquid phase, the Bergeron process, and Ostwald ripening. Nucleation starts inside the reorganized network, but crystals grow past it by direct condensation of the gas phase on their surface, driving liquid evaporation, and producing a network structure different from the original phase separation pattern. We argue that similar crystal-gel states can be formed in monatomic and molecular systems if the liquid phase is slow enough to induce viscoelastic phase separation, but fast enough to prevent immediate vitrification. This provides a novel pathway to form nanoporous crystals of metals and semiconductors without dealloying, which may be important for catalytic, optical, sensing, and filtration applications.

  17. Leading Formative Assessment Change: A 3-Phase Approach

    Science.gov (United States)

    Northwest Evaluation Association, 2016

    2016-01-01

    If you are seeking greater student engagement and growth, you need to integrate high-impact formative assessment practices into daily instruction. Read the final article in our five-part series to find advice aimed at leaders determined to bring classroom formative assessment practices district wide. Learn: (1) what you MUST consider when…

  18. Prediction of Phase Formation in Nanoscale Sn-Ag-Cu Solder Alloy

    Science.gov (United States)

    Wu, Min; Lv, Bailin

    2016-01-01

    In a dynamic nonequilibrium process, the effective heat of formation allows the heat of formation to be calculated as a function of concentrations of the reacting atoms. In this work, we used the effective heat of formation rule to predict the formation and size of compound phases in a nanoscale Sn-Ag-Cu lead-free solder. We calculated the formation enthalpy and effective formation enthalpy of compounds in the Sn-Ag, Sn-Cu, and Ag-Cu systems by using the Miedema model and effective heat of formation. Our results show that, considering the surface effect of the nanoparticle, the effective heat of formation rule successfully predicts the phase formation and sizes of Ag3Sn and Cu6Sn5 compounds, which agrees well with experimental data.

  19. Control of structure formation in phase-separating systems

    NARCIS (Netherlands)

    Singh, A.; Mukherjee, A.; Vermeulen, H.M.; Barkema, G.T.; Puri, S.

    2011-01-01

    In this paper, we study the evolution of phase-separating binary mixtures which are subjected to alternate cooling and heating cycles. An initially homogeneous mixture is rapidly quenched to a temperature T1 phase separation for a whil

  20. Void shape control in GaN re-grown on hexagonally patterned mask-less GaN

    Science.gov (United States)

    Ali, M.; Romanov, A. E.; Suihkonen, S.; Svensk, O.; Törmä, P. T.; Sopanen, M.; Lipsanen, H.; Odnoblyudov, M. A.; Bougrov, V. E.

    2011-01-01

    We present the results of GaN re-growth on hexagonally patterned GaN templates. Sapphire was used as the original substrate and the samples were grown by metalorganic vapor phase epitaxy (MOVPE). The re-growth on the patterned templates results in the formation of voids at the GaN/sapphire interface. Our extensive scanning electron microscopy (SEM)-based experimental investigations show that the void shape can be controlled from nearly vertical to fully inclined configurations. It was found that the initial hexagon hole diameter plays a key role in determining the final profile of the void sidewalls. X-ray diffraction analysis of the GaN layers indicates that the layers with inclined sidewall voids have an improved crystalline quality. Knowledge of the void configurations in the GaN layers and a possibility to control their shape can help in enhancing light extraction from the light emitting structures.

  1. Periodic layers of a dodecagonal quasicrystal and a floating hexagonal crystal in sedimentation-diffusion equilibria of colloids

    Science.gov (United States)

    Pattabhiraman, Harini; Dijkstra, Marjolein

    2017-09-01

    We investigate the behaviour of a system of colloidal particles interacting with a hard-core and a repulsive square shoulder potential under the influence of a gravitational field using event-driven Brownian dynamics simulations. We use a fixed square shoulder diameter equal to 1.4 times the hard-core diameter of the colloids, for which we have previously calculated the equilibrium phase diagram considering two-dimensional disks [H. Pattabhiraman et al., J. Chem. Phys. 143, 164905 (2015) and H. Pattabhiraman and M. Dijkstra, J. Phys.: Condens. Matter 20, 094003 (2017)]. The parameters in the simulations are chosen such that the pressure at the bottom of the sediment facilitates the formation of phases in accordance with the calculated phase diagram of the two-dimensional system. It is surprising that we observe the formation of layers with dodecagonal, square, and hexagonal symmetries at the relevant pressures in the three-dimensional sedimentation column. In addition, we also observe a re-entrant behaviour exhibited by the colloidal fluid phase, engulfing a hexagonal crystal phase, in the sedimentation column. In other words, a floating crystal is formed between the colloidal fluid regions.

  2. Hydrothermal synthesis of hexagonal and orthorhombic MoO{sub 3} nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Chithambararaj, A. [Nanomaterials Laboratory, Department of Physics, National Institute of Technology, Tiruchirappalli 620 015 (India); Bose, A. Chandra, E-mail: acbose@nitt.edu [Nanomaterials Laboratory, Department of Physics, National Institute of Technology, Tiruchirappalli 620 015 (India)

    2011-08-04

    Molybdenum oxide (MoO{sub 3}) with two different crystal structures (hexagonal and orthorhombic) was successfully synthesized by an effective and environmental friendly hydrothermal method. The phase confirmation and structural properties of the sample was elucidated by X-ray diffraction (XRD) method. The reaction temperature has great impact on the crystal structure, size, shape and chemical composition of the samples. Vibration behavior of chemical bonds was characterized by Fourier transform infrared spectroscopy (FT-IR) and the observed peaks confirm the formation of MoO{sub 3}. Scanning electron microscopy (SEM) observation shows that an increase in reaction temperature, the shape was drastically changed from one dimensional (1D) to two dimensional (2D) layered structures. Energy dispersive X-ray analysis (EDX) reveals that the as-prepared samples are in non-stoichiometric composition and their composition varies with reaction temperature. The thermal study was acquired by thermo gravimetric analysis and it demonstrates the process of dehydration and deammonization, observed below 260 deg. C and phase transformation from hexagonal to highly stable orthorhombic phase at 400-450 deg. C. Additionally, the optical absorption properties were measured using diffuse reflectance spectroscopy (DRS) and the band gap energy, estimated from Kubelka-Munk function (K-M) was found to be in the range of 3.01-3.24 eV.

  3. Wavelength preserved phase erasure and PSK to conventional OOK data format conversion based on phase sensitive amplification

    Science.gov (United States)

    Yu, Kan; Yang, Weili; Yu, Yu

    2016-10-01

    In this paper, a phase erasure and format conversion of phase-shift keying (PSK) to conventional on-off keying (OOK) is proposed and demonstrated theoretically and experimentally. Using a single-pump nondegenerate phase sensitive amplification process in a highly nonlinear fiber, the 0 and 1-bits of the PSK signal obtain different gains through amplification and de-amplification. As a result, the modulation information is transferred onto the amplitude. With an optimized input power difference between the signal and idler, the signal phase information is erased with wavelength preservation after the PSA. The output constellation and eye diagrams show an effective phase erasure and format conversion of PSK to conventional OOK. The error vector magnitude is utilized to evaluate the scheme performance. The proposed scheme provides the flexibility and resiliency for future photonic networks.

  4. Phase behavior, formation, and rheology of cubic phase and related gel emulsion in Tween 80/water/oil systems.

    Science.gov (United States)

    Alam, Mohammad Mydul; Ushiyama, Kousuke; Aramaki, Kenji

    2009-01-01

    We investigated the phase behavior, formation, and rheology of the cubic phase (I(1)) and related O/I(1) gel emulsion in water/Tween 80/oil systems using squalane, liquid paraffin (LP), and decane as oil components. In the phase behavior study, the phase sequences were similar for squalane and LP systems, while a lamellar liquid crystal (L(alpha)) was observed for decane system. In all the systems the addition of oil to W(m) or H(1) phase induced the I(1) phase, which can solubilize some amounts of oil followed by the appearance of I(1)+O phase. The formation of the O/I(1) gel emulsion has been studied at a fixed w/s (50/50) and we found that 30 wt% decane, 70 wt% squalane, and 60 wt% LP can form the gel emulsion. The water/Tween 80/squalane system has been taken as a model system to study viscoelastic properties of the I(1) phase and O/I(1) gel emulsion. The I(1) phase shows a typical hard gel cubic structure under the frequency and the values of the complex viscosity, /eta*/ and the elastic modulus, G ' increase with the addition of squalane, which could be due to the neighboring micellar interaction. On the other hand, the decreasing values of the viscoelastic parameters in the O/I(1) gel emulsion simply relate to the volume fraction of the I(1) phase in the system.

  5. EDGE-ORIENTED HEXAGONAL ELEMENTS

    Institute of Scientific and Technical Information of China (English)

    Chao Yang; Jiachang Sun

    2007-01-01

    In this paper, two new nonconforming hexagonal elements are presented, which are based on the trilinear function space Q(3)1 and are edge-oriented, analogical to the case of the rotated Q1 quadrilateral element. A priori error estimates are given to show that the new elements achieve first-order accuracy in the energy norm and second-order accuracy in the L2 norm. This theoretical result is confirmed by the numerical tests.

  6. FORMATION OF MANGANESE SILICIDE THIN FILMS BY SOLID PHASE REACTION

    Institute of Scientific and Technical Information of China (English)

    E.Q. Xie; W.W. Wang; N. Jiang; D.Y. He

    2002-01-01

    Manganese silicide MnSi2-x thin films have been prepared on n-type silicon substratesthrough solid phase reaction. The heterostructures were analyzed by X-ray diffraction,Rutherford backscattering spectroscopy, Fourier transform infrared transmittance spec-troscopy and the four-point probe technique. The results show that two manganese sili-cides have been formed sequentially via the reaction of thin layer Mn with Si substrateat different irradiation annealing stages, i.e., MnSi at 450℃ and MnSi1.73 at 550℃.MnSi1.73 phase exhibits preferred growth after irradiation with infrared. In situ four-point probe measurements of sheet resistance during infrared irradiation annealingshow that nucleation of MnSi and phase transformation of MnSi to MnSi1. 73 occur at410℃ and 530℃, respectively; the MnSi phase shows metallic behavior, while MnSi1.73exhibits semiconducting behavior. Characteristic phonon bands of MnSi2-x silicides,which can be used for phase identification along with conventional XRD techniques,have been observed by FTIR spectroscopy.

  7. Comparing gas-phase and grain-catalyzed H2 formation

    CERN Document Server

    Glover, S C O

    2003-01-01

    Because H2 formation on dust grain surfaces completely dominates gas-phase H2 formation in local molecular clouds, it is often assumed that gas-phase formation is never important. In fact, it is the dominant mechanism in a number of cases. In this paper, I briefly summarize the chemistry of gas-phase H2 formation, and show that it dominates for dust-to-gas ratios less than a critical value D_cr. I also show that D_cr is simple to calculate for any given astrophysical situation, and illustrate this with a number of examples, ranging from H2 formation in warm atomic gas in the Milky Way to the formation of protogalaxies at high redshift.

  8. Numerical modeling of experimental observations on gas formation and multi-phase flow of carbon dioxide in subsurface formations

    Science.gov (United States)

    Pawar, R.; Dash, Z.; Sakaki, T.; Plampin, M. R.; Lassen, R. N.; Illangasekare, T. H.; Zyvoloski, G.

    2011-12-01

    One of the concerns related to geologic CO2 sequestration is potential leakage of CO2 and its subsequent migration to shallow groundwater resources leading to geochemical impacts. Developing approaches to monitor CO2 migration in shallow aquifer and mitigate leakage impacts will require improving our understanding of gas phase formation and multi-phase flow subsequent to CO2 leakage in shallow aquifers. We are utilizing an integrated approach combining laboratory experiments and numerical simulations to characterize the multi-phase flow of CO2 in shallow aquifers. The laboratory experiments involve a series of highly controlled experiments in which CO2 dissolved water is injected in homogeneous and heterogeneous soil columns and tanks. The experimental results are used to study the effects of soil properties, temperature, pressure gradients and heterogeneities on gas formation and migration. We utilize the Finite Element Heat and Mass (FEHM) simulator (Zyvoloski et al, 2010) to numerically model the experimental results. The numerical models capture the physics of CO2 exsolution, multi-phase fluid flow as well as sand heterogeneity. Experimental observations of pressure, temperature and gas saturations are used to develop and constrain conceptual models for CO2 gas-phase formation and multi-phase CO2 flow in porous media. This talk will provide details of development of conceptual models based on experimental observation, development of numerical models for laboratory experiments and modelling results.

  9. Structural control of void formation in dual phase steels

    DEFF Research Database (Denmark)

    Azuma, Masafumi

    measurements, tensile tests and hole-expansion tests. The initial microstructure and the deformed microstructure were characterized by means of scanning electron microscopy (SEM) and transmission electron microscopy (TEM). In situ tensile tests in a SEM were applied for direct observation of the void formation...

  10. Polymer fullerene solution phase behaviour and film formation pathways.

    Science.gov (United States)

    Dattani, Rajeev; Cabral, João T

    2015-04-28

    We report the phase behaviour of polymer/fullerene/solvent ternary mixtures and its consequence for the morphology of the resulting composite thin films. We focus particularly on solutions of polystyrene (PS), C60 fullerene and toluene, which are examined by static and dynamic light scattering, and films obtained from various solution ages and thermal annealing conditions, using atomic force and light microscopy. Unexpectedly, the solution phase behaviour below the polymer overlap concentration, c*, is found to be described by a simple excluded volume argument (occupied by the polymer chains) and the neat C60/solvent miscibility. Scaling consistent with full exclusion is found when the miscibility of the fullerene in the solvent is much lower than that of the polymer, giving way to partial exclusion with more soluble fullerenes (phenyl-C61-butyric acid methyl ester, PCBM) and a less asymmetric solvent (chlorobenzene), employed in photovoltaic devices. Spun cast and drop cast films were prepared from PS/C60/toluene solutions across the phase diagram to yield an identical PS/C60 composition and film thickness, resulting in qualitatively different morphologies in agreement with our measured solution phase boundaries. Our findings are relevant to the solution processing of polymer/fullerene composites (including organic photovoltaic devices), which generally require effective solubilisation of fullerene derivatives and polymer pairs in this concentration range, and the design of well-defined thin film morphologies.

  11. New signals of quark-gluon-hadron mixed phase formation

    Energy Technology Data Exchange (ETDEWEB)

    Bugaev, K.A.; Sagun, V.V.; Ivanytskyi, A.I.; Zinovjev, G.M. [Bogolyubov Institute for Theoretical Physics, Kiev (Ukraine); Oliinychenko, D.R. [Bogolyubov Institute for Theoretical Physics, Kiev (Ukraine); Goethe University, FIAS, Frankfurt am Main (Germany); Ilgenfritz, E.M. [JINR, Bogoliubov Laboratory of Theoretical Physics, Dubna (Russian Federation); Nikonov, E.G. [JINR, Laboratory for Information Technologies, Dubna (Russian Federation); Taranenko, A.V. [Moscow Engineering Physics Institute, National Research Nuclear University ' ' MEPhI' ' , Moscow (Russian Federation)

    2016-08-15

    Here we present several remarkable irregularities at chemical freeze-out which are found using an advanced version of the hadron resonance gas model. The most prominent of them are the sharp peak of the trace anomaly existing at chemical freeze-out at the center-of-mass energy 4.9 GeV and two sets of highly correlated quasi-plateaus in the collision energy dependence of the entropy per baryon, total pion number per baryon, and thermal pion number per baryon which we found at the center-of-mass energies 3.8-4.9 GeV and 7.6-10 GeV. The low-energy set of quasi-plateaus was predicted a long time ago. On the basis of the generalized shock-adiabat model we demonstrate that the low-energy correlated quasi-plateaus give evidence for the anomalous thermodynamic properties inside the quark-gluon-hadron mixed phase. It is also shown that the trace anomaly sharp peak at chemical freeze-out corresponds to the trace anomaly peak at the boundary between the mixed phase and quark gluon plasma. We argue that the high-energy correlated quasi-plateaus may correspond to a second phase transition and discuss its possible origin and location. Besides we suggest two new observables which may serve as clear signals of these phase transformations. (orig.)

  12. Modeling quantitative phase image formation under tilted illuminations.

    Science.gov (United States)

    Bon, Pierre; Wattellier, Benoit; Monneret, Serge

    2012-05-15

    A generalized product-of-convolution model for simulation of quantitative phase microscopy of thick heterogeneous specimen under tilted plane-wave illumination is presented. Actual simulations are checked against a much more time-consuming commercial finite-difference time-domain method. Then modeled data are compared with experimental measurements that were made with a quadriwave lateral shearing interferometer.

  13. Nematic phase formation in suspensions of carbon nanotubes

    Science.gov (United States)

    Zakri, Cecile; Poulin, Philippe

    This chapter describes the chemical composition, phase behavior and structure of recently investigated carbon nanotube (CNT) based liquid crystals. Because nanotubes are long and thin rigid cylinders, their phase behavior shares several similarities with many other systems such as rigid polymers and rod-like particle suspensions. CNT liquid crystals are achieved in highly concentrated suspensions comprised of raw or chemically functionalized particles. But extreme aspect ratio, rigidity, high sensitivity to interactions, optical properties and structural features of CNTs make their liquid crystalline phases unique in several ways. In particular, the chapter discusses the importance of the CNT waviness on the phase ordering and the role of excess surfactant or biomolecules used to stabilize the CNTs. The unique resonant Raman scattering of CNT allows original and accurate measurements of order parameters at a micron-scale. Highly oriented nematic tactoids could even be characterized by polarized Raman microscopy. From a more applied point of view, nematic ordering is shown to be a route towards the processing of new materials such as anisotropic conductive films and high strength fibers made of oriented carbon nanotubes. Examples of functional materials and nanocomposites achieved from CNT liquid crystals are given.

  14. Effect of metal-ion-to-fuel ratio on the phase formation of bioceramic phosphates synthesized by self-propagating combustion

    Directory of Open Access Journals (Sweden)

    Swamiappan Sasikumar and Rajagopalan Vijayaraghavan

    2008-01-01

    Full Text Available Synthetic calcium hydroxyapatite (HAP, Ca10 (PO46 (OH2 is a well-known bioceramic material used in orthopedic and dental applications because of its excellent biocompatibility and bone-bonding ability due to its structural and compositional similarity to human bone. Here we report, for the first time, the synthesis of HAP by combustion employing tartaric acid as a fuel. Calcium nitrate is used as the source of calcium and diammonium hydrogen phosphate serves as the source of phosphate ions. Reaction processing parameters such as the pH, fuel-oxidant ratio and autoignition temperature are controlled and monitored. The products were characterized by powder x-ray diffraction, which revealed the formation of a hexagonal hydroxyapatite phase. Fourier transform infrared spectroscopy (FT-IR spectra showed that the substitution of a carbonate ion occurs at the phosphate site. The morphology of the particles was imaged by scanning electron microscopy, which also revealed that the particles are of submicron size. Thermal analysis showed that the phase formation takes place at the time of combustion. Surface area and porosity analysis showed that the surface area is high and that the pores are of nanometer size. The mean grain size of the HAP powder, determined by the Debye–Scherrer formula, is in the range 20–30 nm. Chemical analyses to determine the Ca : P atomic ratio in synthesized ceramics were performed, and it was found to be 1 : 1.66.

  15. Phase transitions during fruiting body formation in Myxococcus xanthus

    CERN Document Server

    Thutupalli, Shashi; Bunyak, Filiz; Palaniappan, Kannappan; Shaevitz, Joshua W

    2014-01-01

    The formation of a collectively moving group benefits individuals within a population in a variety of ways such as ultra-sensitivity to perturbation, collective modes of feeding, and protection from environmental stress. While some collective groups use a single organizing principle, others can dynamically shift the behavior of the group by modifying the interaction rules at the individual level. The surface-dwelling bacterium Myxococcus xanthus forms dynamic collective groups both to feed on prey and to aggregate during times of starvation. The latter behavior, termed fruiting-body formation, involves a complex, coordinated series of density changes that ultimately lead to three-dimensional aggregates comprising hundreds of thousands of cells and spores. This multi-step developmental process most likely involves several different single-celled behaviors as the population condenses from a loose, two-dimensional sheet to a three-dimensional mound. Here, we use high-resolution microscopy and computer vision sof...

  16. The hexagon hypothesis: Six disruptive scenarios.

    Science.gov (United States)

    Burtles, Jim

    2015-01-01

    This paper aims to bring a simple but effective and comprehensive approach to the development, delivery and monitoring of business continuity solutions. To ensure that the arguments and principles apply across the board, the paper sticks to basic underlying concepts rather than sophisticated interpretations. First, the paper explores what exactly people are defending themselves against. Secondly, the paper looks at how defences should be set up. Disruptive events tend to unfold in phases, each of which invites a particular style of protection, ranging from risk management through to business continuity to insurance cover. Their impact upon any business operation will fall into one of six basic scenarios. The hexagon hypothesis suggests that everyone should be prepared to deal with each of these six disruptive scenarios and it provides them with a useful benchmark for business continuity.

  17. Fibril Formation and Phase Separation in Aqueous Cellulose Ethers

    Science.gov (United States)

    Maxwell, Amanda; Schmidt, Peter; McAllister, John; Lott, Joseph; Bates, Frank; Lodge, Timothy

    Aqueous solutions of many cellulose ethers are known to undergo thermoreversible gelation and phase separation upon heating to form turbid hydrogels, but the mechanism and resulting structures have not been well understood. Turbidity, light scattering and small-angle neutron scattering (SANS) are used to show that hydroxypropyl methylcellulose (HPMC) chains are dissolved in water below 50 °C and undergo phase separation at higher temperatures. At 70 °C, at sufficiently high concentrations in water, HPMC orders into fibrillar structures with a well-defined radius of 18 +/- 2 nm, as characterized by cryogenic transmission electron microscopy and SANS. The HPMC fibril structure is independent of concentration and heating rate. However, HPMC fibrils do not form a percolating network as readily as is seen in methylcellulose, resulting in a lower hot-gel modulus, as demonstrated by rheology.

  18. Epitaxial stabilization of artificial hexagonal GdMnO3 thin films and their magnetic properties

    Science.gov (United States)

    Lee, D.; Lee, J.-H.; Murugavel, P.; Jang, S. Y.; Noh, T. W.; Jo, Y.; Jung, M.-H.; Ko, Y.-D.; Chung, J.-S.

    2007-04-01

    The authors investigated the role of oxygen partial pressure on the epitaxial growth of an artificial hexagonal GdMnO3 phase, which should exist in an orthorhombic structure in bulk. The hexagonal GdMnO3 film showed diverse, but obvious, magnetic phase transitions with highly enhanced ferromagnetic properties. Its remnant magnetization at 4.2K is higher than those of other hexagonal RMnO3 (R =Ho, Er, and Yb) compounds, and the Curie temperature increases by around 25K. The results demonstrate that the epitaxial stabilization technique is a promising method for fabricating an artificial material with enhanced magnetic properties.

  19. Pressure Dependence of Structure Stability of Multiferroic Hexagonal-RMnO3

    Science.gov (United States)

    Chen, Zhiqiang; Gao, Peng; Tyson, Trevor. A.; Liu, Zhenxian; Hu, Jinzhu; Zhang, Chenglin; Kim, Sung-Baek; Cheong, Sang-Wook

    2009-03-01

    We present high pressure IR and X-ray diffraction measurements of the hexagonal multiferroic systems HoMnO3, YMnO3 and LuMnO3. Measurements were conducted over the pressure range ambient to ˜20 GPa. No phase changes were observed over this broad range of hydrostatic pressures. These suggest that the hexagonal structure is stable at higher pressures. The thermal treatment is necessary to overcome the barrier (breaking and reconnection of bonds) to achieve the hexagonal to orthorhombic phase change. A discussion of the effect of hydrostatic pressure on the ferroelectric properties of these systems will be given based on comparisons with density functional calculations.

  20. Triblock siloxane copolymer surfactant: template for spherical mesoporous silica with a hexagonal pore ordering.

    Science.gov (United States)

    Stébé, M J; Emo, M; Forny-Le Follotec, A; Metlas-Komunjer, L; Pezron, I; Blin, J L

    2013-02-01

    Ordered mesoporous silica materials with a spherical morphology have been prepared for the first time through the cooperative templating mechanism (CTM) by using a silicone triblock copolymer as template. The behavior of the pure siloxane copolymer amphiphile in water was first investigated. A direct micellar phase (L(1)) and a hexagonal (H(1)) liquid crystal were found. The determination of the structural parameters by SAXS measurements leads us to conclude that in the hexagonal liquid crystal phase a part of the ethylene oxide group is not hydrated as observed for the micelles. Mesoporous materials were then synthesized from the cooperative templating mechanism. The recovered materials were characterized by SAXS measurements, nitrogen adsorption-desorption analysis, and transmission and scanning electron microscopy. The results clearly evidence that one can control the morphology and the nanostructuring of the resulting material by modifying the synthesis parameters. Actually, highly ordered mesoporous materials with a spherical morphology have been obtained with a siloxane copolymer/tetramethoxysilane molar ratio of 0.10 after hydrothermal treatment at 100 °C. Our study also supports the fact that the interactions between micelles and the hydrolyzed precursor are one of the key parameters governing the formation of ordered mesostructures through the cooperative templating mechanism. Indeed, we have demonstrated that when the interactions between micelles are important, only wormhole-like structures are recovered.

  1. Competing structures in two dimensions: Square-to-hexagonal transition

    Science.gov (United States)

    Gränz, Barbara; Korshunov, Sergey E.; Geshkenbein, Vadim B.; Blatter, Gianni

    2016-08-01

    We study a system of particles in two dimensions interacting via a dipolar long-range potential D /r3 and subject to a square-lattice substrate potential V (r ) with amplitude V and lattice constant b . The isotropic interaction favors a hexagonal arrangement of the particles with lattice constant a , which competes against the square symmetry of the underlying substrate lattice. We determine the minimal-energy states at fixed external pressure p generating the commensurate density n =1 /b2=(4/3 ) 1 /2/a2 in the absence of thermal and quantum fluctuations, using both analytical techniques based on the harmonic and continuum elastic approximations as well as numerical relaxation of particle configurations. At large substrate amplitude V >0.2 eD, with eD=D /b3 the dipolar energy scale, the particles reside in the substrate minima and hence arrange in a square lattice. Upon decreasing V , the square lattice turns unstable with respect to a zone-boundary shear mode and deforms into a period-doubled zigzag lattice. Analytic and numerical results show that this period-doubled phase in turn becomes unstable at V ≈0.074 eD towards a nonuniform phase developing an array of domain walls or solitons; as the density of solitons increases, the particle arrangement approaches that of a rhombic (or isosceles triangular) lattice. At a yet smaller substrate value estimated as V ≈0.046 eD, a further solitonic transition establishes a second nonuniform phase which smoothly approaches the hexagonal (or equilateral triangular) lattice phase with vanishing amplitude V . At small but finite amplitude V , the hexagonal phase is distorted and hexatically locked at an angle of φ ≈3 .8∘ with respect to the substrate lattice. The square-to-hexagonal transformation in this two-dimensional commensurate-incommensurate system thus involves a complex pathway with various nontrivial lattice- and modulated phases.

  2. Microstructures in phase-inversion membranes. Part I. Formation of macrovoids

    NARCIS (Netherlands)

    Smolders, C.A.; Smolders, C.A.; Reuvers, A.J.; Reuvers, A.J.; Boom, R.M.; Boom, R.M.; Wienk, I.M.; Wienk, I.M.

    1992-01-01

    A new mechanism for the formation of macrovoids in phase-inversion membranes is proposed. It is based on the observed difference in type of demixing of a thin film of a polymer solution when immersed in a nonsolvent bath: delayed or instantaneous demixing. The explanation for macrovoid formation ass

  3. [Formation of the third phase and spectroscopic research of the loading organic phases in the gold extraction].

    Science.gov (United States)

    Jiang, Jian-zhun; Zhou, Wei-jin; Gao, Hong-cheng; Chen, Jing; Wu, Jin-guang

    2002-06-01

    The formation of the third phase during the gold extraction from cyanide solution by quaternary ammonium, tetradecyldimethylbenzylammonium chloride (TDMBAC) was studied by 198Au tracer method. The microstructure of the organic phases was investigated by FTIR, 31P-NMR. With the increasing of gold concentration, aggregations were formed in the gold-loaded organic phase. With the further increasing of gold concentration, the organic phase turned into two layers. Gold, water, and tri-n-butyl phosphate (TBP) were mainly in the down organic phase. In the down layer, distinct O-H stretching vibration peak was found by FTIR; the frequency of P=O stretching vibration shifted to the low frequency; 31P-NMR chemical shift was markedly shifted to the high frequency field. The radius of aggregation was measured by the dynamic laser scattering (DLS) method.

  4. 640 Gbit/s RZ-to-NRZ format conversion based on optical phase filtering

    DEFF Research Database (Denmark)

    Maram, Reza; Kong, Deming; Galili, Michael;

    2014-01-01

    We propose a novel approach for all optical RZ-to-NRZ conversion based on optical phase filtering. The proposed concept is experimentally validated through format conversion of a 640 Gbit/s coherent RZ signal to NRZ signal using a simple phase filter implemented by a commercial optical waveshaper....

  5. Phase-field modeling of microstructural pattern formation in alloys and geological veins

    OpenAIRE

    Ankit, Kumar

    2016-01-01

    With the advent of high performance computing, the application areas of the phase-field method, traditionally used to numerically model the phase transformation in metals and alloys, have now spanned into geoscience. A systematic investigation of the two distinct scientific problems in consideration suggest a strong influence of interfacial energy on the natural and induced pattern formation in diffusion-controlled regime.

  6. Flow induced formation of dual-phase continuity in polymer blends and alloys

    DEFF Research Database (Denmark)

    Lyngaae-Jørgensen, Jørgen; Chtcherbakova, E.A.; Utracki, L.A.

    1997-01-01

    showed that an addition of block copolymer may narrow the volume fraction range where bi-continuous phase structures are formed. Both annealing in the molten stale and shearing history influence the measured phi(cr) for formation of bi-continuous phase structure in amorphous immiscible polymer blends....

  7. Pattern formation in a complex Swift-Hohenberg equation with phase bistability

    CERN Document Server

    de Valcárcel, Manuel Martínez-Quesada Germán J

    2016-01-01

    We study pattern formation in a complex Swift Hohenberg equation with phase-sensitive (parametric) gain. Such an equation serves as a universal order parameter equation describing the onset of spontaneous oscillations in extended systems submitted to a kind of forcing dubbed rocking when the instability is towards long wavelengths. Applications include two-level lasers and photorefractive oscillators. Under rocking, the original continuous phase symmetry of the system is replaced by a discrete one, so that phase bistability emerges. This leads to the spontaneous formation of phase-locked spatial structures like phase domains and dark-ring (phase-) cavity solitons. Stability of the homogeneous solutions is studied and numerical simulations are made covering all the dynamical regimes of the model, which turn out to be very rich. Formal derivations of the rocked complex Swift-Hohenberg equation, using multiple scale techniques, are given for the two-level laser and the photorefractive oscillator.

  8. Formation of a two-phase microstructure in Fe-Cr-Ni alloy during directional solidification

    Science.gov (United States)

    Fu, J. W.; Yang, Y. S.; Guo, J. J.; Ma, J. C.; Tong, W. H.

    2008-12-01

    The formation and evolution of a two-phase coupled growth microstructure in AISI 304 stainless steel are investigated using a quenching method during directional solidification. It is found that the two-phase microstructure, which is composed of coupled growth of thin lathy delta ferrite (δ) and austenite (γ), forms from the melt first during solidification. As solidification proceeds, the retained liquid transforms into austenite directly. On cooling, the subsequent incomplete solid-state transformation from ferrite to austenite results in the disappearance of the thinner lathy delta ferrite, and the final two-phase coupled growth microstructure is formed. The formation mechanism of the two-phase coupled growth microstructure is analyzed theoretically based on the nucleation and constitutional undercooling (NCU) criterion. Transmission electron microscope (TEM) and EDS analyses were carried out to identify the phases and determine the phase composition, respectively.

  9. Formation of laves phase in a refractory austenitic steel due to long-term heating

    Science.gov (United States)

    Tarasenko, L. V.; Shal'kevich, A. B.

    2011-07-01

    Steels of the Fe - Cr - Ni -Mo - Nb - Al - C system are studied by methods of phase physicochemical analysis and electron microscopy with the aim to determine the causes of changes in mechanical properties after long-term heating at a temperature of 600 - 700°C. Grain-boundary formation of particles of a Laves phase is shown to cause decrease in the impact toughness and transformation of particles of γ'-phase under conditions of creep. The effect of alloying elements on the chemical composition of the multicomponent Laves phase is studied depending on the temperatures of hardening, aging, and subsequent heating. Concentration correspondence between the chemical composition of the austenite and the intermetallic tcp phase formed in aging is discovered. A computational scheme for predicting the possibility of formation of Laves phases in multicomponent alloys is suggested.

  10. Formation of aqueous-phase α-hydroxyhydroperoxides (α-HHP): potential atmospheric impacts

    Science.gov (United States)

    Zhao, R.; Lee, A. K. Y.; Soong, R.; Simpson, A. J.; Abbatt, J. P. D.

    2013-06-01

    The focus of this work is on quantifying the degree of the aqueous-phase formation of α-hydroxyhydroperoxides (α-HHPs) via reversible nucleophilic addition of H2O2 to aldehydes. Formation of this class of highly oxygenated organic hydroperoxides represents a poorly characterized aqueous-phase processing pathway that may lead to enhanced SOA formation and aerosol toxicity. Specifically, the equilibrium constants of α-HHP formation have been determined using proton nuclear-magnetic-resonance (1H NMR) spectroscopy and proton-transfer-reaction mass spectrometry (PTR-MS). Significant α-HHP formation was observed from formaldehyde, acetaldehyde, propionaldehyde, glycolaldehyde, glyoxylic acid, and methylglyoxal, but not from methacrolein and ketones. Low temperatures enhanced the formation of α-HHPs but slowed their formation rates. High inorganic salt concentrations shifted the equilibria toward the hydrated form of the aldehydes and slightly suppressed α-HHP formation. Using the experimental equilibrium constants, we predict the equilibrium concentration of α-HHPs to be in the μM level in cloud water, but it may also be present in the mM level in aerosol liquid water (ALW), where the concentrations of H2O2 and aldehydes can be high. Formation of α-HHPs in ALW may significantly affect the effective Henry's law constants of H2O2 and aldehydes but may not affect their gas-phase levels. The photochemistry and reactivity of this class of atmospheric species have not been studied.

  11. Formation of aqueous-phase α-hydroxyhydroperoxides (α-HHP: potential atmospheric impacts

    Directory of Open Access Journals (Sweden)

    R. Zhao

    2013-06-01

    Full Text Available The focus of this work is on quantifying the degree of the aqueous-phase formation of α-hydroxyhydroperoxides (α-HHPs via reversible nucleophilic addition of H2O2 to aldehydes. Formation of this class of highly oxygenated organic hydroperoxides represents a poorly characterized aqueous-phase processing pathway that may lead to enhanced SOA formation and aerosol toxicity. Specifically, the equilibrium constants of α-HHP formation have been determined using proton nuclear-magnetic-resonance (1H NMR spectroscopy and proton-transfer-reaction mass spectrometry (PTR-MS. Significant α-HHP formation was observed from formaldehyde, acetaldehyde, propionaldehyde, glycolaldehyde, glyoxylic acid, and methylglyoxal, but not from methacrolein and ketones. Low temperatures enhanced the formation of α-HHPs but slowed their formation rates. High inorganic salt concentrations shifted the equilibria toward the hydrated form of the aldehydes and slightly suppressed α-HHP formation. Using the experimental equilibrium constants, we predict the equilibrium concentration of α-HHPs to be in the μM level in cloud water, but it may also be present in the mM level in aerosol liquid water (ALW, where the concentrations of H2O2 and aldehydes can be high. Formation of α-HHPs in ALW may significantly affect the effective Henry's law constants of H2O2 and aldehydes but may not affect their gas-phase levels. The photochemistry and reactivity of this class of atmospheric species have not been studied.

  12. Asymptotic formation and orbital stability of phase-locked states for the Kuramoto model

    Science.gov (United States)

    Choi, Young-Pil; Ha, Seung-Yeal; Jung, Sungeun; Kim, Yongduck

    2012-04-01

    We discuss the asymptotic formation and nonlinear orbital stability of phase-locked states arising from the ensemble of non-identical Kuramoto oscillators. We provide an explicit lower bound for a coupling strength on the formation of phase-locked states, which only depends on the diameters of natural frequencies and initial phase configurations. We show that, when the phases of non-identical oscillators are distributed over the half circle and the coupling strength is sufficiently large, the dynamics of Kuramoto oscillators exhibits two stages (transition and relaxation stages). In a transition stage, initial configurations shrink to configurations whose diameters are strictly less than {π}/{2} in a finite-time, and then the configurations tend to phase-locked states asymptotically. This improves previous results on the formation of phase-locked states by Chopra-Spong (2009) [26] and Ha-Ha-Kim (2010) [27] where their attention were focused only on the latter relaxation stage. We also show that the Kuramoto model is ℓ1-contractive in the sense that the ℓ1-distance along two smooth Kuramoto flows is less than or equal to that of initial configurations. In particular, when two initial configurations have the same averaged phases, the ℓ1-distance between them decays to zero exponentially fast. For the configurations with different phase averages, we use the method of average adjustment and translation-invariant of the Kuramoto model to show that one solution converges to the translation of the other solution exponentially fast. This establishes the orbital stability of the phase-locked states. Our stability analysis does not employ any standard linearization technique around the given phase-locked states, but instead, we use a robust ℓ1-metric functional as a Lyapunov functional. In the formation process of phase-locked states, we estimate the number of collisions between oscillators, and lower-upper bounds of the transversal phase differences.

  13. Spontaneous formation of circular and vortex ferroelectric domain structure in hexagonal YMnO{sub 3} and YMn{sub 0.9}Fe{sub 0.1}O{sub 3} prepared by low temperature solution synthesis

    Energy Technology Data Exchange (ETDEWEB)

    Harunsani, M. H.; Walton, R. I., E-mail: r.i.walton@warwick.ac.uk, E-mail: hxyang@iphy.ac.cn [Department of Chemistry, University of Warwick, Coventry CV4 7AL (United Kingdom); Li, J.; Qin, Y. B.; Tian, H. T.; Li, J. Q.; Yang, H. X., E-mail: r.i.walton@warwick.ac.uk, E-mail: hxyang@iphy.ac.cn [Beijing National Laboratory for Condensed Matter Physics, Institute of Physics, Chinese Academy of Sciences, Beijing 100190 (China)

    2015-08-10

    We report an experimental study of the domain structure of ferroelectric YMnO{sub 3} and YMn{sub 0.9}Fe{sub 0.1}O{sub 3} using polycrystalline samples prepared by direct hydrothermal crystallisation at 240 °C, well below their structural phase transition temperatures. Powder X-ray diffraction shows the expected P6{sub 3}cm space group for both samples with an increase in a and a small decrease in c with Fe incorporation, consistent with an adjustment of MnO{sub 5} tilting, while XANES spectra at the Mn and Fe K edges show the oxidation state of both metals are maintained at +3 in the doped sample. High resolution TEM shows that curved stripe, annular and vortex domains can all be observed in the YMnO{sub 3} crystals, proving that the structural phase transition is not the only driving force for the occurrence of the annular and vortex domains. Furthermore, the absence of the annular and vortex domains in YMn{sub 0.9}Fe{sub 0.1}O{sub 3} indicates that the tilting state of MnO{sub 5} bipyramids plays an important role in the domain formation. Atomic resolution STEM images confirm that the ferroelectric domain walls correspond to structural antiphase boundaries similar to the crystals made via high temperature solid-state reactions.

  14. Formation of unequilibrated R chondrite chondrules and opaque phases

    Science.gov (United States)

    Miller, K. E.; Lauretta, D. S.; Connolly, H. C.; Berger, E. L.; Nagashima, K.; Domanik, K.

    2017-07-01

    Sulfide assemblages are commonly found in chondritic meteorites as small inclusions in the matrix or in association with chondrules. These assemblages are widely hypothesized to form through pre-accretionary corrosion of metal by H2S gas or through parent body processes. We report here on two unequilibrated R chondrite samples that contain large, chondrule-sized sulfide nodules in the matrix. Both samples are from Mount Prestrud (PRE) 95404. Chemical maps and spot and broad-beam electron microprobe analyses (EMPA) were used to assess the distribution, stoichiometry, and bulk composition of sulfide nodules and silicate chondrules in the clasts. Oxygen isotope data were collected via secondary ion mass spectrometry (SIMS) to assess the relationship of chondrules to other chondrite groups. Scanning electron microscopy (SEM), focused ion beam (FIB), and transmission electron microscopy (TEM) analyses were used to assess fine-scale features and identify crystal structures in sulfide assemblages. Thermodynamic models were used to assess the temperature, sulfur fugacity (fS2), total pressure, dust-to-gas ratio, and oxygen fugacity (fO2) conditions during sulfide nodule and chondrule formation. The unequilibrated clasts include a mixture of type I and type II chondrules, as well as non-porphyritic chondrules. Chondrule oxygen isotopes overlap with ordinary-chondrite chondrules. Sulfide nodules average 200 μm in diameter, have rounded shapes, and are primarily composed of pyrrhotite, pentlandite, and magnetite. Some are deformed around chondrules in a petrologic relationship similar in appearance to compound chondrules. Both nodules and sulfides in chondrules include phosphate inclusions and Cu-rich lamellae, which suggests a genetic relationship between sulfides in chondrules and in the matrix. Ni/Co ratios for matrix and chondrule sulfides are solar, while Fe and Ni are non-solar and inversely related. We hypothesize that sulfide nodules formed via pre-accretionary melt

  15. Relationship between Multi-Phase Formation and Molecular Structure for Liquid Crystal System

    Institute of Scientific and Technical Information of China (English)

    LI Zhenxin; MA Heng; LI Shipu

    2005-01-01

    A mechanical model of liquid crystals ( LCs ) was used to explain the phase formation and thermal properties. The LC phases in the model are micro-machine systems consisting of an ensemble of molecular rotors, and some dynamic parameters in a semi-experiment molecular orbit method. A novel explanation on the multi-phase formation of LC system is obtained. It is found that the value of the critical rotational velocity is a key parameter for the characterization of each homologous series. The dipole moment of the molecules was also discussed.

  16. Lattice-Polarity-Driven Epitaxy of Hexagonal Semiconductor Nanowires.

    Science.gov (United States)

    Wang, Ping; Yuan, Ying; Zhao, Chao; Wang, Xinqiang; Zheng, Xiantong; Rong, Xin; Wang, Tao; Sheng, Bowen; Wang, Qingxiao; Zhang, Yongqiang; Bian, Lifeng; Yang, Xuelin; Xu, Fujun; Qin, Zhixin; Li, Xinzheng; Zhang, Xixiang; Shen, Bo

    2016-02-10

    Lattice-polarity-driven epitaxy of hexagonal semiconductor nanowires (NWs) is demonstrated on InN NWs. In-polarity InN NWs form typical hexagonal structure with pyramidal growth front, whereas N-polarity InN NWs slowly turn to the shape of hexagonal pyramid and then convert to an inverted pyramid growth, forming diagonal pyramids with flat surfaces and finally coalescence with each other. This contrary growth behavior driven by lattice-polarity is most likely due to the relatively lower growth rate of the (0001̅) plane, which results from the fact that the diffusion barriers of In and N adatoms on the (0001) plane (0.18 and 1.0 eV, respectively) are about 2-fold larger in magnitude than those on the (0001̅) plane (0.07 and 0.52 eV), as calculated by first-principles density functional theory (DFT). The formation of diagonal pyramids for the N-polarity hexagonal NWs affords a novel way to locate quantum dot in the kink position, suggesting a new recipe for the fabrication of dot-based devices.

  17. Lattice-polarity-driven epitaxy of hexagonal semiconductor nanowires

    KAUST Repository

    Wang, Ping

    2015-12-22

    Lattice-polarity-driven epitaxy of hexagonal semiconductor nanowires (NWs) is demonstrated on InN NWs. In-polarity InN NWs form typical hexagonal structure with pyramidal growth front, whereas N-polarity InN NWs slowly turn to the shape of hexagonal pyramid and then convert to an inverted pyramid growth, forming diagonal pyramids with flat surfaces and finally coalescence with each other. This contrary growth behavior driven by lattice-polarity is most likely due to the relatively lower growth rate of the (0001 ̅) plane, which results from the fact that the diffusion barriers of In and N adatoms on the (0001) plane (0.18 and 1.0 eV, respectively) are about two-fold larger in magnitude than those on the (0001 ̅) plane (0.07 and 0.52 eV), as calculated by first-principles density functional theory (DFT). The formation of diagonal pyramids for the N-polarity hexagonal NWs affords a novel way to locate quantum dot in the kink position, suggesting a new recipe for the fabrication of dot-based devices.

  18. Intermetallic Phase Formation in Explosively Welded Al/Cu Bimetals

    Science.gov (United States)

    Amani, H.; Soltanieh, M.

    2016-08-01

    Diffusion couples of aluminum and copper were fabricated by explosive welding process. The interface evolution caused by annealing at different temperatures and time durations was investigated by means of optical microscopy, scanning electron microscopy equipped with energy dispersive spectroscopy, and x-ray diffraction. Annealing in the temperature range of 573 K to 773 K (300 °C to 500 °C) up to 408 hours showed that four types of intermetallic layers have been formed at the interface, namely Al2Cu, AlCu, Al3Cu4, and Al4Cu9. Moreover, it was observed that iron trace in aluminum caused the formation of Fe-bearing intermetallics in Al, which is near the interface of the Al-Cu intermetallic layers. Finally, the activation energies for the growth of Al2Cu, AlCu + Al3Cu4, Al4Cu9, and the total intermetallic layer were calculated to be about 83.3, 112.8, 121.6, and 109.4 kJ/mol, respectively. Considering common welding methods ( i.e., explosive welding, cold rolling, and friction welding), although there is a great difference in welding mechanism, it is found that the total activation energy is approximately the same.

  19. Effect of hardness of martensite and ferrite on void formation in dual phase steel

    DEFF Research Database (Denmark)

    Azuma, M.; Goutianos, Stergios; Hansen, Niels;

    2012-01-01

    The influence of the hardness of martensite and ferrite phases in dual phase steel on void formation has been investigated by in situ tensile loading in a scanning electron microscope. Microstructural observations have shown that most voids form in martensite by evolving four steps: plastic...... deformation of martensite, crack initiation at the martensite/ferrite interface, crack propagation leading to fracture of martensite particles and void formation by separation of particle fragments. It has been identified that the hardness effect is associated with the following aspects: strain partitioning...... between martensite and ferrite, strain localisation and critical strain required for void formation. Reducing the hardness difference between martensite and ferrite phases by tempering has been shown to be an effective approach to retard the void formation in martensite and thereby is expected to improve...

  20. CDS Simulation and Pattern Formation of Phase Separation

    Institute of Scientific and Technical Information of China (English)

    ZhangjiLIU; MenCHENG; 等

    1998-01-01

    Several properties of the generation and evolution of phase separating patterns for binary material studied by CDS model are proposed.The main conclusions are(1) for alloys spinodal decomposition,the conceptions of “macro-pattern” and “micropattern” are posed by “black-and-white graph”and “gray-scale graph” respectively.We find that though the four forms of map f that represent the self-evolution of order parameter in a cell (lattice)are similar to each other in “macro-pattern”,there are evident differences in their micro-pattern,e.g.,some different fine netted sturctures in the black domain and the white domain are found by the micro-pattern.so that distinct mechanical and physical behaviors shall be obtained.(2) If the two constituteons of block copolymers are not symmetric (i.e.r≠0.5),a pattern called “grain-strip cross pattern is discovered,is the 0.43

  1. The Process of TiB2-Cu Composite Phase and Structure Formation during Combustion Synthesis

    Institute of Scientific and Technical Information of China (English)

    XU Qiang; ZHANG Xinghong; HAN Jiecai; PAN Wei

    2006-01-01

    The reaction process of combustion synthesis for TiB2- Cu was investigated in detail using combustion-wave arresting experiment, X-ray diffraction (XRD) analysis, SEM analysis and differential thermal analysis ( DTA ). The XRD analysis results for the different parts of the quenched specimen shaw that TiCux intermetallic phase firstly forms with the propagation of combustion wave, and then Ti1.87 B50 and Ti3 B4 metastable phases come forth due to the diffusion of B atoms and finally the stable TiB2 phase forms because of the continuous diffusion of B atoms. The formation of TiB2 phase is not completed by one step, but undergoes several transient processes. The process of reaction synthesis for Ti-B-Cu ternary system can be divided into three main stages: melting of Cu and Ti, and the formation of Cu- Ti melt and few TiCux , TiBx intermetallic phases; large numbers of TiCux intermetallic phases formation and some fine TiB2 particles precipitation; and the TiB2 particles coarsening and the stable TiB2 and Cu two phases formation in the final product.

  2. Preparation of Highly Crystalline TiO2 Nanostructures by Acid-assisted Hydrothermal Treatment of Hexagonal-structured Nanocrystalline Titania/Cetyltrimethyammonium Bromide Nanoskeleton

    Directory of Open Access Journals (Sweden)

    Sakai Hideki

    2010-01-01

    Full Text Available Abstract Highly crystalline TiO2 nanostructures were prepared through a facile inorganic acid-assisted hydrothermal treatment of hexagonal-structured assemblies of nanocrystalline titiania templated by cetyltrimethylammonium bromide (Hex-ncTiO2/CTAB Nanoskeleton as starting materials. All samples were characterized by X-ray diffraction (XRD and transmission electron microscopy (TEM. The influence of hydrochloric acid concentration on the morphology, crystalline and the formation of the nanostructures were investigated. We found that the morphology and crystalline phase strongly depended on the hydrochloric acid concentrations. More importantly, crystalline phase was closely related to the morphology of TiO2 nanostructure. Nanoparticles were polycrystalline anatase phase, and aligned nanorods were single crystalline rutile phase. Possible formation mechanisms of TiO2 nanostructures with various crystalline phases and morphologies were proposed.

  3. Instability of vibrational modes in hexagonal lattice

    Science.gov (United States)

    Korznikova, Elena A.; Bachurin, Dmitry V.; Fomin, Sergey Yu.; Chetverikov, Alexander P.; Dmitriev, Sergey V.

    2017-02-01

    The phenomenon of modulational instability is investigated for all four delocalized short-wave vibrational modes recently found for the two-dimensional hexagonal lattice with the help of a group-theoretic approach. The polynomial pair potential with hard-type quartic nonlinearity ( β-FPU potential with β > 0) is used to describe interactions between atoms. As expected for the hard-type anharmonic interactions, for all four modes the frequency is found to increase with the amplitude. Frequency of the modes I and III bifurcates from the upper edge of the phonon spectrum, while that of the modes II and IV increases from inside the spectrum. It is also shown that the considered model supports spatially localized vibrational mode called discrete breather (DB) or intrinsic localized mode. DB frequency increases with the amplitude above the phonon spectrum. Two different scenarios of the mode decay were revealed. In the first scenario (for modes I and III), development of the modulational instability leads to a formation of long-lived DBs that radiate their energy slowly until thermal equilibrium is reached. In the second scenario (for modes II and IV) a transition to thermal oscillations of atoms is observed with no formation of DBs.

  4. Extremal hexagonal chains concerning largest eigenvalue

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    In this paper, we define a roll-attaching operation of a hexagonal chain, and prove Gutman's conjecture affirmatively by using the operation. The idea of the proof is also applicable to the results concerning extremal hexagonal chains for the Hosoya index and Merrifield-Simmons index.

  5. Characterization of the secondary flow in hexagonal ducts

    Science.gov (United States)

    Marin, O.; Vinuesa, R.; Obabko, A. V.; Schlatter, P.

    2016-12-01

    In this work we report the results of DNSs and LESs of the turbulent flow through hexagonal ducts at friction Reynolds numbers based on centerplane wall shear and duct half-height Reτ,c ≃ 180, 360, and 550. The evolution of the Fanning friction factor f with Re is in very good agreement with experimental measurements. A significant disagreement between the DNS and previous RANS simulations was found in the prediction of the in-plane velocity, and is explained through the inability of the RANS model to properly reproduce the secondary flow present in the hexagon. The kinetic energy of the secondary flow integrated over the cross-sectional area yz decreases with Re in the hexagon, whereas it remains constant with Re in square ducts at comparable Reynolds numbers. Close connection between the values of Reynolds stress u w ¯ on the horizontal wall close to the corner and the interaction of bursting events between the horizontal and inclined walls is found. This interaction leads to the formation of the secondary flow, and is less frequent in the hexagon as Re increases due to the 120∘ aperture of its vertex, whereas in the square duct the 90∘ corner leads to the same level of interaction with increasing Re. Analysis of turbulence statistics at the centerplane and the azimuthal variance of the mean flow and the fluctuations shows a close connection between hexagonal ducts and pipe flows, since the hexagon exhibits near-axisymmetric conditions up to a distance of around 0.15DH measured from its center. Spanwise distributions of wall-shear stress show that in square ducts the 90∘ corner sets the location of a high-speed streak at a distance zv+≃50 from it, whereas in hexagons the 120∘ aperture leads to a shorter distance of zv+≃38 . At these locations the root mean square of the wall-shear stresses exhibits an inflection point, which further shows the connections between the near-wall structures and the large-scale motions in the outer flow.

  6. The Molecular Structure of the Liquid Ordered Phase

    Science.gov (United States)

    Lyman, Edward

    2014-03-01

    Molecular dynamics simulations reveal substructures within the liquid-ordered phase of lipid bilayers. These substructures, identified in a 10 μsec all-atom trajectory of liquid-ordered/liquid-disordered coexistence (Lo/Ld) , are composed of saturated hydrocarbon chains packed with local hexagonal order, and separated by interstitial regions enriched in cholesterol and unsaturated chains. Lipid hydrocarbon chain order parameters calculated from the Lo phase are in excellent agreement with 2H NMR measurements; the local hexagonal packing is also consistent with 1H-MAS NMR spectra of the Lo phase, NMR diffusion experiments, and small angle X-ray- and neutron scattering. The balance of cholesterol-rich to local hexagonal order is proposed to control the partitioning of membrane components into the Lo regions. The latter have been frequently associated with formation of so-called rafts, platforms in the plasma membranes of cells that facilitate interaction between components of signaling pathways.

  7. Morphological, Raman, electrical and dielectric properties of rare earth doped X-type hexagonal ferrites

    Energy Technology Data Exchange (ETDEWEB)

    Majeed, Abdul, E-mail: abdulmajeed2276@gmail.com [Department of Physics, The Islamia University of Bahawalpur, Bahawalpur 63100 (Pakistan); Center for Computational Materials Science, Department of Physics, University of Malakand, Chakdara, Dir (Lower) 18800 (Pakistan); Khan, Muhammad Azhar, E-mail: azhar.khan@iub.edu.pk [Department of Physics, The Islamia University of Bahawalpur, Bahawalpur 63100 (Pakistan); Raheem, Faseeh ur [Department of Physics, The Islamia University of Bahawalpur, Bahawalpur 63100 (Pakistan); Ahmad, Iftikhar [Center for Computational Materials Science, Department of Physics, University of Malakand, Chakdara, Dir (Lower) 18800 (Pakistan); Department of Physics, Abbottabad University of Science & Technology, Abbottabad (Pakistan); Akhtar, Majid Niaz [Department of Physics, COMSATS Institute of Information Technology, Lahore 54000 (Pakistan); Warsi, Muhammad Farooq [Department of Chemistry, The Islamia University of Bahawalpur, Bahawalpur 63100 (Pakistan)

    2016-12-15

    The influence of rare-earth metals (La, Nd, Gd, Tb, Dy) on morphology, Raman, electrical and dielectric properties of Ba{sub 2}NiCoRE{sub x}Fe{sub 28−}xO{sub 46} ferrites were studied. The scanning electron microscopy (SEM) exhibited the platelet like structure of these hexagonal ferrites. The surface morphology indicated the formation of ferrite grains in the nano-regime scale. The bands obtained at lower wave number may be attributed to the metal-oxygen vibration at octahedral site which confirm the development of hexagonal phase of these ferrites. The resonance peaks were observed in dielectric constant, dielectric loss factor and quality factor versus frequency graphs. These dielectric parameters indicate that these ferrites nano-materials are potential candidates in the high frequency applications. The enhancement in DC electric resistivity from 2.48×10{sup 8} to 1.20×10{sup 9} Ω cm indicates that the prepared materials are beneficial for decreasing the eddy current losses at high frequencies and for the fabrication of multilayer chip inductor (MLCI) devices.

  8. Morphological, Raman, electrical and dielectric properties of rare earth doped X-type hexagonal ferrites

    Science.gov (United States)

    Majeed, Abdul; Khan, Muhammad Azhar; ur Raheem, Faseeh; Ahmad, Iftikhar; Akhtar, Majid Niaz; Warsi, Muhammad Farooq

    2016-12-01

    The influence of rare-earth metals (La, Nd, Gd, Tb, Dy) on morphology, Raman, electrical and dielectric properties of Ba2NiCoRExFe28-xO46 ferrites were studied. The scanning electron microscopy (SEM) exhibited the platelet like structure of these hexagonal ferrites. The surface morphology indicated the formation of ferrite grains in the nano-regime scale. The bands obtained at lower wave number may be attributed to the metal-oxygen vibration at octahedral site which confirm the development of hexagonal phase of these ferrites. The resonance peaks were observed in dielectric constant, dielectric loss factor and quality factor versus frequency graphs. These dielectric parameters indicate that these ferrites nano-materials are potential candidates in the high frequency applications. The enhancement in DC electric resistivity from 2.48×108 to 1.20×109 Ω cm indicates that the prepared materials are beneficial for decreasing the eddy current losses at high frequencies and for the fabrication of multilayer chip inductor (MLCI) devices.

  9. Crystallization of -type hexagonal ferrites from mechanically activated mixtures of barium carbonate and goethite

    Indian Academy of Sciences (India)

    J Temuujin; M Aoyama; M Senna; T Masuko; C Ando; H Kishi; A Minjigmaa

    2006-10-01

    -type hexagonal ferrite precursor was prepared by a soft mechanochemical treatment of BaCO3 and -FeOOH mixtures. The effect of milling on its structure and thermal behaviour was examined by XRD, SEM and FTIR. Well crystallized -type hexagonal ferrite was formed from just 1 h milled precursors at 800°C. The beneficial effect of milling was explained in terms of increased homogeneity with simultaneous hetero bridging bond formation between powder constituents.

  10. Soliton Formation in Whispering-Gallery-Mode Resonators via Input Phase Modulation

    CERN Document Server

    Taheri, Hossein; Wiesenfeld, Kurt; Adibi, Ali

    2014-01-01

    We propose a method for soliton formation in whispering-gallery-mode (WGM) resonators through input phase modulation. Our numerical simulations of a variant of the Lugiato-Lefever equation suggest that modulating the input phase at a frequency equal to the resonator free-spectral-range and at modest modulation depths provides a deterministic route towards soliton formation in WGM resonators without undergoing a chaotic phase. We show that the generated solitonic state is sustained when the modulation is turned off adiabatically. Our results support parametric seeding as a powerful means of control, besides input pump power and pump-resonance detuning, over frequency comb generation in WGM resonators. Our findings also help pave the path towards ultra-short pulse formation on a chip.

  11. Controlled synthesis of triangular and hexagonal Ni nanosheets and their size-dependent properties

    Energy Technology Data Exchange (ETDEWEB)

    Leng Yonghua [State Key Laboratory of Rare Earth Materials Chemistry and Applications, College of Chemistry and Molecular Engineering, Peking University, Beijing 100871 (China); Wang Yuntao [State Key Laboratory of Rare Earth Materials Chemistry and Applications, College of Chemistry and Molecular Engineering, Peking University, Beijing 100871 (China); Li Xingguo [State Key Laboratory of Rare Earth Materials Chemistry and Applications, College of Chemistry and Molecular Engineering, Peking University, Beijing 100871 (China); Liu Tong [Department of Materials Science and Engineering, Faculty of Engineering, Iwate University, 4-3-5 Ueda, Morioka, 020-8551 (Japan); Takahashhi, Seiki [Department of Materials Science and Engineering, Faculty of Engineering, Iwate University, 4-3-5 Ueda, Morioka, 020-8551 (Japan)

    2006-10-14

    A solution phase method has been used to synthesize triangular and hexagonal Ni nanosheets with different edge lengths by controlling the reaction kinetics. This procedure is realized by introducing Fe(CO){sub 5} into the reaction system to slow the formation rate of Ni(0). The introduced Fe(CO){sub 5} exists as Fe(III) ions in the solution, which could oxidize Ni(0) back to Ni(II). By controlling the nucleation density, the sheet edge lengths could be changed from 19 nm to several hundreds of nanometres. The Ni nanosheets exhibit the transition from superparamagnetism to ferromagnetism with increasing sheet edge lengths. Their blocking temperature decreases with applied field and increasing sheet edge lengths. The Ni nanosheets also exhibit a surface plasmon resonance (SPR) feature, which is quite different from that of the Ni nanoparticles.

  12. Ar + induced interfacial mixing and phase formation in the Al/Cr system

    Science.gov (United States)

    Kim, H. K.; Kim, S. O.; Song, J. H.; Kim, K. W.; Woo, J. J.; Whang, C. N.; Smith, R. J.

    1991-07-01

    Evaporated Al/Cr bilayer thin films were irradiated by 80 keV Ar + at doses in the range from 1 × 10 15 to 2 × 10 16 Ar +/cm 2 at room temperature in order to investigate the Ar + induced interfacial mixing behavior and the phase formation and transition by Ar + bombardment. Ion bombardment induces intermixing across the Al/Cr interface and mixing variance increases with increasing ion dose. Cascade and thermal spike models are found to be not adequate for the ion beam mixing mechanism at room temperature in this system. The Al 13Cr 2 phase is formed as an initial phase by ion beam mixing and then transforms into the Al 11Cr 2 or Al 4Cr phases at subsequent ion bombardment. This result is discussed in terms of the enhanced atomic mobility and the thermodynamical driving force by introducing the concept of an effective heat of formation.

  13. Investigation of wing crack formation with a combined phase-field and experimental approach

    Science.gov (United States)

    Lee, Sanghyun; Reber, Jacqueline E.; Hayman, Nicholas W.; Wheeler, Mary F.

    2016-08-01

    Fractures that propagate off of weak slip planes are known as wing cracks and often play important roles in both tectonic deformation and fluid flow across reservoir seals. Previous numerical models have produced the basic kinematics of wing crack openings but generally have not been able to capture fracture geometries seen in nature. Here we present both a phase-field modeling approach and a physical experiment using gelatin for a wing crack formation. By treating the fracture surfaces as diffusive zones instead of as discontinuities, the phase-field model does not require consideration of unpredictable rock properties or stress inhomogeneities around crack tips. It is shown by benchmarking the models with physical experiments that the numerical assumptions in the phase-field approach do not affect the final model predictions of wing crack nucleation and growth. With this study, we demonstrate that it is feasible to implement the formation of wing cracks in large scale phase-field reservoir models.

  14. Regularities of formation of ternary alloy phases between non-transition metals

    Institute of Scientific and Technical Information of China (English)

    姚莉秀; 陈瑞亮; 钦佩; 陈念贻; 陆文聪

    2000-01-01

    Using a four-parameter model based on extended Miedema’ s cellular model of alloy phases and pattern recognition methods, the regularities of formation of ternary intermetallic compounds between non-transition metals have been investigated. The criterion of formation can be expressed as some empirical functions of Φ (electronegativity), nws1/3( valence electron density in Wagn-er-Seitz cell), R (Pauling’s metallic radius) and Z (number of valence electrons in atom).

  15. Regularities of formation of ternary alloy phases between non-transition metals

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    Using a four-parameter model based on extended Miedema's cellular model of alloy phases and pattern recognition methods, the regularities of formation of ternary intermetallic compounds between non-transition metals have been investigated. The criterion of formation can be expressed as some empirical functions of Ф (electronegativity), n1/3WS (valence electron density in Wagner-Seitz cell), R (Pauling's metallic radius) and Z (number of valence electrons in atom).

  16. Formation of complex organic molecules in cold objects: the role of gas phase reactions

    OpenAIRE

    Balucani, Nadia; Ceccarelli, Cecilia; Taquet, Vianney

    2015-01-01

    While astrochemical models are successful in reproducing many of the observed interstellar species, they have been struggling to explain the observed abundances of complex organic molecules. Current models tend to privilege grain surface over gas phase chemistry in their formation. One key assumption of those models is that radicals trapped in the grain mantles gain mobility and react on lukewarm (>30 K) dust grains. Thus, the recent detections of methyl formate (MF) and dimethyl ether (DME) ...

  17. Investigation of phase separation behavior and formation of plasmonic nanocomposites from polypeptide-gold nanorod nanoassemblies.

    Science.gov (United States)

    Huang, Huang-Chiao; Nanda, Alisha; Rege, Kaushal

    2012-04-24

    Genetically engineered elastin-like polypeptides (ELP) can be interfaced with cetyltrimethyl ammonium bromide (CTAB)-stabilized gold nanorods (GNRs) resulting in the formation of stable dispersions (nanoassemblies). Increasing the dispersion temperature beyond the ELP transition temperature results in phase separation and formation of solid-phase ELP-GNR matrices (nanocomposites). Here, we investigated different physicochemical conditions that influence nanocomposite formation from temperature-induced phase separation of ELP-GNR nanoassemblies. The presence of cetyltrimethyl ammonium bromide (CTAB), used to template the formation of gold nanorods, plays a significant role in the phase separation behavior, with high concentrations of the surfactant leading to dramatic enhancements in ELP transition temperature. Nanocomposites could be generated at 37 °C in the presence of low CTAB concentrations (nanoassemblies leading to nanocomposites, but had minimal effect on nanocomposite maturation, which is a later-stage longer event. Finally, nanocomposites prepared in the presence of low CTAB concentrations demonstrated a superior photothermal response following laser irradiation compared to those generated using higher CTAB concentrations. Our results on understanding the formation of plasmonic/photothermal ELP-GNR nanocomposites have significant implications for tissue engineering, regenerative medicine, and drug delivery.

  18. Process Dynamics and Fractal Analysis of New Phase Formation in Thermal Processes

    Institute of Scientific and Technical Information of China (English)

    Wang J; Shen Z.W; Shen Z. Q

    2001-01-01

    Boiling and fouling are taken as typical examples of new phase formation process to be analyzed and discussed in this paper. The process dynamics of nucleate boiling is analyzed and its mechanism is discussed from the view point of self-organization. Fouling, which is a more complicated phenomenon of new phase formation, involves series of underlying processes. The morphology and fractal analysis of fouling on low-energy surface and that with fouling inhibitors are studied and discussed. It is suggested that considering the process dynamics, fractal analysis and self-organization, a new avenue of research should be found.

  19. Microcrystalline hexagonal tungsten bronze. 2. Dehydration dynamics.

    Science.gov (United States)

    Luca, Vittorio; Griffith, Christopher S; Hanna, John V

    2009-07-06

    Low-temperature (25-600 degrees C) thermal transformations have been studied for hydrothermally prepared, microcrystalline hexagonal tungsten bronze (HTB) phases A(x)WO(3+x/2).zH(2)O as a function of temperature, where A is an exchangeable cation (in this case Na(+) or Cs(+)) located in hexagonal structural tunnels. Thermal treatment of the as-prepared sodium- and cesium-exchanged phases in air were monitored using a conventional laboratory-based X-ray diffractometer, while thermal transformations in vacuum were studied using synchrotron X-ray and neutron diffraction. Concurrent thermogravimetric, diffuse reflectance infrared (DRIFT), and (23)Na and (133)Cs magic angle spinning (MAS) NMR spectroscopic studies have also been undertaken. For the cesium variant, cell volume contraction occurred from room temperature to about 350 degrees C, the regime in which water was "squeezed" out of tunnel sites. This was followed by a lattice expansion in the 350-600 degrees C temperature range. Over the entire temperature range, a net thermal contraction was observed, and this was the result of an anisotropic change in the cell dimensions which included a shortening of the A-O2 bond length. These changes explain why Cs(+) ions are locked into tunnel positions at temperatures as low as 400 degrees C, subsequently inducing a significant reduction in Cs(+) extractability under low pH (nitric acid) conditions. The changing Cs(+) speciation as detected by (133)Cs MAS NMR showed a condensation from multiple Cs sites, presumably associated with differing modes of Cs(+) hydration in the tunnels, to a single Cs(+) environment upon thermal transformation and water removal. While similar lattice contraction was observed for the as-prepared sodium variant, the smaller radius of Na(+) caused it to be relatively easily removed with acid in comparison to the Cs(+) variant. From (23)Na MAS NMR studies of the parent material, complex Na(+) speciation was observed with dehydrated and various

  20. Development of theory-based health messages: three-phase programme of formative research.

    Science.gov (United States)

    Epton, Tracy; Norman, Paul; Harris, Peter; Webb, Thomas; Snowsill, F Alexandra; Sheeran, Paschal

    2015-09-01

    Online health behaviour interventions have great potential but their effectiveness may be hindered by a lack of formative and theoretical work. This paper describes the process of formative research to develop theoretically and empirically based health messages that are culturally relevant and can be used in an online intervention to promote healthy lifestyle behaviours among new university students. Drawing on the Theory of Planned Behaviour, a three-phase programme of formative research was conducted with prospective and current undergraduate students to identify (i) modal salient beliefs (the most commonly held beliefs) about fruit and vegetable intake, physical activity, binge drinking and smoking, (ii) which beliefs predicted intentions/behaviour and (iii) reasons underlying each of the beliefs that could be targeted in health messages. Phase 1, conducted with 96 pre-university college students, elicited 56 beliefs about the behaviours. Phase 2, conducted with 3026 incoming university students, identified 32 of these beliefs that predicted intentions/behaviour. Phase 3, conducted with 627 current university students, elicited 102 reasons underlying the 32 beliefs to be used to construct health messages to bolster or challenge these beliefs. The three-phase programme of formative research provides researchers with an example of how to develop health messages with a strong theoretical- and empirical base for use in health behaviour change interventions.

  1. Development of theory-based health messages: three-phase programme of formative research

    Science.gov (United States)

    Epton, Tracy; Norman, Paul; Harris, Peter; Webb, Thomas; Snowsill, F. Alexandra; Sheeran, Paschal

    2015-01-01

    Online health behaviour interventions have great potential but their effectiveness may be hindered by a lack of formative and theoretical work. This paper describes the process of formative research to develop theoretically and empirically based health messages that are culturally relevant and can be used in an online intervention to promote healthy lifestyle behaviours among new university students. Drawing on the Theory of Planned Behaviour, a three-phase programme of formative research was conducted with prospective and current undergraduate students to identify (i) modal salient beliefs (the most commonly held beliefs) about fruit and vegetable intake, physical activity, binge drinking and smoking, (ii) which beliefs predicted intentions/behaviour and (iii) reasons underlying each of the beliefs that could be targeted in health messages. Phase 1, conducted with 96 pre-university college students, elicited 56 beliefs about the behaviours. Phase 2, conducted with 3026 incoming university students, identified 32 of these beliefs that predicted intentions/behaviour. Phase 3, conducted with 627 current university students, elicited 102 reasons underlying the 32 beliefs to be used to construct health messages to bolster or challenge these beliefs. The three-phase programme of formative research provides researchers with an example of how to develop health messages with a strong theoretical- and empirical base for use in health behaviour change interventions. PMID:24504361

  2. The self regulating star formation of gas rich dwarf galaxies in quiescent phase

    CERN Document Server

    Kobayashi, M A R; Kobayashi, Masakazu A.R.; Kamaya, Hideyuki

    2004-01-01

    The expected episodic or intermittent star formation histories (SFHs) of gas rich dwarf irregular galaxies (dIrrs) are the longstanding puzzles to understand their whole evolutional history. Solving this puzzle, we should grasp what physical mechanism causes the quiescent phase of star formation under the very gas rich condition after the first starburst phase. We consider that this quiescent phase is kept by lack of H2, which can be important coolant to generate the next generation of stars in the low-metal environment like dIrrs. Furthermore, in dIrrs, H2 formation through gas-phase reactions may dominate the one on dust-grain surfaces because their interstellar medium (ISM) are very plentiful and the typical dust-to-gas ratio of dIrrs (D_dIrrs = 1.31 x 10^-2 D_MW, where D_MW is its value for the local ISM) is on the same order with a critical value D_cr ~ 10^-2 D_MW. We show that the lack of H2 is mainly led by H- destruction when gas-phase H2 formation dominates since H- is important intermediary of gas-p...

  3. Follow up of the glassy phase formation as silicon oxide was added to Brownmillerite phase of Portland cement clinker

    Energy Technology Data Exchange (ETDEWEB)

    Hassaan, M. Y., E-mail: yousry@tedata.net.eg; Salem, S. M.; Ebrahim, F. M. [Al-Azhar University, Moessbauer Lab, Physics Department, Faculty of Science (Egypt)

    2009-01-15

    Brownmillerite phase is one of the four main phases of Portland cement clinker. It was prepared as pure C{sub 4}AF{sup 1} and C{sub 4}AF with different amount of SiO{sub 2}, (5, 10, 15, 20, 25, and 40 mol%) by addition. Pure C{sub 4}AF was prepared using CaO, Al{sub 2}O{sub 3} and Fe{sub 2}O{sub 3} according to the ratios 4:1:1. Each sample mixture was fired at 1,400 deg. C for 1 h then ground and introduced again to 1,400 deg. C for 1/2 h then quenched in air. The prepared samples were ground and measured using x-ray diffraction, scanning electron microscope, A.C. conductivity and Moessbauer spectroscopy. The results were correlated and discussed. The main finding is the formation of a glassy phase besides the C{sub 4}AF structure, in addition to the formation of the C{sub 2}S phase of cement clinker as SiO{sub 2} addition was upgraded. The electrical conductivity results showed that the 20 mol% SiO{sub 2} sample has the lowest ({sigma}) value.

  4. Delta ferrite-containing austenitic stainless steel resistant to the formation of undesirable phases upon aging

    Science.gov (United States)

    Leitnaker, James M.

    1981-01-01

    Austenitic stainless steel alloys containing delta ferrite, such as are used as weld deposits, are protected against the transformation of delta ferrite to sigma phase during aging by the presence of carbon plus nitrogen in a weight percent 0.015-0.030 times the volume percent ferrite present in the alloy. The formation of chi phase upon aging is controlled by controlling the Mo content.

  5. Influence of the selected alloy additions on limiting the phase formation in Cu-Zn alloys

    Directory of Open Access Journals (Sweden)

    J. Kozana

    2010-01-01

    Full Text Available Influence of the selected alloy additions into copper and zinc alloys was investigated in order to find out the possibility of limiting the precipitation of unfavourable phase . The observation of microstructures and strength tests were performed. The results of metallographic and strength investigations indicate positive influence of small amounts of nickel, cobalt or tellurium. The precise determination of the influence of the selected alloy additions on limiting the gamma phase formation will be the subject of further examinations.

  6. Influence of phase separation for surfactant driven pattern formation during ion beam erosion

    Energy Technology Data Exchange (ETDEWEB)

    Hofsaess, Hans; Zhang, Kun; Vetter, Ulrich; Bobes, Omar; Pape, Andre; Gehrke, Hans-Gregor; Broetzmann, Marc [II. Physikalisches Institut, Goettingen Univ. (Germany)

    2012-07-01

    We will present results on metal surfactant driven self-organized pattern formation on surfaces by ion beam erosion, with a focus on the role of phase separation for the initial steps of pattern formation. Si substrates were irradiated with 5 keV Xe ions at normal incidence and ion fluences up to 5.10{sup 17} Xe/cm{sup 2} under continuous deposition of surfactant atoms. In the absence of such surfactants uniform flat surfaces are obtained, while in the presence of Fe and Mo surfactants pronounced patterns like dots, combinations of dots and ripples with wavelengths around 100 nm are generated. The surfactant coverage and deposition direction determine the pattern type and the pattern orientation, respectively. A critical steady-state coverage for onset of dot formation and onset of ripple formation is in the range of 10{sup 15} and 5.10{sup 15} Xe/cm{sup 2}. The steady-state surface region consists of a thin amorphous metal silicide layer with high metal concentration in the ripple and dot regions. Pattern formation is explained by ion induced diffusion and phase separation of the initially flat amorphous silicide layer and subsequent ion beam erosion with composition dependent sputter yield. To investigate the role of initial phase separation we additionally compare the pattern formation for different other metal surfactants.

  7. Intermetallic phase formation in the system aluminium-gold studied by EBSD

    Energy Technology Data Exchange (ETDEWEB)

    Scheibe, Stefan; Maerz, Benjamin; Graff, Andreas; Petzold, Matthias [Fraunhofer Institut fuer Werkstoffmechanik Halle IWMH, Halle (Germany)

    2011-07-01

    In the system aluminium-gold 5 stable intermetallic phases (Al{sub 11}Au{sub 6}, AlAu, AlAu{sub 2}, Al{sub 3}Au{sub 8}, AlAu{sub 4}) exist. The combination of aluminium and gold is often used for wire bond interconnects in microelectronic devices. Intermetallic Al-Au phases are formed at the Al-Au bond interface of these interconnects and affect their reliability. To understand the possible failure mechanisms it is important to know which phases are involved and where they are located. In the study, two different sample types were used. To investigate phase formation in systems with excess of gold, Au wires were bonded on Al substrates. In contrast, Al wires were bonded on Au substrates to observe phase formation under excess of aluminium. After annealing at 150 C for different times, phase evolution was studied by EBSD. A metallographic preparation in combination with argon ion beam etching was developed to meet the requirements of the EBSD analysis. Pseudosymmetry, the similarity of diffraction patterns for different phases and the susceptibility to corrosion were specific challenges in this investigation. A precise phase differentiation with high spatial resolution was possible in most of the investigated cases. These results allow a better understanding of the Al-Au bonding mechanism as a function of the interface microstructure.

  8. Formation of aqueous-phase α-hydroxyhydroperoxides (α-HHP: potential atmospheric impacts

    Directory of Open Access Journals (Sweden)

    R. Zhao

    2013-02-01

    Full Text Available The focus of this work is on quantifying the degree of the aqueous-phase formation of α-hydroxyhydroperoxides (α-HHPs via reversible nucleophilic addition of H2O2 to aldehydes. Formation of this class of highly oxygenated organic hydroperoxides represents a poorly characterized aqueous-phase processing pathway that may lead to enhanced SOA formation and aerosol toxicity. Specifically, the equilibrium constants of α-HHP formation have been determined using proton nuclear resonance (1H NMR spectroscopy and proton transfer reaction mass spectrometry (PTR-MS. Significant α-HHP formation was observed from formaldehyde, acetaldehyde, propionaldehyde, glycolaldehyde, glyoxylic acid, methylglyoxal, but not from methacrolein and ketones. Low temperatures enhanced the formation of α-HHPs but slowed their formation rates. High inorganic salt concentrations shifted the equilibria toward the hydrated form of the aldehydes and slightly suppressed α-HHP formation. Using the experimental equilibrium constants, we predict the equilibrium concentration of α-HHPs to be in the μM level in cloud water but may be present in the mM level in aerosol liquid water (ALW, where the concentrations of H2O2 and aldehydes can be high. Formation of α-HHPs in ALW may significantly affect the effective Henry's law constants of H2O2 and aldehydes but may not affect their gas-phase levels. The photochemistry and reactivity of this class of atmospheric species have not been studied.

  9. Size distribution dynamics reveal particle-phase chemistry in organic aerosol formation.

    Science.gov (United States)

    Shiraiwa, Manabu; Yee, Lindsay D; Schilling, Katherine A; Loza, Christine L; Craven, Jill S; Zuend, Andreas; Ziemann, Paul J; Seinfeld, John H

    2013-07-16

    Organic aerosols are ubiquitous in the atmosphere and play a central role in climate, air quality, and public health. The aerosol size distribution is key in determining its optical properties and cloud condensation nucleus activity. The dominant portion of organic aerosol is formed through gas-phase oxidation of volatile organic compounds, so-called secondary organic aerosols (SOAs). Typical experimental measurements of SOA formation include total SOA mass and atomic oxygen-to-carbon ratio. These measurements, alone, are generally insufficient to reveal the extent to which condensed-phase reactions occur in conjunction with the multigeneration gas-phase photooxidation. Combining laboratory chamber experiments and kinetic gas-particle modeling for the dodecane SOA system, here we show that the presence of particle-phase chemistry is reflected in the evolution of the SOA size distribution as well as its mass concentration. Particle-phase reactions are predicted to occur mainly at the particle surface, and the reaction products contribute more than half of the SOA mass. Chamber photooxidation with a midexperiment aldehyde injection confirms that heterogeneous reaction of aldehydes with organic hydroperoxides forming peroxyhemiacetals can lead to a large increase in SOA mass. Although experiments need to be conducted with other SOA precursor hydrocarbons, current results demonstrate coupling between particle-phase chemistry and size distribution dynamics in the formation of SOAs, thereby opening up an avenue for analysis of the SOA formation process.

  10. sd(2) Graphene: Kagome band in a hexagonal lattice.

    Science.gov (United States)

    Zhou, Miao; Liu, Zheng; Ming, Wenmei; Wang, Zhengfei; Liu, Feng

    2014-12-05

    Graphene, made of sp^{2} hybridized carbon, is characterized with a Dirac band, representative of its underlying 2D hexagonal lattice. The fundamental understanding of graphene has recently spurred a surge in the search for 2D topological quantum phases in solid-state materials. Here, we propose a new form of 2D material, consisting of sd^{2} hybridized transition metal atoms in hexagonal lattice, called sd^{2} "graphene." The sd^{2} graphene is characterized by bond-centered electronic hopping, which transforms the apparent atomic hexagonal lattice into the physics of a kagome lattice that may exhibit a wide range of topological quantum phases. Based on first-principles calculations, room-temperature quantum anomalous Hall states with an energy gap of ∼0.1  eV are demonstrated for one such lattice made of W, which can be epitaxially grown on a semiconductor surface of 1/3 monolayer Cl-covered Si(111), with high thermodynamic and kinetic stability.

  11. Energy of formation for AgIn liquid binary alloys along the line of phase separation

    CERN Document Server

    Bhuiyan, G M; Ziauddin-Ahmed, A Z

    2003-01-01

    We have investigated the energy of formation for AgIn liquid binary alloys along the solid-liquid phase separation line. A microscopic theory based on the first order perturbation has been applied. The interionic interaction and a reference liquid are the fundamental components of the theory. These are described by a local pseudopotential and the hard sphere liquids, respectively. The results of calculations reveal a characteristic feature that the energy of formation becomes minimum at the equiatomic composition, and thus indicates maximal mix-ability at this concentration. The energy of formation at a particular thermodynamic state that is at T 1173 K predicts the experimental trends fairly well.

  12. Three-phase heaters with common overburden sections for heating subsurface formations

    Energy Technology Data Exchange (ETDEWEB)

    Vinegar, Harold J [Bellaire, TX

    2012-02-14

    A heating system for a subsurface formation is described. The heating system includes three substantially u-shaped heaters with first end portions of the heaters being electrically coupled to a single, three-phase wye transformer and second end portions of the heaters being electrically coupled to each other and/or to ground. The three heaters may enter the formation through a first common wellbore and exit the formation through a second common wellbore so that the magnetic fields of the three heaters at least partially cancel out in the common wellbores.

  13. Topological states in two-dimensional hexagon lattice bilayers

    Science.gov (United States)

    Zhang, Ming-Ming; Xu, Lei; Zhang, Jun

    2016-10-01

    We investigate the topological states of the two-dimensional hexagon lattice bilayer. The system exhibits a quantum valley Hall (QVH) state when the interlayer interaction t⊥ is smaller than the nearest neighbor hopping energy t, and then translates to a trivial band insulator state when t⊥ / t > 1. Interestingly, the system is found to be a single-edge QVH state with t⊥ / t = 1. The topological phase transition also can be presented via changing bias voltage and sublattice potential in the system. The QVH states have different edge modes carrying valley current but no net charge current. The bias voltage and external electric field can be tuned easily in experiments, so the present results will provide potential application in valleytronics based on the two-dimensional hexagon lattice.

  14. Hexagonal boron-nitride nanomesh magnets

    Science.gov (United States)

    Ohata, C.; Tagami, R.; Nakanishi, Y.; Iwaki, R.; Nomura, K.; Haruyama, J.

    2016-09-01

    The formation of magnetic and spintronic devices using two-dimensional (2D) atom-thin layers has attracted attention. Ferromagnetisms (FMs) arising from zigzag-type atomic structure of edges of 2D atom-thin materials have been experimentally observed in graphene nanoribbons, hydrogen (H)-terminated graphene nanomeshes (NMs), and few-layer oxygen (O)-terminated black phosphorus NMs. Herein, we report room-temperature edge FM in few-layer hexagonal boron-nitride (hBN) NMs. O-terminated hBNNMs annealed at 500 °C show the largest FM, while it completely disappears in H-terminated hBNNMs. When hBNNMs are annealed at other temperatures, amplitude of the FM significantly decreases. These are highly in contrast to the case of graphene NMs but similar to the cases of black phosphorus NM and suggest that the hybridization of the O atoms with B(N) dangling bonds of zigzag pore edges, formed at the 500 °C annealing, strongly contribute to this edge FM. Room-temperature FM realizable only by exposing hBNNMs into air opens the way for high-efficiency 2D flexible magnetic and spintronic devices without the use of rare magnetic elements.

  15. Decrease in spermidine content during logarithmic phase of cell growth delays spore formation of Bacillus subtilis.

    Science.gov (United States)

    Ishii, I; Takada, H; Terao, K; Kakegawa, T; Igarashi, K; Hirose, S

    1994-11-01

    Bacillus subtilis 168M contained a large amount of spermidine during the logarithmic phase of growth, but the amount decreased drastically during the stationary phase. The extracts, prepared from B. subtilis cells harvested in the logarithmic phase, contained activity of arginine decarboxylase (ADC) rather than the activity of ornithine decarboxylase. In the presence of alpha-difluoromethylarginine (DFMA), a specific and irreversible inhibitor of ADC, the amount of spermidine in B. subtilis during the logarithmic phase decreased to about 25% of the control cells. Under these conditions, spore formation of B. subtilis 168M delayed greatly without significant inhibition of cell growth. The decrease in spermidine content in the logarithmic phase rather than in the stationary phase was involved in the delay of sporulation. Electron microscopy of cells at 24 hrs. of culture confirmed the delay of spore formation by the decrease of spermidine content. Furthermore, the delay of sporulation was negated by the addition of spermidine. These data suggest that a large amount of spermidine existing during the logarithmic phase plays an important role in the sporulation of B. subtilis.

  16. Theory of the formation of P4132(P4332)-phase spinels

    Science.gov (United States)

    Talanov, V. M.; Talanov, M. V.; Shirokov, V. B.

    2016-03-01

    A group-theoretical, thermodynamic, and structural study of the formation of P4132( P4332) spinel modification has been performed. In particular, the occurrence of unique hyper-kagome atomic order is analyzed. The critical order parameter inducing a phase transition is established. It is shown that the calculated structure of the low-symmetry P4132( P4332) phase is formed as a result of displacements of atoms of all types and due to the cation and anion ordering. The problem of the occurrence of unique hyper-kagome atomic order in the structures of P4132( P4332) spinel modifications is considered theoretically. It is proven within the Landau theory of phase transitions that the P4132( P4332) phase can be formed from the high-symmetry Fd3 m phase with an ideal spinel structure only as a result of first-order phase transition. Therefore, the formation of hyper-kagome sublattice in the P4132( P4332) phase is accompanied by a significant transformation of the spinel structure.

  17. Formation of metastable phases during solidification of Al-3.2 wt% Mn

    Energy Technology Data Exchange (ETDEWEB)

    Khvan, Alexandra V.; Cheverikin, Vladimir V.; Dinsdale, Alan T. [Thermochemistry of Materials SRC, National University of Science and Technology MISIS, 4 Leninsky Prosp., 119049 Moscow (Russian Federation); Watson, Andy [Thermochemistry of Materials SRC, National University of Science and Technology MISIS, 4 Leninsky Prosp., 119049 Moscow (Russian Federation); Institute for Materials Research, School of Chemical and Process Engineering, University of Leeds, LS2 9JT Leeds (United Kingdom); Levchenko, Viktor V.; Zolotorevskiy, Vadim S. [Department of Physical Metallurgy of Non-Ferrous Metals, National University of Science and Technology MISIS, 4 Leninsky Prosp., 119049 Moscow (Russian Federation)

    2015-02-15

    Highlights: • During rapid solidification of Al-Mn alloys, expected phases do not always form. • This has been verified in this study. • Calculations of phase equilibria using thermodynamics can help to explain this. • ‘Stable’ phases are shown to be kinetically inhibited from forming. - Abstract: The solidification of the technologically important Al-rich Al-Mn alloys has been studied both experimentally and by calculation of the phase equilibria. The results of previous experimental studies, which indicated that one or more stable intermetallic phases are suppressed on solidification from the liquid, have been confirmed. It was shown that it is important to consider the formation of Al{sub 11}Mn{sub 4} even though other intermetallic phases have a higher driving force for solidification. It is concluded that while an understanding of the thermodynamic properties of the phases is fundamental to modelling the formation of microstructure associated with solidification, it is necessary to take into account other effects such as the thermodynamic properties at interfaces and their effect on nucleation.

  18. Hexagonal image processing a practical approach

    CERN Document Server

    Middleton, Lee

    2006-01-01

    This book provides an introduction to the processing of hexagonally sampled images, includes a survey of the work done in the field, and presents a novel framework for hexagonal image processing (HIP) based on hierarchical aggregates. The strengths offered by hexagonal lattices over square lattices to define digital images are considerable: higher packing density; uniform connectivity of points (pixels) in the lattice; better angular resolution by virtue of having more nearest neighbours; and superlative representation of curves. The utility of the HIP framework is shown by implementing severa

  19. The ionic liquid isopropylammonium formate as a mobile phase modifier to improve protein stability during reversed phase liquid chromatography.

    Science.gov (United States)

    Zhou, Ling; Danielson, Neil D

    2013-12-01

    The room temperature ionic liquid isopropylammonium formate (IPAF) is studied as a reversed phase HPLC mobile phase modifier for separation of native proteins using a polymeric column and the protein stability is compared to that using acetonitrile (MeCN) as the standard organic mobile phase modifier. A variety of important proteins with different numbers of subunits are investigated, including non-subunit proteins: albumin, and amyloglucosidase (AMY); a two subunit protein: thyroglobulin (THY); and four subunit proteins: glutamate dehydrogenase (GDH) and lactate dehydrogenase (LDH). A significant enhancement in protein stability is observed in the chromatograms upon using IPAF as a mobile phase modifier. The first sharper peak at about 2min represented protein in primarily the native form and a second broader peak more retained at about 5-6min represented substantially denatured or possibly aggregated protein. The investigated proteins (except LDH) could maintain the native form within up to 50% IPAF, while a mobile phase, with as low as 10% MeCN, induced protein denaturation. The assay for pyruvate using LDH has further shown that enzymatic activity can be maintained up to 30% IPAF in water in contrast to no activity using 30% MeCN.

  20. Role of Nucleation and Growth in Two-Phase Microstructure Formation

    Energy Technology Data Exchange (ETDEWEB)

    Shin, Jong Ho [Iowa State Univ., Ames, IA (United States)

    2007-01-01

    During the directional solidification of peritectic alloys, a rich variety of two-phase microstructures develop, and the selection process of a specific microstructure is complicated due to the following two considerations. (1) In contrast to many single phase and eutectic microstructures that grow under steady state conditions, two-phase microstructures in a peritectic system often evolve under non-steady-state conditions that can lead to oscillatory microstructures, and (2) the microstructure is often governed by both the nucleation and the competitive growth of the two phases in which repeated nucleation can occur due to the change in the local conditions during growth. In this research, experimental studies in the Sn-Cd system were designed to isolate the effects of nucleation and competitive growth on the dynamics of complex microstructure formation. Experiments were carried out in capillary samples to obtain diffusive growth conditions so that the results can be analyzed quantitatively. At high thermal gradient and low velocity, oscillatory microstructures were observed in which repeated nucleation of the two phases was observed at the wall-solid-liquid junction. Quantitative measurements of nucleation undercooling were obtained for both the primary and the peritectic phase nucleation, and three different ampoule materials were used to examine the effect of different contact angles at the wall on nucleation undercooling. Nucleation undercooling for each phase was found to be very small, and the experimental undercooling values were orders of magnitude smaller than that predicted by the classical theory of nucleation. A new nucleation mechanism is proposed in which the clusters of atoms at the wall ahead of the interface can become a critical nucleus when the cluster encounters the triple junction. Once the nucleation of a new phase occurs, the microstructure is found to be controlled by the relative growth of the two phases that give rise to different

  1. A comparison of methods to predict solid phase heats of formation of molecular energetic salts.

    Science.gov (United States)

    Byrd, Edward F C; Rice, Betsy M

    2009-01-01

    In this study a variety of methods were used to compute the energies for lattice enthalpies and gas phase heats of formation of the ionic constituents used in Born-Fajans-Haber cycles to produce solid phase heats of formation of molecular ionic energetic crystals. Several quantum mechanically based or empirical approaches to calculate either the heat of formation of the ionic constituents in the gas phase (deltaH(o)f(g)) or the lattice enthalpy (deltaH(o)Lattice) were evaluated. Solid phase heats of formation calculated from combinations of deltaH(o)f(g) and deltaH(o)Lattice determined through various approaches are compared with experimental values for a series of molecular energetic salts with 1:1, 2:1 and 2:2 charge ratios. Recommendations for combinations of deltaH(o)f(g) and deltaH(o)Lattice to produce best agreement with experiment are given, along with suggestions for improvements of the methods.

  2. Formation of residual NAPL in three-phase systems: Experiments and numerical simulations

    NARCIS (Netherlands)

    Hofstee, C.; Oostrom, M.

    2002-01-01

    The formation of residual, discontinuous nonaqueous phase liquids (NAPLs) in the vadose zone is a process that is not well understood. The simulators have conveniently implemented the Leverett concept (Leverett and Lewis, 1941) which states that in a water-wet porous media, when fluid wettabilities

  3. Numerical modeling of gas-phase kinetics in formation of secondary aerosol

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    Three basic modules of gas-phase photochemical reactions involved in the formation of secondary aerosol are developed for modeling the concentration variation of precursors of aerosol, including ketone (RCOx), aldehyde (ALD), peroxyacetylnitrate (PAN), NO2, and SO2, followed by numerical solution for each of the modules. Reasonable trends of concentration variation of the precursors can be obtained from the proposed modules.

  4. Hydroformylation of dihydrofurans catalyzed by rhodium complex encapsulated hexagonal mesoporous silica

    KAUST Repository

    Khokhar, Munir

    2015-05-01

    HRh(CO)(PPh3)3 encapsulated hexagonal mesoporous silica (HMS) is found to be an efficient heterogeneous catalyst for the selective hydroformylation of 2,3-dihydrofuran (2,3DHF) and 2,5-dihydrofuran (2,5DHF). The Rh-complex encapsulated in situ in the organic phase of template inside the pores of HMS was found to act as nano phase reactors. Conversion of 2,3-DHF and 2,5-DHF and selectivity of the corresponding aldehydes were thoroughly investigated by studying the reaction parameters: catalyst amount, substrate concentration, partial as well as total pressure of CO and H2, and temperature. The selectivity for the formation of tetrahydrofuran-2-carbaldehyde (THF-2-carbaldehyde) from the hydroformylation of 2,3-DHF was found to be more than the selectivity of the formation of tetrahydrofuran-3-carbaldehyde (THF-3-carbaldehyde) from 2,5-DHF. The reaction paths are suggested and discussed for the selective formation of the corresponding aldehydes. The catalyst was elegantly separated and effectively recycled for six times.

  5. Keeping a Step Ahead: formative phase of a workplace intervention trial to prevent obesity.

    Science.gov (United States)

    Zapka, Jane; Lemon, Stephenie C; Estabrook, Barbara B; Jolicoeur, Denise G

    2007-11-01

    Ecological interventions hold promise for promoting overweight and obesity prevention in worksites. Given the paucity of evaluative research in the hospital worksite setting, considerable formative work is required for successful implementation and evaluation. This paper describes the formative phases of Step Ahead, a site-randomized controlled trial of a multilevel intervention that promotes physical activity and healthy eating in six hospitals in central Massachusetts. The purpose of the formative research phase was to increase the feasibility, effectiveness, and likelihood of sustainability of the intervention. The Step Ahead ecological intervention approach targets change at the organization, interpersonal work environment, and individual levels. The intervention was developed using fundamental steps of intervention mapping and important tenets of participatory research. Formative research methods were used to engage leadership support and assistance and to develop an intervention plan that is both theoretically and practically grounded. This report uses observational data, program minutes and reports, and process tracking data. Leadership involvement (key informant interviews and advisory boards), employee focus groups and advisory boards, and quantitative environmental assessments cultivated participation and support. Determining multiple foci of change and designing measurable objectives and generic assessment tools to document progress are complex challenges encountered in planning phases. Multilevel trials in diverse organizations require flexibility and balance of theory application and practice-based perspectives to affect impact and outcome objectives. Formative research is an essential component.

  6. Small angle neutron scattering study of U(VI) third phase formation in HNO3/DHDECMP–-dodecane system

    Indian Academy of Sciences (India)

    K V Lohithakshan; V K Aswal; S K Aggarwal

    2008-11-01

    Small angle neutron scattering studies (SANS) were carried out to understand the formation of third phase in DHDECMP–dodecane–UO2(NO3)2/HNO3 system. It was observed that third phase formation takes place due to the formation of UO2(NO3)2. DHDECMP reverse micelles in the dodecane phase. SANS data obtained were interpreted with particle interaction model using Baxter sticky spheres model.

  7. Competing order in the fermionic Hubbard model on the hexagonal graphene lattice

    CERN Document Server

    Buividovich, Pavel; Ulybyshev, Maksim; von Smekal, Lorenz

    2016-01-01

    We study the phase diagram of the fermionic Hubbard model on the hexagonal lattice in the space of on-site and nearest neighbor couplings with Hybrid-Monte-Carlo simulations. With pure on-site repulsion this allows to determine the critical coupling strength for spin-density wave formation with the standard approach of introducing a small mass term, explicitly breaking the sublattice symmetry. The analogous mass term for charge-density wave formation above a critical nearest-neighbor repulsion, on the other hand, would introduce a fermion sign problem. The competition between the two and the phase diagram in the space of the two coouplings can however be studied in simulations without explicit sublattice symmetry breaking. Our results compare qualitatively well with the Hartree-Fock phase diagram. We furthermore demonstrate how spin-symmetry breaking by the Euclidean time discretization can be avoided also, when using an improved fermion action based on an exponetial transfer matrix with exact sublattice symm...

  8. Formation of complex organic molecules in cold objects: the role of gas-phase reactions

    Science.gov (United States)

    Balucani, Nadia; Ceccarelli, Cecilia; Taquet, Vianney

    2015-04-01

    While astrochemical models are successful in reproducing many of the observed interstellar species, they have been struggling to explain the observed abundances of complex organic molecules. Current models tend to privilege grain surface over gas-phase chemistry in their formation. One key assumption of those models is that radicals trapped in the grain mantles gain mobility and react on lukewarm ( ≳ 30 K) dust grains. Thus, the recent detections of methyl formate (MF) and dimethyl ether (DME) in cold objects represent a challenge and may clarify the respective role of grain-surface and gas-phase chemistry. We propose here a new model to form DME and MF with gas-phase reactions in cold environments, where DME is the precursor of MF via an efficient reaction overlooked by previous models. Furthermore, methoxy, a precursor of DME, is also synthesized in the gas phase from methanol, which is desorbed by a non-thermal process from the ices. Our new model reproduces fairly well the observations towards L1544. It also explains, in a natural way, the observed correlation between DME and MF. We conclude that gas-phase reactions are major actors in the formation of MF, DME and methoxy in cold gas. This challenges the exclusive role of grain-surface chemistry and favours a combined grain-gas chemistry.

  9. Multifunctional acid formation from the gas-phase ozonolysis of beta-pinene.

    Science.gov (United States)

    Ma, Yan; Marston, George

    2008-10-28

    The gas-phase ozonolysis of beta-pinene was studied in static chamber experiments, using gas chromatography coupled to mass spectrometric and flame ionisation detection to separate and detect products. A range of multifunctional organic acids-including pinic acid, norpinic acid, pinalic-3-acid, pinalic-4-acid, norpinalic acid and OH-pinalic acid-were identified in the condensed phase after derivatisation. Formation yields for these products under systematically varying reaction conditions (by adding different OH radical scavengers and Criegee intermediate scavengers) were investigated and compared with those observed from alpha-pinene ozonolysis, allowing detailed information on product formation mechanisms to be elucidated. In addition, branching ratios for the initial steps of the reaction were inferred from quantitative measurements of primary carbonyl formation. Atmospheric implications of this work are discussed.

  10. Hexagonal packing of Drosophila wing epithelial cells by the planar cell polarity pathway.

    Science.gov (United States)

    Classen, Anne-Kathrin; Anderson, Kurt I; Marois, Eric; Eaton, Suzanne

    2005-12-01

    The mechanisms that order cellular packing geometry are critical for the functioning of many tissues, but they are poorly understood. Here, we investigate this problem in the developing wing of Drosophila. The surface of the wing is decorated by hexagonally packed hairs that are uniformly oriented by the planar cell polarity pathway. They are constructed by a hexagonal array of wing epithelial cells. Wing epithelial cells are irregularly arranged throughout most of development, but they become hexagonally packed shortly before hair formation. During the process, individual cell boundaries grow and shrink, resulting in local neighbor exchanges, and Cadherin is actively endocytosed and recycled through Rab11 endosomes. Hexagonal packing depends on the activity of the planar cell polarity proteins. We propose that these proteins polarize trafficking of Cadherin-containing exocyst vesicles during junction remodeling. This may be a common mechanism for the action of planar cell polarity proteins in diverse systems.

  11. Interface properties and phase formation between surface coated SKD61 and aluminum alloys

    Institute of Scientific and Technical Information of China (English)

    Se-Weon CHOI; Young-Chan KIM; Se-Hun CHANG; Ik-Hyun OH; Joon-Sik PARK; Chang-Seog KANG

    2009-01-01

    The intermediate phase formation and surface protection effects between SKD61 die mold alloys and aluminum alloys were investigated during a simulated die-casting process. The surface coatings of SKD61 alloy were carried out via Si pack cementation coatings at 900 ℃ for 10 h and the e-FeSi phase formed. When the coated SKD61 alloy was dipped in the liquid aluminum alloy (ALDC12), the surface coated SKD61 alloys showed better surface properties compared with uncoated SKD61 alloys, i.e., the intermediate phases (FeSiAl compound) were not produced for the coated SKD61 alloy. The coating layer of e-FeSi served as a diffusion barrier for the formation of FeSiAl compounds.

  12. New thresholds for Primordial Black Hole formation during the QCD phase transition

    CERN Document Server

    Sobrinho, J L G; Gonçalves, A L

    2016-01-01

    Primordial Black Holes (PBHs) might have formed in the early Universe as a consequence of the collapse of density fluctuations with an amplitude above a critical value $\\delta_{c}$: the formation threshold. Although for a radiation-dominated Universe $\\delta_{c}$ remains constant, if the Universe experiences some dust-like phases (e.g. phase transitions) $\\delta_{c}$ might decrease, improving the chances of PBH formation. We studied the evolution of $\\delta_{c}$ during the QCD phase transition epoch within three different models: Bag Model (BM), Lattice Fit Model (LFM), and Crossover Model (CM). We found that the reduction on the background value of $\\delta_{c}$ can be as high as $77\\%$ (BM), which might imply a $\\sim10^{-10}$ probability of PBHs forming at the QCD epoch.

  13. Controllable synthesis of hexagonal ZnO–carbon core–shell microrods and the removal of ZnO to form hexagonal carbon microtubes

    Energy Technology Data Exchange (ETDEWEB)

    Xiao, Yong, E-mail: xy91007@163.com [Department of Applied Chemistry, South China Agricultural University, Guangzhou 510642 (China); He, Wenqi; Gao, Chuang [Department of Chemistry and Institute of Nanochemistry, Jinan University, Guangzhou 510632 (China); Zheng, Mingtao; Lie, Bingfu; Liu, Xiaotang [Department of Applied Chemistry, South China Agricultural University, Guangzhou 510642 (China); Liu, Yingliang, E-mail: tliuyl@163.com [Department of Applied Chemistry, South China Agricultural University, Guangzhou 510642 (China)

    2013-06-15

    A simple and efficient approach was developed to produce regular and uniform shaped hexagonal ZnO–C core–shell micro-rods and carbon micro-tubes. A single-source raw material, zinc acetate dihydrate, has been used for the in situ generation of the hexagonal ZnO–C micro-rods in a sealed autoclave system at 500 °C for 12 h without a catalyst. The resulting products were characterized by X-ray powder diffraction, scanning and transmission electron microscopy, energy-dispersive X-ray analysis and room-temperature photoluminescence spectroscopy (PL). The partial or complete carbon coating on the ZnO surfaces plays an important role in modifying the PL properties. Impacting factors including thermolysis temperature, time and dose of the reactant on the evolution of the hexagonal shape were investigated. A possible formation diagram for the materials has been proposed and discussed based on the features of the reaction system. - Highlights: • Hexagonal ZnO–C core–shell microrods were synthesized by the lower temperature decomposition of zinc acetate. • The novel hexagonal carbon microtubes can gain by simply handling with dilute acid. • The partial or complete carbon coating on the ZnO surfaces plays an important role in modifying the PL properties. • A possible formation diagram for the materials has been proposed.

  14. Formation of liquid-crystalline structures in the bile salt-chitosan system and triggered release from lamellar phase bile salt-chitosan capsules.

    Science.gov (United States)

    Tangso, Kristian J; Lindberg, Seth; Hartley, Patrick G; Knott, Robert; Spicer, Patrick; Boyd, Ben J

    2014-08-13

    Nanostructured capsules comprised of the anionic bile salt, sodium taurodeoxycholate (STDC), and the biocompatible cationic polymer, chitosan, were prepared to assess their potential as novel tailored release nanomaterials. For comparison, a previously studied system, sodium dodecyl sulfate (SDS), and polydiallyldimethylammonium chloride (polyDADMAC) was also investigated. Crossed-polarizing light microscopy (CPLM) and small-angle X-ray scattering (SAXS) identified the presence of lamellar and hexagonal phase at the surfactant-polymer interface of the respective systems. The hydrophobic and electrostatic interactions between the oppositely charged components were studied by varying temperature and salt concentration, respectively, and were found to influence the liquid-crystalline nanostructure formed. The hexagonal phase persisted at high temperatures, however the lamellar phase structure was lost above ca. 45 °C. Both mesophases were found to dissociate upon addition of 4% NaCl solution. The rate of release of the model hydrophilic drug, Rhodamine B (RhB), from the lamellar phase significantly increased in response to changes in the solution conditions studied, suggesting that modulating the drug release from these bile salt-chitosan capsules is readily achieved. In contrast, release from the hexagonal phase capsules had no appreciable response to the stimuli applied. These findings provide a platform for these oppositely charged surfactant and polymer systems to function as stimuli-responsive or sustained-release drug delivery systems.

  15. Harmonic hexagonal superlattice pattern in a dielectric barrier discharge at atmospheric pressure

    Institute of Scientific and Technical Information of China (English)

    DONG LiFang; XIE WeiXia; ZHAO HaiTao; FAN WeiLi

    2009-01-01

    We report a harmonic hexagonal superlattice pattern in a dielectric barrier discharge in air/argon mixture at atmospheric pressure.The bifurcation scenario of harmonic hexagonal superlattice pattern with the applied voltage increasing is given.The phase diagram of the pattern types as a function of the applied voltage and the air-concentration is obtained.The hysteresis of pattern transitions at the upward and downward stage of the applied voltage is observed.The correlation measurements indicate that harmonic hexagonal superlattice pattern is an interleaving of two different transient sublattices.The spatial power spectrum demonstrates that harmonic hexagonal superlattice pattern has two separate wave vectors.Both small wave vector qh and big wave vector Kh,belong to the harmonic mode,and they obey a triad resonant interaction q1h + q2h,=Kh.

  16. The study of membrane formation via phase inversion method by cloud point and light scattering experiment

    Science.gov (United States)

    Arahman, Nasrul; Maimun, Teuku; Mukramah, Syawaliah

    2017-01-01

    The composition of polymer solution and the methods of membrane preparation determine the solidification process of membrane. The formation of membrane structure prepared via non-solvent induced phase separation (NIPS) method is mostly determined by phase separation process between polymer, solvent, and non-solvent. This paper discusses the phase separation process of polymer solution containing Polyethersulfone (PES), N-methylpirrolidone (NMP), and surfactant Tetronic 1307 (Tet). Cloud point experiment is conducted to determine the amount of non-solvent needed on induced phase separation. Amount of water required as a non-solvent decreases by the addition of surfactant Tet. Kinetics of phase separation for such system is studied by the light scattering measurement. With the addition of Tet., the delayed phase separation is observed and the structure growth rate decreases. Moreover, the morphology of fabricated membrane from those polymer systems is analyzed by scanning electron microscopy (SEM). The images of both systems show the formation of finger-like macrovoids through the cross-section.

  17. The Effect of Sex and Menstrual Phase on Memory Formation during Nap.

    Science.gov (United States)

    Mednick, Sara C; Sattari, Negin; McDevitt, Elizabeth A; Panas, Dagmara; Niknazar, Mohammad; Ahmadi, Maryam; Naji, Mohsen; Baker, Fiona

    2017-09-16

    Memory formation can be influenced by sleep and sex hormones in both men and women, and by the menstrual cycle in women. Though many studies have shown that sleep benefits the consolidation of memories, it is not clear whether this effect differs between men and women in general or according to menstrual phase in women. The present study investigated the effect of sex and menstrual cycle on memory consolidation of face-name associations (FNA) following a daytime nap. Recognition memory was tested using a face-name paired associates task with a polysomnographic nap between morning and evening testing. Seventeen healthy women (age: 20.75 (1.98) years) were studied at two time points of their menstrual cycles, defined from self-report and separated by 2 weeks (perimenses: -5 days to + 6 days from the start of menses, and non-perimenses: outside of the perimenses phase) and compared with eighteen healthy men (age: 22.01 (2.91) years). Regardless of menstrual phase, women had better pre-nap performance than men. Further, menstrual phase affected post-nap memory consolidation, with women showing greater forgetting in their perimenses phase compared with their non-perimenses phase, and men. Interestingly, post-nap performance correlated with electrophysiological events during sleep (slow oscillations, spindles, and temporal coupling between the two), however, these correlations differed according to menstrual phase and sex. Men's performance improvement was associated with the temporal coupling of spindles and slow oscillations (i.e., spindle/SO coincidence) as well as spindles. Women, however, showed an association with slow oscillations during non-perimenses, whereas when they were in their perimenses phase of their cycle, women appeared to show an association only with sleep spindle events for consolidation. These findings add to the growing literature demonstrating sex and menstrual phase effects on memory formation during sleep. Copyright © 2017. Published by

  18. Structural and magnetic phase formation in nanophase brass–iron electron compounds

    Indian Academy of Sciences (India)

    A K Mishra; C Bansal

    2005-11-01

    Starting with Cu0.65Zn0.35 with an e/a ratio of 1.35 we studied the phase formation in nanophase (Cu0.65Zn0.35)1−Fe alloys in the concentration range 0.1 ≤ ≤ 0.7 to see the effect of altering the electron concentration. The evolution of bcc phase from the fcc phase as a function of Fe concentration was investigated by Mössbauer spectroscopy and X-ray diffraction. The grain size, lattice parameters, and average hyperfine magnetic field distributions were estimated for the nanophase alloys. The fcc phase was observed to persist up to 40 atomic per cent Fe substitutions, a mixed (fcc + bcc) phase region up to 70 atomic per cent Fe and bcc phase beyond 70 atomic per cent Fe. The magnetic state of the alloys changed from nonmagnetic for ≤ 0.3 to magnetically ordered state at room temperature for ≥ 0.33, which lies in the fcc phase region. The fcc phase alloys of Fe with non-magnetic metals have very low magnetic transition temperatures. However, in this system the room temperature state is unusually magnetic.

  19. New hexagonal structure for silicon atoms

    Science.gov (United States)

    Naji, S.; Belhaj, A.; Labrim, H.; Benyoussef, A.; El Kenz, A.

    2012-11-01

    Motivated by recent experimental and theoretical works on silicene and its derived materials and based on the exceptional Lie algebra G2 we propose a new hexagonal symmetry producing the (√3 × √3)R30° superstructure for silicon atoms. The principal hexagonal unit cell contains twelve atoms instead of the usual structure involving only six ones and it is associated with the G2 root system. In this silicon atom configuration appears two hexagons of unequal side length at angle 30°. This atomic structure can be tessellated to exhibit two superstructures (1 × 1) and (√3 × √3)R30° on the same atomic sheet. To test this double hexagonal structure, we perform a numerical study using Ab-initio calculations based on FPLO9.00-34 code. We observe that the usual silicon electronic properties and the lattice parameters of planar geometry are modified. In particular, the corresponding material becomes a conductor rather than zero gaped semi-conductor arising in single hexagonal structure. Although the calculation is done for silicon atoms, we expect that this structure could be adapted to all two dimensional materials having a single hexagonal flat geometry.

  20. THE VISCOELASTIC EFFECT ON THE FORMATION OF MESO-GLOBULAR PHASE OF DILUTE HETEROPOLYMER SOLUTIONS

    Institute of Scientific and Technical Information of China (English)

    Chi Wu

    2003-01-01

    Linear homopolymer chains in poor solvent exist either as individual crumpled single chain globules or as macroscopic precipitate, depending on whether the solution is in the one- or the two-phase region. However, linear heteropolymer chains in dilute solution might be able to form stable mesoglobules made up of a limited number of chains if the degree of amphiphilicity of the chain is sufficiently high and the experimental conditions are appropriate. The selfassembly of block copolymers in a selective solvent is typical of such examples. In practice, the formation of stable mesoglobules can be directly related to the formation of novel polymeric nanoparticles in solution. In this article, we will address the formation of mesoglobular phase not only on the basis of thermodynamics, but also from a kinetic point of view,which leads to the discussion of how viscoelasticity can affect the phase behavior of heteropolymer chains in dilute solution.The formation and stabilization of several different kinds of novel polymeric nanoparticles will be used to illustrate our discussion.

  1. THE VISCOELASTIC EFFECT ON THE FORMATION OF MESO—GLOBULAR PHASE OF DILUTE HETEROPOLYMER SOLUTIONS

    Institute of Scientific and Technical Information of China (English)

    ChiWu

    2003-01-01

    Linear Homopolymer chains in poor solvent exist either as individual crumpled single chain globules or as macroscopic precipitate,depending on whether the solution is in the one- or the two-phase region.However,linear heteropolymer chains in dilute solution might be able to form stable mesoglobules made up of a limited number of chains if the degree of amphiphilicity of the chain is sufficiently high and the experimental conditions are appropriate.The selfassembly of block copolymers in a selective solvent is typical of such examples.In practice,the formation of stable mesoglobules can be directly related to the formation of novel polymeric nanoparticles in solution.In this article,we will address the formation of mesoglobular phase not only on the basis of thermodynamics,but also from a kinetic point of view,which leads to the discussion of how viscoelasticity can affect the phase behavior of heteropolymer chains in dilute solution.The formation and stabilization of several different kinds of novel polymeric nanoparticles will be used to illustrate our discussion.

  2. The Inflow Signature toward Different Evolutionary Phases of Massive Star Formation

    Science.gov (United States)

    Jin, Mihwa; Lee, Jeong-Eun; Kim, Kee-Tae; Evans, Neal J., II

    2016-08-01

    We analyze both HCN J = 1-0 and HNC J = 1-0 line profiles to study the inflow motions in different evolutionary stages of massive star formation: 54 infrared dark clouds (IRDCs), 69 high-mass protostellar objects (HMPOs), and 54 ultra-compact H ii regions (UCHIIs). Inflow asymmetry in the HCN spectra seems to be prevalent throughout all the three evolutionary phases, with IRDCs showing the largest excess in the blue profile. In the case of the HNC spectra, the prevalence of blue sources does not appear, apart from for IRDCs. We suggest that this line is not appropriate to trace the inflow motion in the evolved stages of massive star formation, because the abundance of HNC decreases at high temperatures. This result highlights the importance of considering chemistry in dynamics studies of massive star-forming regions. The fact that the IRDCs show the highest blue excess in both transitions indicates that the most active inflow occurs in the early phase of star formation, i.e., in the IRDC phase rather than in the later phases. However, mass is still inflowing onto some UCHIIs. We also find that the absorption dips of the HNC spectra in six out of seven blue sources are redshifted relative to their systemic velocities. These redshifted absorption dips may indicate global collapse candidates, although mapping observations with better resolution are needed to examine this feature in more detail.

  3. Unexpected δ-Phase Formation in Additive-Manufactured Ni-Based Superalloy

    Science.gov (United States)

    Idell, Y.; Levine, L. E.; Allen, A. J.; Zhang, F.; Campbell, C. E.; Olson, G. B.; Gong, J.; Snyder, D. R.; Deutchman, H. Z.

    2016-03-01

    An as-built and solutionized Ni-based superalloy built by additive manufacturing through a direct metal laser sintering technique is characterized to understand the microstructural differences as compared to the as-wrought alloy. Initially, each layer undergoes rapid solidification as it is melted by the laser; however, as the part is built, the underlying layers experience a variety of heating and cooling cycles that produce significant microsegregation of niobium which allows for the formation of the deleterious δ-phase. The as-built microstructure was characterized through Vickers hardness, optical microscopy, scanning and transmission electron microscopy, electron back-scattering diffraction, x-ray diffraction, and synchrotron x-ray microLaue diffraction. The isothermal formation and growth of the δ-phase were characterized using synchrotron-based in situ small angle and wide angle x-ray scattering experiments. These experimental results are compared with multicomponent diffusion simulations that predict the phase fraction and composition. The high residual stresses and unexpected formation of the δ-phase will require further annealing treatments to be designed so as to remove these deficiencies and obtain an optimized microstructure.

  4. Ion beam induced single phase nanocrystalline TiO{sub 2} formation

    Energy Technology Data Exchange (ETDEWEB)

    Rukade, Deepti A. [Department of Physics, University of Mumbai, Mumbai 400098 (India); Tribedi, L.C. [Tata Institute of Fundamental Research, Homi Bhabha Road, Colaba, Mumbai 400005 (India); Bhattacharyya, Varsha, E-mail: varsha.b1.physics@gmail.com [Department of Physics, University of Mumbai, Mumbai 400098 (India)

    2014-06-15

    Single phase TiO{sub 2} nanostructures are fabricated by oxygen ion implantation (60 keV) at fluence ranging from 1×10{sup 16} ions/cm{sup 2} to 1×10{sup 17} ions/cm{sup 2} in titanium thin films deposited on fused silica substrate and subsequent thermal annealing in argon atmosphere. GAXRD and Raman spectroscopy study reveals formation of single rutile phases of TiO{sub 2}. Particle size is found to vary from 29 nm to 35 nm, establishing nanostructure formation. Nanostructure formation is also confirmed by the quantum confinement effect manifested by the blueshift of the UV–vis absorption spectra. Photoluminescence spectra show peaks corresponding to TiO{sub 2} rutile phase and reveal the presence of oxygen defects due to implantation. The controlled synthesis of single phase nanostructure is attributed to ion induced defects and post-implantation annealing. It is observed that the size of the nanostructures formed is strongly dependent on the ion fluence.

  5. The inflow signature toward different evolutionary phases of massive star formation

    CERN Document Server

    Jin, Mihwa; Kim, Kee-Tae; Evans, Neal J

    2016-01-01

    We analyzed both HCN J=1-0 and HNC J=1-0 line profiles to study the inflow motions in different evolutionary stages of massive star formation: 54 infrared dark clouds (IRDCs), 69 high-mass protostellar object (HMPOs), and 54 ultra-compact HII regions (UCHIIs). The inflow asymmetry in HCN spectra seems to be prevalent throughout all the three evolutionary phases, with IRDCs showing the largest excess in blue profile. In the case of HNC spectra, the prevalence of blue sources does not appear, excepting for IRDCs. We suggest that this line is not appropriate to trace inflow motion in evolved stages of massive star formation because the abundance of HNC decreases at high temperatures. This result spotlights the importance of considering chemistry in the dynamics study of massive star-forming regions. The fact that the IRDCs show the highest blue excess in both transitions indicates that the most active inflow occurs in the early phase of star formation, i.e., the IRDC phase rather than in the later phases. Howeve...

  6. Investigation on the formation of lonsdaleite from graphite

    Energy Technology Data Exchange (ETDEWEB)

    Greshnyakov, V. A.; Belenkov, E. A., E-mail: belenkov@csu.ru [Chelyabinsk State University (Russian Federation)

    2017-02-15

    Structural stability and the possible pathways to experimental formation of lonsdaleite—a hexagonal 2H polytype of diamond—have been studied in the framework of the density functional theory (DFT). It is established that the structural transformation of orthorhombic Cmmm graphite to 2H polytype of diamond must take place at a pressure of 61 GPa, while the formation of lonsdaleite from hexagonal P6/mmm graphite must take place at 56 GPa. The minimum potential barrier height separating the 2H polytype state from graphite is only 0.003 eV/atom smaller than that for the cubic diamond. The high potential barrier is indicative of the possibility of stable existence of the hexagonal diamond under normal conditions. In this work, we have also analyzed the X-ray diffraction and electron-microscopic data available for nanodiamonds found in meteorite impact craters in search for the presence of hexagonal diamond. Results of this analysis showed that pure 3C and 2H polytypes are not contained in the carbon materials of impact origin, the structure of nanocrystals found representing diamonds with randomly packed layers. The term “lonsdaleite,” used to denote carbon materials found in meteorite impact craters and diamond crystals with 2H polytype structure, is rather ambiguous, since no pure hexagonal diamond has been identified in carbon phases found at meteorite fall sites.

  7. Formation and structural phase transition in Co atomic chains on a Cu(775) surface

    Energy Technology Data Exchange (ETDEWEB)

    Syromyatnikov, A. G.; Kabanov, N. S.; Saletsky, A. M.; Klavsyuk, A. L., E-mail: klavsyuk@physics.msu.ru [Moscow State University (Russian Federation)

    2017-01-15

    The formation of Co atomic chains on a Cu(775) surface is investigated by the kinetic Monte Carlo method. It is found that the length of Co atomic chains formed as a result of self-organization during epitaxial growth is a random quantity and its mean value depends on the parameters of the experiment. The existence of two structural phases in atomic chains is detected using the density functional theory. In the first phase, the separations between an atom and its two nearest neighbors in a chain are 0.230 and 0.280 nm. In the second phase, an atomic chain has identical atomic spacings of 0.255 nm. It is shown that the temperature of the structural phase transition depends on the length of the atomic chain.

  8. Hydride phase formation in LaMg{sub 2}Ni during H{sub 2} absorption

    Energy Technology Data Exchange (ETDEWEB)

    Di Chio, M.; Baricco, M. [Dipartimento di Chimica IFM and NIS/CNISM/INSTM, Universita di Torino, Via P.Giuria, 9 10125 Torino (Italy); Schiffini, L.; Enzo, S.; Cocco, G. [Dipartimento di Chimica and INSTM, Universita di Sassari, Via Vienna, 2 07100 Sassari (Italy)

    2008-02-15

    Hydrogen absorption and desorption properties in nanocrystalline LaMg{sub 2}Ni are presented. Nanostructured phases have been obtained by milling grain coarse ingot and by mechanically alloying the parent elements. The structural and hydriding properties were examined by X-ray diffraction, thermal analysis and thermal desorption measurements. Ball milling and mechanical alloying give a significant refinement of the microstructure. Reactive milling has been used for hydrogen absorption experiments. Hydrogenation by means of reactive milling at 300 K under a pressure of 0.4 MPa leads to the formation of a stable La-hydride phase together with an amorphous phase. Thermal desorption up to 983 K of hydrogenated samples leads again to parent LaMg{sub 2}Ni phase. (author)

  9. Single-phase and two-phase flow properties of mesaverde tight sandstone formation; random-network modeling approach

    Science.gov (United States)

    Bashtani, Farzad; Maini, Brij; Kantzas, Apostolos

    2016-08-01

    3D random networks are constructed in order to represent the tight Mesaverde formation which is located in north Wyoming, USA. The porous-space is represented by pore bodies of different shapes and sizes which are connected to each other by pore throats of varying length and diameter. Pore bodies are randomly distributed in space and their connectivity varies based on the connectivity number distribution which is used in order to generate the network. Network representations are then validated using publicly available mercury porosimetry experiments. The network modeling software solves the fundamental equations of two-phase immiscible flow incorporating wettability and contact angle variability. Quasi-static displacement is assumed. Single phase macroscopic properties (porosity, permeability) are calculated and whenever possible are compared to experimental data. Using this information drainage and imbibition capillary pressure, and relative permeability curves are predicted and (whenever possible) compared to experimental data. The calculated information is grouped and compared to available literature information on typical behavior of tight formations. Capillary pressure curve for primary drainage process is predicted and compared to experimental mercury porosimetry in order to validate the virtual porous media by history matching. Relative permeability curves are also calculated and presented.

  10. Importance of Aqueous-phase Secondary Organic Aerosol Formation from Aromatics in an Atmospheric Hydrocarbon Mixture

    Science.gov (United States)

    Parikh, H. M.; Carlton, A. G.; Vizuete, W.; Zhang, H.; Zhou, Y.; Chen, E.; Kamens, R. M.

    2010-12-01

    Two new secondary organic aerosol (SOA) modeling frameworks are developed, one based on an aromatic gas and particle-phase kinetic mechanism and another based on a parameterized SOA model used in conjunction with an underlying gas-phase mechanism, both of which simulate SOA formation through partitioning to two stable liquid phases: one hydrophilic containing particle aqueous-phase and the other hydrophobic comprising mainly organic components. The models were evaluated against outdoor smog chamber experiments with different combinations of initial toluene, o-xylene, p-xylene, toluene and xylene mixtures, NOx, non-SOA-forming hydrocarbon mixture, initial seed type, and humidity. Aerosol data for experiments with either ammonium sulfate or initial background seed particles, in the presence of an atmospheric hydrocarbon mixture, NOx and in sunlight under a dry atmosphere (RH = 6 to 10%) show reduced SOA formation when compared to experiments with similar initial gas and particle concentrations at higher relative humidities (RH = 40 to 90%). Both frameworks simulated reasonable fits to the total observed SOA concentrations under all conditions. For both dry and wet experiments with low initial seed, semi-volatile product partitioning in particle organic-phase is mass-transfer limited and is modeled using a dynamic gas-particle partitioning algorithm with accommodation coefficient as the primary pseudo-transport parameter. Further, the modeled SOA product distributions for both frameworks clearly show the importance of the contribution of aqueous-phase SOA particularly under conditions of low initial seed concentrations and high-humidity. For both models, under these conditions, aqueous-phase SOA from uptake of glyoxal, methylglyoxal and related polar products to particle water phase dominates as compared to the partitioning of semi-volatiles to particle organic phase. Interestingly, both the kinetic and parameterized SOA frameworks simulate similar amounts of aqueous-phase

  11. Finding confined water in the hexagonal phase of Bi0.05Eu0.05Y0.90P$O$_{4}·H2O and its impact for identifying the location of luminescence quencher

    Indian Academy of Sciences (India)

    R S Ninghthoujam

    2013-06-01

    1H MAS NMR spectra of Bi0.05Eu0.05Y0.90PO4·H2O show chemical shift from −0.56 ppm at 300 K to −3.8 ppm at 215 K and another one at 5–6 ppm, which are related to the confined or interstitial water in the hexagonal structure and water molecules on the surface of the particles, respectively. Negative value of the chemical shift indicates that H of H2O is closer to metal ions (Y3+ or Eu3+), which is a source of luminescence quencher. H coupling and decoupling 31P MAS NMR spectra at 300 and 250 K show the same chemical shift (−0.4 ppm) indicating that there is no direct bond between P and H. It is concluded that the confined water is not frozen even at 215 K because of the less number of H-bonding.

  12. Phenomenological thermodynamics and the structure formation mechanism of the CuTi₂S₄ rhombohedral phase.

    Science.gov (United States)

    Talanov, Michail V; Shirokov, Vladimir B; Talanov, Valery M

    2016-04-21

    The theory of structural phase transition in CuTi2S4 is proposed. The symmetry of order parameters, thermodynamics and the mechanism of the atomic structure formation of the rhombohedral Cu-Ti-thiospinel have been studied. The critical order parameter inducing the phase transition has been found. Within the Landau theory of phase transitions, it is shown that the phase state may change from the high-symmetry cubic disordered Fd3[combining macron]m phase to the low-symmetry ordered rhombohedral R3[combining macron]m phase as a result of phase transition of the first order close to the second order. It is shown that the rhombohedral structure of CuTi2S4 is formed as a result of the displacements of all types of atoms and the ordering of Cu-atoms (1 : 1 order type in tetrahedral spinel sites), Ti-atoms (1 : 1 : 6 order type in octahedral spinel sites), and S-atoms (1 : 1 : 3 : 3 order type). The Cu- and Ti-atoms form metal nanoclusters which are named a "bunch" of dimers. The "bunch" of dimers in CuTi2S4 is a new type of self-organization of atoms in frustrated spinel-like structures. It is shown that Ti-atoms also form other types of metal nanoclusters: trimers and tetrahedra.

  13. Formation of uniform magnetic structures and epitaxial hydride phases in Nd/Pr superlattices

    DEFF Research Database (Denmark)

    Goff, J.P.; Bryn-Jacobsen, C.; McMorrow, D.F.;

    1997-01-01

    , and that the stacking sequence is coherent over many bilayer repeats. The neutron measurements show that for the hexagonal sites of the dhcp structure, the Nd magnetic order propagates coherently through the Pr, whereas the order on the cubic sites is either suppressed or confined to single Nd blocks. It is also shown...... that the singlet ground state of Pr is perturbed to produce a local moment on the hexagonal sites, so that in some cases there is a uniform magnetic structure throughout the superlattice. These results cast new light on the theory of magnetic interactions in rare-earth superlattices. Within a few months of growth...

  14. Formation of Nanoscale Intermetallic Phases in Ni Surface Layer at High Intensity Implantation of Al Ions

    Institute of Scientific and Technical Information of China (English)

    I.A.Bozhko; S.V.Fortuna; I.A.Kurzina; I.B.Stepanov; E.V.Kozlov; Yu.P. Sharkeev

    2004-01-01

    The results of experimental study of nanoscale intermetallic formation in surface layer of a metal target at ion implantation are presented. To increase the thickness of the ion implanted surface layer the high intensive ion implantation is used. Compared with the ordinary ion implantation, the high intensive ion implantation allows a much thicker modified surface layer. Pure polycrystalline nickel was chosen as a target. Nickel samples were irradiated with Al ions on the vacuum-arc ion beam and plasma flow source "Raduga-5". It was shown that at the high intensity ion implantation the fine dispersed particles of Ni3Al, NiAl intermetallic compounds and solid solution Al in Ni are formed in the nickel surface layer of 200 nm and thicker. The formation of phases takes place in complete correspondence with the Ni-Al phase diagram.

  15. Complex 3D Vortex Lattice Formation by Phase-Engineered Multiple Beam Interference

    Directory of Open Access Journals (Sweden)

    Jolly Xavier

    2012-01-01

    Full Text Available We present the computational results on the formation of diverse complex 3D vortex lattices by a designed superposition of multiple plane waves. Special combinations of multiples of three noncoplanar plane waves with a designed relative phase shift between one another are perturbed by a nonsingular beam to generate various complex 3D vortex lattice structures. The formation of complex gyrating lattice structures carrying designed vortices by means of relatively phase-engineered plane waves is also computationally investigated. The generated structures are configured with both periodic as well as transversely quasicrystallographic basis, while these whirling complex lattices possess a long-range order of designed symmetry in a given plane. Various computational analytical tools are used to verify the presence of engineered geometry of vortices in these complex 3D vortex lattices.

  16. Atomic scale analysis of phase formation and diffusion kinetics in Ag/Al multilayer thin films

    Science.gov (United States)

    Aboulfadl, Hisham; Gallino, Isabella; Busch, Ralf; Mücklich, Frank

    2016-11-01

    Thin films generally exhibit unusual kinetics leading to chemical reactions far from equilibrium conditions. Binary metallic multilayer thin films with miscible elements show some similar behaviors with respect to interdiffusion and phase formation mechanisms. Interfacial density, lattice defects, internal stresses, layer morphologies and deposition conditions strongly control the mass transport between the individual layers. In the present work, Ag/Al multilayer thin films are used as a simple model system, in which the effects of the sputtering power and the bilayer period thickness on the interdiffusion and film reactions are investigated. Multilayers deposited by DC magnetron sputtering undergo calorimetric and microstructural analyses. In particular, atom probe tomography is extensively used to provide quantitative information on concentration gradients, grain boundary segregations, and reaction mechanisms. The magnitude of interdiffusion was found to be inversely proportional to the period thickness for the films deposited under the same conditions, and was reduced using low sputtering power. Both the local segregation at grain boundaries as well as pronounced non-equilibrium supersaturation effects play crucial roles during the early stages of the film reactions. For multilayers with small periods of 10 nm supersaturation of the Al layers with Ag precedes the polymorphic nucleation and growth of the hcp γ-Ag2Al phase. In larger periods the γ phase formation is triggered at junctions between grain boundaries and layers interfaces, where the pathway to heterogeneous nucleation is local supersaturation. Other Ag-rich phases also form as intermediate phases due to asymmetric diffusion rates of parent phases in the γ phase during annealing.

  17. Comparison between triangular and hexagonal modeling of a hexagonal-structured reactor core using box method

    Energy Technology Data Exchange (ETDEWEB)

    Malmir, Hessam, E-mail: malmir@energy.sharif.edu [Department of Energy Engineering, Sharif University of Technology, Azadi Street, Tehran (Iran, Islamic Republic of); Moghaddam, Nader Maleki [Department of Nuclear Engineering and Physics, Amir Kabir University of Technology (Tehran Polytechnique), Hafez Street, Tehran (Iran, Islamic Republic of); Zahedinejad, Ehsan [Department of Energy Engineering, Sharif University of Technology, Azadi Street, Tehran (Iran, Islamic Republic of)

    2011-02-15

    A hexagonal-structured reactor core (e.g. VVER-type) is mostly modeled by structured triangular and hexagonal mesh zones. Although both the triangular and hexagonal models give good approximations over the neutronic calculation of the core, there are some differences between them that seem necessary to be clarified. For this purpose, the neutronic calculations of a hexagonal-structured reactor core have to be performed using the structured triangular and hexagonal meshes based on box method of discretisation and then the results of two models should be benchmarked in different cases. In this paper, the box method of discretisation is derived for triangular and hexagonal meshes. Then, two 2-D 2-group static simulators for triangular and hexagonal geometries (called TRIDIF-2 and HEXDIF-2, respectively) are developed using the box method. The results are benchmarked against the well-known CITATION computer code in case of a VVER-1000 reactor core. Furthermore, the relative powers calculated by the TRIDIF-2 and HEXDIF-2 along with the ones obtained by the CITATION code are compared with the verified results which have been presented in the Final Safety Analysis Report (FSAR) of the aforementioned reactor. Different benchmark cases revealed the reliability of the box method in contrast with the CITATION code. Furthermore, it is shown that the triangular modeling of the core is more acceptable compared with the hexagonal one.

  18. SURVIVAL OF INTERSTELLAR MOLECULES TO PRESTELLAR DENSE CORE COLLAPSE AND EARLY PHASES OF DISK FORMATION

    Energy Technology Data Exchange (ETDEWEB)

    Hincelin, U. [Department of Chemistry, University of Virginia, Charlottesville, VA 22904 (United States); Wakelam, V.; Hersant, F.; Guilloteau, S. [University of Bordeaux, LAB, UMR 5804, F-33270 Floirac (France); Commerçon, B., E-mail: ugo.hincelin@virginia.edu [Laboratoire de radioastronomie, LERMA, Observatoire de Paris, Ecole Normale Supérieure (UMR 8112 CNRS), 24 rue Lhomond, F-75231 Paris Cedex 05 (France)

    2013-09-20

    An outstanding question of astrobiology is the link between the chemical composition of planets, comets, and other solar system bodies and the molecules formed in the interstellar medium. Understanding the chemical and physical evolution of the matter leading to the formation of protoplanetary disks is an important step for this. We provide some new clues to this long-standing problem using three-dimensional chemical simulations of the early phases of disk formation: we interfaced the full gas-grain chemical model Nautilus with the radiation-magnetohydrodynamic model RAMSES, for different configurations and intensities of the magnetic field. Our results show that the chemical content (gas and ices) is globally conserved during the collapsing process, from the parent molecular cloud to the young disk surrounding the first Larson core. A qualitative comparison with cometary composition suggests that comets are constituted of different phases, some molecules being direct tracers of interstellar chemistry, while others, including complex molecules, seem to have been formed in disks, where higher densities and temperatures allow for an active grain surface chemistry. The latter phase, and its connection with the formation of the first Larson core, remains to be modeled.

  19. Formation of asymmetrical structured silica controlled by a phase separation process and implication for biosilicification.

    Directory of Open Access Journals (Sweden)

    Jia-Yuan Shi

    Full Text Available Biogenetic silica displays intricate patterns assembling from nano- to microsize level and interesting non-spherical structures differentiating in specific directions. Several model systems have been proposed to explain the formation of biosilica nanostructures. Of them, phase separation based on the physicochemical properties of organic amines was considered to be responsible for the pattern formation of biosilica. In this paper, using tetraethyl orthosilicate (TEOS, Si(OCH2CH34 as silica precursor, phospholipid (PL and dodecylamine (DA were introduced to initiate phase separation of organic components and influence silica precipitation. Morphology, structure and composition of the mineralized products were characterized using a range of techniques including field emission scanning electron microscopy (FESEM, transmission electron microscope (TEM, X-ray diffraction (XRD, thermogravimetric and differential thermal analysis (TG-DTA, infrared spectra (IR, and nitrogen physisorption. The results demonstrate that the phase separation process of the organic components leads to the formation of asymmetrically non-spherical silica structures, and the aspect ratios of the asymmetrical structures can be well controlled by varying the concentration of PL and DA. On the basis of the time-dependent experiments, a tentative mechanism is also proposed to illustrate the asymmetrical morphogenesis. Therefore, our results imply that in addition to explaining the hierarchical porous nanopatterning of biosilica, the phase separation process may also be responsible for the growth differentiation of siliceous structures in specific directions. Because organic amine (e.g., long-chair polyamines, phospholipids (e.g., silicalemma and the phase separation process are associated with the biosilicification of diatoms, our results may provide a new insight into the mechanism of biosilicification.

  20. Effect of Al doping on phase formation and thermal stability of iron nitride thin films

    Energy Technology Data Exchange (ETDEWEB)

    Tayal, Akhil [Amity Center for Spintronic Materials, Amity University, Sector 125, Noida 201 303 (India); Gupta, Mukul, E-mail: mgupta@csr.res.in [Amity Center for Spintronic Materials, Amity University, Sector 125, Noida 201 303 (India); Pandey, Nidhi [Amity Center for Spintronic Materials, Amity University, Sector 125, Noida 201 303 (India); Gupta, Ajay [UGC-DAE Consortium for Scientific Research, University Campus, Khandwa Road, Indore 452 001 (India); Horisberger, Michael [Laboratory for Developments and Methods, Paul Scherrer Institut, CH-5232 Villigen PSI (Switzerland); Stahn, Jochen [Laboratory for Neutron Scattering and Imaging, Paul Scherrer Institut, CH-5232 Villigen PSI (Switzerland)

    2015-11-25

    In the present work, we systematically studied the effect of Al doping on the phase formation of iron nitride (Fe–N) thin films. Fe–N thin films with different concentration of Al (Al = 0, 2, 3, 6, and 12 at.%) were deposited using dc magnetron sputtering by varying the nitrogen partial pressure between 0 and 100%. The structural and magnetic properties of the films were studied using x-ray diffraction and polarized neutron reflectivity. It was observed that at the lowest doping level (2 at.% of Al), nitrogen rich non-magnetic Fe–N phase gets formed at a lower nitrogen partial pressure as compared to the un-doped sample. Interestingly, we observed that as Al doping is increased beyond 3 at.%, nitrogen rich non-magnetic Fe–N phase appears at higher nitrogen partial pressure as compared to un-doped sample. The thermal stability of films were also investigated. Un-doped Fe–N films deposited at 10% nitrogen partial pressure possess poor thermal stability. Doping of Al at 2 at.% improves it marginally, whereas, for 3, 6 and 12 at.% Al doping, it shows significant improvement. The obtained results have been explained in terms of thermodynamics of Fe–N and Al–N. - Highlights: • Doping effects of Al on Fe–N phase formation is studied. • Phase formation shows a non-monotonic behavior with Al doping. • Low doping levels of Al enhance and high levels retard the nitridation process. • Al doping beyond 3 at.% improve thermal stability of Fe–N films.

  1. Complex Organic Molecules Formation in Space Through Gas Phase Reactions: A Theoretical Approach

    Science.gov (United States)

    Redondo, Pilar; Barrientos, Carmen; Largo, Antonio

    2017-02-01

    Chemistry in the interstellar medium (ISM) is capable of producing complex organic molecules (COMs) of great importance to astrobiology. Gas phase and grain surface chemistry almost certainly both contribute to COM formation. Amino acids as building blocks of proteins are some of the most interesting COMs. The simplest one, glycine, has been characterized in meteorites and comets and, its conclusive detection in the ISM seems to be highly plausible. In this work, we analyze the gas phase reaction of glycine and {{{CH}}5}+ to establish the role of this process in the formation of alanine or other COMs in the ISM. Formation of protonated α- and β-alanine in spite of being exothermic processes is not viable under interstellar conditions because the different paths leading to these isomers present net activation energies. Nevertheless, glycine can evolve to protonated 1-imide-2, 2-propanediol, protonated amino acetone, protonated hydroxyacetone, and protonated propionic acid. However, formation of acetic acid and protonated methylamine is also a favorable process and therefore will be a competitive channel with the evolution of glycine to COMs.

  2. Epitaxial diamond-hexagonal silicon nano-ribbon growth on (001) silicon

    Science.gov (United States)

    Qiu, Y.; Bender, H.; Richard, O.; Kim, M.-S.; van Besien, E.; Vos, I.; de Potter de Ten Broeck, M.; Mocuta, D.; Vandervorst, W.

    2015-08-01

    Silicon crystallizes in the diamond-cubic phase and shows only a weak emission at 1.1 eV. Diamond-hexagonal silicon however has an indirect bandgap at 1.5 eV and has therefore potential for application in opto-electronic devices. Here we discuss a method based on advanced silicon device processing to form diamond-hexagonal silicon nano-ribbons. With an appropriate temperature anneal applied to densify the oxide fillings between silicon fins, the lateral outward stress exerted on fins sandwiched between wide and narrow oxide windows can result in a phase transition from diamond-cubic to diamond-hexagonal Si at the base of these fins. The diamond-hexagonal slabs are generally 5-8 nm thick and can extend over the full width and length of the fins, i.e. have a nano-ribbon shape along the fins. Although hexagonal silicon is a metastable phase, once formed it is found being stable during subsequent high temperature treatments even during process steps up to 1050 ºC.

  3. Phase formation and mechanical properties of Cu-Zr-Ti bulk metallic glass composites

    Science.gov (United States)

    Kim, Byoung Jin; Yun, Young Su; Kim, Won Tae; Kim, Do Hyang

    2016-11-01

    The effect of the type of the crystalline phase and its volume fraction on the mechanical property of Cu50Zr50-xTix alloys (x = 0-10) bulk metallic glass composites has been investigated in this study. Up to 6 at% of Ti, B19' phase particles distributed in the glassy matrix, while at 8 and 10% of Ti, B2 phase particles are retained in the glass matrix due to suppression of the eutectoid transformation of B2 phase and by avoidance of martensitic transformation of B2 into B19'. The volume fraction of crystalline phase is strongly dependent on the cooling rate. The larger volume fraction of the crystalline phases results in the lower yield stress, the higher plastic strain, and the more pronounced work hardening behavior. At the crystalline volume fraction below 30%, the variation of the yield strength can be described by the rule of mixture model (ROM), while at the crystalline volume fraction higher than 50% by the load-bearing model (LBM). At the crystal fractions between 30 and 50%, there is a yield strength drop and a transition from the ROM to the LBM. This transition is due to the formation of the crystalline structural framework at higher crystal fraction.

  4. Phase formation in selected surface-roughened plasma-nitrided 304 austenite stainless steel

    Directory of Open Access Journals (Sweden)

    Gajendra Prasad Singh et al

    2008-01-01

    Full Text Available Direct current (DC glow discharge plasma nitriding was carried out on three selected surface-roughened AISI 304 stainless steel samples at 833 K under 4 mbar pressures for 24 h in the presence of N2:H2 gas mixtures of 50 : 50 ratios. After plasma nitriding, the phase formation, case depth, surface roughness, and microhardness of a plasma-nitrided layer were evaluated by glancing angle x-ray diffractogram, optical microscope, stylus profilometer, and Vickers microhardness tester techniques. The case depth, surface hardness, and phase formation variations were observed with a variation in initial surface roughness. The diffraction patterns of the plasma-nitrided samples showed the modified intensities of the α and γ phases along with those of the CrN, Fe4N, and Fe3N phases. Hardness and case depth variations were observed with a variation in surface roughness. A maximum hardness of 1058 Hv and a case depth of 95 μm were achieved in least surface-roughened samples.

  5. Formation of complex organic molecules in cold objects: the role of gas phase reactions

    CERN Document Server

    Balucani, Nadia; Taquet, Vianney

    2015-01-01

    While astrochemical models are successful in reproducing many of the observed interstellar species, they have been struggling to explain the observed abundances of complex organic molecules. Current models tend to privilege grain surface over gas phase chemistry in their formation. One key assumption of those models is that radicals trapped in the grain mantles gain mobility and react on lukewarm (>30 K) dust grains. Thus, the recent detections of methyl formate (MF) and dimethyl ether (DME) in cold objects represent a challenge and may clarify the respective role of grain surface and gas phase chemistry. We propose here a new model to form DME and MF with gas phase reactions in cold environments, where DME is the precursor of MF via an efficient reaction overlooked by previous models. Furthermore, methoxy, a precursor of DME, is also synthetized in the gas phase from methanol, which is desorbed by a non-thermal process from the ices. Our new model reproduces fairy well the observations towards L1544. It also...

  6. Phase formation in selected surface-roughened plasma-nitrided 304 austenite stainless steel.

    Science.gov (United States)

    Singh, Gajendra Prasad; Joseph, Alphonsa; Raole, Prakash Manohar; Barhai, Prema Kanta; Mukherjee, Subroto

    2008-04-01

    Direct current (DC) glow discharge plasma nitriding was carried out on three selected surface-roughened AISI 304 stainless steel samples at 833 K under 4 mbar pressures for 24 h in the presence of N2:H2 gas mixtures of 50 : 50 ratios. After plasma nitriding, the phase formation, case depth, surface roughness, and microhardness of a plasma-nitrided layer were evaluated by glancing angle x-ray diffractogram, optical microscope, stylus profilometer, and Vickers microhardness tester techniques. The case depth, surface hardness, and phase formation variations were observed with a variation in initial surface roughness. The diffraction patterns of the plasma-nitrided samples showed the modified intensities of the α and γ phases along with those of the CrN, Fe4N, and Fe3N phases. Hardness and case depth variations were observed with a variation in surface roughness. A maximum hardness of 1058 Hv and a case depth of 95 μm were achieved in least surface-roughened samples.

  7. Modulation Format Independent Joint Polarization and Phase Tracking for Coherent Receivers

    CERN Document Server

    Czegledi, Cristian B; Karlsson, Magnus; Johannisson, Pontus

    2016-01-01

    The state of polarization and the carrier phase drift dynamically during transmission in a random fashion in coherent optical fiber communications. The typical digital signal processing solution to mitigate these impairments consists of two separate blocks that track each phenomenon independently. Such algorithms have been developed without taking into account mathematical models describing the impairments. We study a blind, model-based tracking algorithm to compensate for these impairments. The algorithm dynamically recovers the carrier phase and state of polarization jointly for an arbitrary modulation format. Simulation results show the effectiveness of the proposed algorithm, having a fast convergence rate and an excellent tolerance to phase noise and dynamic drift of the polarization. The computational complexity of the algorithm is lower compared to state-of-the-art algorithms at similar or better performance, which makes it a strong candidate for future optical systems.

  8. The Molecular Structure of the Liquid Ordered Phase of Lipid Bilayers

    Science.gov (United States)

    Sodt, Alexander J.; Sandar, Michael Logan; Gawrisch, Klaus; Pastor, Richard W.; Lyman, Edward

    2014-01-01

    Molecular dynamics simulations reveal substructures within the liquid-ordered phase of lipid bilayers. These substructures, identified in a 10 μsec all-atom trajectory of liquid-ordered/liquid-disordered coexistence (Lo/Ld), are composed of saturated hydrocarbon chains packed with local hexagonal order, and separated by interstitial regions enriched in cholesterol and unsaturated chains. Lipid hydrocarbon chain order parameters calculated from the Lo phase are in excellent agreement with 2H NMR measurements; the local hexagonal packing is also consistent with 1H-MAS NMR spectra of the Lo phase, NMR diffusion experiments, and small angle X-ray- and neutron scattering. The balance of cholesterol-rich to local hexagonal order is proposed to control the partitioning of membrane components into the Lo regions. The latter have been frequently associated with formation of so-called rafts, platforms in the plasma membranes of cells that facilitate interaction between components of signaling pathways. PMID:24345334

  9. Role of Disclinations and Nanocrystalline State in the Formation of Quasicrystalline Phases on Mechanical Alloying of Cu-Fe Powders

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    @@Elemental powders of Cu and Fe were ball milled for various time durations up to 100 h. The various stages of forced alloying by ball milling, leading to instability of elemental crystalline phases and formation of quasicrystalline phases were monitored using X-ray diffraction. Diffusion of Fe into the Cu matrix is proposed as the cause which triggers the instability of crystalline phases and leads to the formation of quasicrystalline phases after 10 h of milling. Milling for 100 h resulted in two different quasicrystalline phases with different lattice constants. Role of the nanocrystalline microstructure as an important criterion for the destabilisation of crystalline phases is explained. It is suggested that the formation of nanocrystalline microstructure and their subsequent transformation into quasicrystalline phases may be associated with a continuous increase in the disclination content of the system, which had formed as a result of continued milling and mechanical deformation.

  10. FORMATION REGULARITIES OF PHASE COMPOSITION, STRUCTURE AND PROPERTIES DURING MECHANICAL ALLOYING OF BINARY ALUMINUM COMPOSITES

    Directory of Open Access Journals (Sweden)

    F. G. Lovshenko

    2015-01-01

    Full Text Available The paper presents investigation results pertaining to  ascertainment of formation regularities of phase composition and structure during mechanical alloying of binary aluminium composites/substances. The invetigations have been executed while applying a wide range of methods, devices and equipment used in modern material science. The obtained data complement each other. It has been established that presence of oxide and hydro-oxide films on aluminium powder  and introduction of surface-active substance in the composite have significant effect on mechanically and thermally activated phase transformations and properties of semi-finished products.  Higher fatty acids have been used as a surface active substance.The mechanism of mechanically activated solid solution formation has been identified. Its essence is  a formation of  specific quasi-solutions at the initial stage of processing. Mechanical and chemical interaction between components during formation of other phases has taken place along with dissolution  in aluminium while processing powder composites. Granule basis is formed according to the dynamic recrystallization mechanism and possess submicrocrystal structural type with the granule dimension basis less than 100 nm and the grains are divided in block size of not more than 20 nm with oxide inclusions of 10–20 nm size.All the compounds  with the addition of  surface-active substances including aluminium powder without alloying elements obtained by processing in mechanic reactor are disperse hardened. In some cases disperse hardening is accompanied by dispersive and solid solution hardnening process. Complex hardening predetermines a high temperature of recrystallization in mechanically alloyed compounds,  its value exceeds 400 °C.

  11. Upwash exploitation and downwash avoidance by flap phasing in ibis formation flight.

    Science.gov (United States)

    Portugal, Steven J; Hubel, Tatjana Y; Fritz, Johannes; Heese, Stefanie; Trobe, Daniela; Voelkl, Bernhard; Hailes, Stephen; Wilson, Alan M; Usherwood, James R

    2014-01-16

    Many species travel in highly organized groups. The most quoted function of these configurations is to reduce energy expenditure and enhance locomotor performance of individuals in the assemblage. The distinctive V formation of bird flocks has long intrigued researchers and continues to attract both scientific and popular attention. The well-held belief is that such aggregations give an energetic benefit for those birds that are flying behind and to one side of another bird through using the regions of upwash generated by the wings of the preceding bird, although a definitive account of the aerodynamic implications of these formations has remained elusive. Here we show that individuals of northern bald ibises (Geronticus eremita) flying in a V flock position themselves in aerodynamically optimum positions, in that they agree with theoretical aerodynamic predictions. Furthermore, we demonstrate that birds show wingtip path coherence when flying in V positions, flapping spatially in phase and thus enabling upwash capture to be maximized throughout the entire flap cycle. In contrast, when birds fly immediately behind another bird--in a streamwise position--there is no wingtip path coherence; the wing-beats are in spatial anti-phase. This could potentially reduce the adverse effects of downwash for the following bird. These aerodynamic accomplishments were previously not thought possible for birds because of the complex flight dynamics and sensory feedback that would be required to perform such a feat. We conclude that the intricate mechanisms involved in V formation flight indicate awareness of the spatial wake structures of nearby flock-mates, and remarkable ability either to sense or predict it. We suggest that birds in V formation have phasing strategies to cope with the dynamic wakes produced by flapping wings.

  12. Thermodynamic Modeling and Phase Diagrams of Hexagonal and Cubic GaN Single-Crystal Film Growth by ECR-PEMOCVD Method%采用ECR-PEMOCVD方法进行立方和六方GaN单晶薄膜生长的准热力学模型和相图

    Institute of Scientific and Technical Information of China (English)

    王三胜; 顾彪

    2004-01-01

    基于热力学平衡理论,对在电子回旋共振等离子体增强金属有机化学气相沉积系统中的GaN薄膜生长给出了一个化学平衡模型.计算表明,GaN生长的驱动力Δp是以下生长条件的函数:Ⅲ族输入分压,输入Ⅴ/Ⅲ比,生长温度.计算了六方和立方GaN的生长相图,计算结果和我们的实验结果显示出一定的一致性.通过分析,解释了高温和高Ⅴ/Ⅲ比生长条件适合六方GaN的原因.上述模型可以延伸到用于GaN单晶薄膜生长的类似系统中.%Based on thermodynamic equilibrium theory,a chemical equilibrium model for GaN growth is given in electron cyclotron resonance plasma enhanced metalorganic chemical vapor deposition (ECR-PEMOCVD) system.Calculation indicates that the growth driving force are functions of growth conditions:group Ⅲ input partial pressure,input Ⅴ/Ⅲ ratio,and growth temperature.Furthermore,the growth phase diagrams of hexagonal and cubic GaN film growth are obtained,which are consistent with our experimental conditions to some extent.Through analysis,it is explained the reason that high temperature and high input Ⅴ/Ⅲ ratio are favorable for hexagonal GaN film growth.This model can be extended to the similar systems used for GaN single-crystal film growth.

  13. Magnetic Order and Spin Dynamics in a Hexagonal Rare Earth Manganite

    Science.gov (United States)

    Helton, J. S.; Singh, D. K.; Elizabeth, S.; Harikrishnan, S.; Lynn, J. W.

    2011-03-01

    Hexagonal rare earth manganites, RMn O3 R = Dy, Ho, Er, Tm, Yb, Lu, Y, or Sc), have attracted a great deal of recent attention as magnetoelectric multiferroics as most of these systems are ferroelectric at room temperature and display magnetic order below TN ~ 100 K. This magnetic order can be quite complex, as both the R and Mn ions lie on geometrically frustrated triangular lattices. DyMn O3 is typically orthorhombic, but can also be grown in the hexagonal phase; Dy 0.5 Y0.5 Mn O3 displays the hexagonal phase and is magnetically diluted at the rare earth site. We have used neutron scattering experiments to explore the magnetic structure and spin dynamics of Dy 0.5 Y0.5 Mn O3 .

  14. Basic Functionalization of Hexagonal Mesoporous Silica

    Institute of Scientific and Technical Information of China (English)

    2003-01-01

    3-Aminopropyltricthoxysilanc (AM), 3-cthyldiaminopropyltrimcthoxysilane (ED) and 3-piperazinylpropyltriethoxysilanc (PZ), were used to chemically couple with the silanol groups of calcined hexagonal and hexagonal-like mesoporous silica SBA-3 and HMS, respectively, to produce functionalised alkaline mesoporous materials. The inerease in the dosage of organosilanes, or in reaction temperature, or in the humidity (i.e., water content) of support, is favorable to the grafting of functional molecules on the surface. When functionalization conditions are the same, the order of loadings on SBA-3 and DDA-HMS is ED>AM>PZ. However, on ODA-HMS, the loading of AM is similar to that of ED.

  15. Hexagonal Structure of Baby Skyrmion Lattices

    CERN Document Server

    Hen, Itay

    2007-01-01

    We study the zero-temperature crystalline structure of baby Skyrmions by applying a full-field numerical minimization algorithm to baby Skyrmions placed inside different parallelogramic unit-cells and imposing periodic boundary conditions. We find that within this setup, the minimal energy is obtained for the hexagonal lattice, and that in the resulting configuration the Skyrmion splits into quarter-Skyrmions. In particular, we find that the energy in the hexagonal case is lower than the one obtained on the well-known rectangular lattice, in which splitting into half-Skyrmions is observed.

  16. Thermally induced microstrain broadening in hexagonal zinc

    Energy Technology Data Exchange (ETDEWEB)

    Lawson, Andrew C [Los Alamos National Laboratory; Valdez, James A [Los Alamos National Laboratory; Roberts, Joyce A [Los Alamos National Laboratory; Leineweber, Andreas [STUTTGART, GERMANY; Mittemeijer, E J [STUTTGART, GERMANY; Kreher, W [DRESDEN UNIV

    2008-01-01

    Neutron powder-diffraction experiments on polycrystalline hexagonal zinc show considerable temperature-dependent line broadening. Whereas as-received zinc at 300 K exhibits narrow reflections, during cooling to a minimum temperature of 10K considerable line-broadening appears, which largely disappears again during reheating. The line broadening may be ascribed to microstrains induced by thermal microstresses due to the anisotropy of the thermal expansion (shrinkage) of hexagonal zinc. Differences between the thermal microstrains and theoretical predictions considering elastic deformation of the grains can be explained by plastic deformation and surface effects.

  17. Interstellar Cloud Formation through Aggregation of Cold Blobs in a Two-Phase Gas Mixture

    Science.gov (United States)

    Kamaya, Hideyuki

    1997-05-01

    We propose a new formation scenario for interstellar clouds through the aggregation of dense cold blobs (phase II [PII]), which drift in a diffuse warm medium (phase I [PI]). We examine how important it is that there exist numerous PII blobs when the properties of such a two-phase flow are studied. First, we solve a one-dimensional shock-tube problem and find that the shock wave in the mixture is considerably damped because of the drag force between the two phases. This is because the PII blobs are left behind the shock front, since their inertia is larger than that of PI, thus suppressing large spatial variations of PI gas via the drag force. The PII blobs thus play the role of anchors. Therefore, mass aggregation by shocks may be ineffective in a two-phase medium. However, the PII blobs can still aggregate through a kind of fluid dynamical instability. We next suppose that the PI gas is accelerated upward by shocks against downward gravity, while the PII blobs are at rest because of balance between the drag force due to PI and gravity. If we put a positive perturbation in the number density of PII blobs, the upward PI flow above the perturbation is decelerated by the enhanced drag force, and the velocity difference between PI and PII is thereby reduced. Then the PII blobs above the perturbation are accelerated downward, since the gravity on PII now dominates the reduced drag force. As a result, the blobs will fall onto this perturbed region, and this region becomes denser and denser. This is the mechanism of the instability. Therefore, we expect efficient cloud formation by this instability in spiral arms, even when galactic shocks are extremely damped.

  18. An elementary reaction kinetic model of the gas-phase formation of polychlorinated dibenzofurans from chlorinated phenols

    Energy Technology Data Exchange (ETDEWEB)

    Dellinger, B.; Khachatryan, L. [Louisiana State Univ., Baton Rouge, LA (United States); Asatryan, R. [State Medical Univ., Yerevan (Armenia)

    2004-09-15

    Combustion and thermal processes are generally recognized as the major source of polychlorinated dibenzo-p-dioxins and dibenzofurans (PCDD/F or simply ''dioxins'') in the environment. A previously developed, simple mechanism of gas-phase formation of PCDD from chlorinated phenols suggested that the gas-phase formation pathway was too slow to account for concentrations of PCDD observed in full-scale combustors. As a result, most research on formation of PCDD/F in combustion sources focused on surface-mediated formation. In this manuscript, we report the development of a modified model for the purely gas-phase formation of polychlorinated dibenzofurans (PCDFs) that is based on the experimentally observed formation of PCDF from the oxidation of 2,4,6-trichlorophenol (TCP) in the presence of hexane.

  19. Formation of Secondary Particulate Matter by Reactions of Gas Phase Hexanal with Sulfate Aerosol Particles

    Science.gov (United States)

    Zhang, J.

    2003-12-01

    The formation of secondary particulate matter from the atmospheric oxidation of organic compounds can significantly contribute to the particulate burden, but the formation of organic secondary particulate matter is poorly understood. One way of producing organic secondary particulate matter is the oxidation of hydrocarbons with seven or more carbon atoms to get products with low vapor pressure. However, several recent reports suggest that relatively low molecular weight carbonyls can enter the particle phase by undergoing heterogeneous reactions. This may be a very important mechanism for the formation of organic secondary particulate matter. Atmospheric aldehydes are important carbonyls in the gas phase, which form via the oxidation of hydrocarbons emitted from anthropogenic and biogenic sources. In this poster, we report the results on particle growth by the heterogeneous reactions of hexanal. A 5 L Continuous Stirred Tank Reactor (CSTR) is set up to conduct the reactions in the presence of seed aerosol particles of deliquesced ammonia bisulfate. Hexanal is added into CSTR by syringe pump, meanwhile the concentrations of hexanal are monitored with High Pressure Liquid Chromatograph (HPLC 1050). A differential Mobility Analyzer (TSI 3071) set to an appropriate voltage is employed to obtain monodisperse aerosols, and another DMA associated with a Condensation Nuclear Counter (TSI 7610) is used to measure the secondary particle size distribution by the reaction in CSTR. This permits the sensitive determination of particle growth due to the heterogeneous reaction, very little growth occurs when hexanal added alone. Results for the simultaneous addition of hexanal and alcohols will also be presented.

  20. The influence of phosphorous pentoxide on the phase composition and formation of Portland clinker

    Energy Technology Data Exchange (ETDEWEB)

    Stanek, T., E-mail: stanek@vustah.cz [Research Institute of Building Materials, Hnevkovskeho 65, 617 00 Brno (Czech Republic); Sulovsky, P., E-mail: sulovsky@sci.muni.cz [Department of Geological Sciences, Faculty of Science, Masaryk University, Kotlarska 2, 611 37 Brno (Czech Republic)

    2009-07-15

    The influence of phosphorous pentoxide (P{sub 2}O{sub 5}) on the phase composition and formation of Portland clinker was studied in laboratory conditions. Phosphorous pentoxide in the form of calcium phosphate was added to common cement-making raw meal in graded quantities up to 5 wt.%. The raw meal properties were studied by thermal analysis. The development of clinker formation by burning for periods ranging from 20 s to 30 min in a special semi-automatic oven with a manipulator was followed using light optical microscopy. The phase composition of clinkers burnt to equilibrium was quantified by the optical point counting method. The entry of P{sub 2}O{sub 5} into clinker minerals was determined by electron microprobe analyses. The laboratory tests show that at 0.7 wt.% of P{sub 2}O{sub 5} in the clinker the alite (Ca{sub 3}SiO{sub 5}) content decreases and belite (Ca{sub 2}SiO{sub 4}) content increases. At a P{sub 2}O{sub 5} content of 4.5 wt.% alite formation was totally blocked and the resulting clinker contained free lime in equilibrium with belite.

  1. Gas-phase products and secondary organic aerosol formation from the ozonolysis and photooxidation of myrcene

    Science.gov (United States)

    Böge, Olaf; Mutzel, Anke; Iinuma, Yoshiteru; Yli-Pirilä, Pasi; Kahnt, Ariane; Joutsensaari, Jorma; Herrmann, Hartmut

    2013-04-01

    Terrestrial vegetation releases a great variety of volatile organic compounds (VOC) into the atmosphere. Monoterpenes, like myrcene, contribute significantly to this global biogenic VOC emission. In the atmosphere, monoterpenes rapidly undergo oxidation reactions by OH radicals (mainly during the daytime), NO3 radicals (mainly during the nighttime) and O3 to form multifunctional oxidation products. The products of these reactions are likely to be of low volatility and hence might lead to secondary organic aerosol (SOA) formation. In the present study, we report results from a series of chamber experiments performed in the LEAK chamber at TROPOS in which the gas-phase products and SOA yields obtained from myrcene O3 reactions with and without an OH radical scavenger as well as from the myrcene OH radical reaction in the presence of NOx have been measured. During the experiments the consumption of myrcene as well as the formation of gas-phase products was monitored using a proton transfer reaction mass spectrometer (PTR-MS). Ozone concentration was measured by an O3 monitor and the mixing ratios of nitrogen oxides were measured by a NOx monitor. Particle size distributions between 3-900 nm were monitored every 11 min using a differential mobility particle sizer (DMPS) system. In addition to the products observed by means of the PTR-MS by their m/z values, an identification of carbonylic compounds by their DNPH derivatives was performed. Beside low molecular mass products the formation of 4-vinyl-4-pentenal with a yield of 55 % in myrcene ozonolysis has been observed. The further oxidation of this major first generation product lead to the formation of two dicarbonylic products with m/z 113 and to SOA formation. The influence of the continuing oxidation of 4-vinyl-4-pentenal on SOA formation will be discussed in detail. The emergence of the gas-phase product hydroxyacetone as direct result of the myrcene ozone reaction will be mooted, because hydroxyacetone seems to

  2. Formation of MgZnO alloy under thermodynamic conditions

    Energy Technology Data Exchange (ETDEWEB)

    Markevich, I.V.; Stara, T.R., E-mail: stara_t@ukr.net; Kuchuk, A.V.; Polishchuk, Yu.O.; Kladko, V.P.

    2014-11-15

    Mg{sub x}Zn{sub 1−x}O ceramics with x=0.10, 0.15, 0.20, 0.25 and 0.30 were sintered at T{sub s}=700–1250 °C. Photoluminescence (PL) and PL excitation (PLE) spectra as well as X-ray diffraction patterns were measured at 293 K. Bandgap width was evaluated from the position of PLE peak. Non-monotonous dependence of PLE peak position on T{sub s} was observed for all used x. This effect was concluded to be caused by the formation of cubic phase side by side with hexagonal one and the enhancement of this process with increasing T{sub s}, which resulted in the decrease of Mg content in the hexagonal phase at T{sub s}>1000 °C. Temperature range of 1000–1050 °C was found to be the optimum one for the formation of hexagonal MgZnO alloy at used x. It was shown that x=0.20 was the solubility limit of MgO in hexagonal Mg{sub x}Zn{sub 1−x}O ceramics.

  3. Cobalt hydroxide/oxide hexagonal ring-graphene hybrids through chemical etching of metal hydroxide platelets by graphene oxide: energy storage applications.

    Science.gov (United States)

    Nethravathi, C; Rajamathi, Catherine R; Rajamathi, Michael; Wang, Xi; Gautam, Ujjal K; Golberg, Dmitri; Bando, Yoshio

    2014-03-25

    The reaction of β-Co(OH)2 hexagonal platelets with graphite oxide in an aqueous colloidal dispersion results in the formation of β-Co(OH)2 hexagonal rings anchored to graphene oxide layers. The interaction between the basic hydroxide layers and the acidic groups on graphene oxide induces chemical etching of the hexagonal platelets, forming β-Co(OH)2 hexagonal rings. On heating in air or N2, the hydroxide hybrid is morphotactically converted to porous Co3O4/CoO hexagonal ring-graphene hybrids. Porous NiCo2O4 hexagonal ring-graphene hybrid is also obtained through a similar process starting from β-Ni0.33Co0.67(OH)2 platelets. As electrode materials for supercapacitors or lithium-ion batteries, these materials exhibit a large capacity, high rate capability, and excellent cycling stability.

  4. Comparison of the Sol-gel Method with the Coprecipitation Technique for Preparation of Hexagonal Barium Ferrite

    Institute of Scientific and Technical Information of China (English)

    WANG Jing-ping; LIU Ying; ZHANG Mi-lin; QIAO Ying-jie; XIA Tian

    2008-01-01

    Hexagonal barium ferrite BaFe12O19 particles were prepared by sol-gel and coprecipitation methods,respectively.The composition of the so-obtained materials was investigated by means of XRD.By the sol-gel method,non-anticipated intermediate crystalline phases,such as γ-Fe2O3,α-Fe2O3,BaCO3,and BaFe2O4 etc.,were formed with the delay of the formation of BaFe12O19.The formation of single phase BaFe12O19 required calcination at 850 ℃ for 4 h.On the other hand,using copreeipitation technique,amorphous hydroxide precursor was directly transferred into BaFe12O19 almost without the formation of intermediate crystalline phases.BaFe12O19 was prepared by calcining at 700 ℃ for 3 h.The results were confirmed by ESEM and VSM analyses.Based on the already reported results and the observed results in this study,it can be concluded that the coprecipitaion technique is easier to control than the sol-gel method for preparation of BaFe12O19 at a low temperature.

  5. Structural and electrical studies of sol-gel synthesized nanocrystalline hexagonal yttrium iron manganite ceramics

    Science.gov (United States)

    Touthang, Jangkhohao; Maisnam, Mamata

    2017-03-01

    Hexagonal yttrium manganites, YMnO3, are interesting materials for their multiferroic behavior. Substituting suitable cations either at the Y-site or Mn-site offers great opportunities to produce a variety of manganites and tune their properties. Nanocrystalline yttrium iron manganites with the compositional formula Y1‑xFexMnO3, x = 0.0, 0.10, 0.15, 0.20 and 0.25, were synthesized by sol-gel autocombustion method. The prepared samples were heated at 1100∘C for 1 h. Another set of samples with compositional formula YFexMn1‑xO3, x = 0.0, 0.10, 0.15, 0.20 and 0.25, were also synthesized by the same method and heated at 1100∘C for 1 h. Various characterizations were done on these manganite systems synthesized by substituting iron at different sites. X-ray diffraction (XRD) technique studied the structure of the samples and analysis of XRD patterns confirmed the formation of hexagonal phase in the samples. Structural parameters such as lattice constants, crystallite size, theoretical density, etc. were determined using the XRD data. The unit cell dimensions have been found to agree with the standard data and the Debye-Scherrer crystallite size obtained from XRD data ranges from 42 nm to 77 nm. The room temperature frequency variations of electrical properties such as dielectric constant, dielectric loss and AC conductivity were measured in the range of 100 Hz-2 MHz and the variations showed a dispersive behavior for all the samples. The various measurements and the results obtained were studied and discussed in the paper.

  6. LAWS OF FORMATION MOVEMENT PATTERNS MANAGEMENT BODY IN PHASE OF FLIGHT IN ATHLETES

    Directory of Open Access Journals (Sweden)

    A. V. Razuvanova

    2016-01-01

    Full Text Available Materials and methods. Regularities of movement patterns in the body control the flight phase of the athletes on the example of the long jump were studied by methods of Motion Tracking and electromyography. The findings suggest that a significant difference of motor stereotypes underlying the performance of motor actions – the long jump – in different skill athletes.Results. In the initial phase (phase jumping differences between the groups are small - repulsion athletes perform in a similar manner, a core group of athletes with a more efficient use of the reserve of the work of the knee. The nature of the work the leg muscles in athletes of both groups in this phase is also not different. However, the further execution of motor actions in athletes of both groups occurs in different ways. Athletes of the control group did not perform virtually control the body in flight phase. This is evidenced primarily high tone muscles in the arms, back and neck throughout the flight phase. Movements are performed only in the knee and hip joints, and already in the phase of “hang-up” – the highest point of the flight path - these movements have focused on the preparation for landing.Conclusions. Athletes of the main group in the flight phase involve the full range of movements - flexion and extension are performed as in the shoulder and elbow joints, as well as in the neck and spine joints. All these movements are designed to increase the range of jumps - this contributes to the removal of the legs forward, and giving the body angular acceleration by the movement of legs and head. Preparation for landing is made directly before contact with the surface, but the very nature of the phase of flight allows the athlete to use the inertia of motion of the body as much as possible to lengthen the jump and thus facilitate shock absorption and retention of balance upon landing.Formation movement patterns in the body control the flight phase of the athletes

  7. Formation of Austenite During Intercritical Annealing of Dual-Phase Steels

    Science.gov (United States)

    Speich, G. R.; Demarest, V. A.; Miller, R. L.

    1981-08-01

    The formation of austenite during intercritical annealing at temperatures between 740 and 900 °C was studied in a series of 1.5 pct manganese steels containing 0.06 to 0.20 pct carbon and with a ferrite-pearlite starting microstructure, typical of most dual-phase steels. Austenite formation was separated into three stages: (1) very rapid growth of austenite into pearlite until pearlite dissolution is complete; (2) slower growth of austenite into ferrite at a rate that is controlled by carbon diffusion in austenite at high temperatures (~85O °C), and by manganese diffusion in ferrite (or along grain boundaries) at low temperatures (~750 °C); and (3) very slow final equilibration of ferrite and austenite at a rate that is controlled by manganese diffusion in austenite. Diffusion models for the various steps were analyzed and compared with experimental results.

  8. Formation of PAHs and Carbonaceous Solids in Gas-Phase Condensation Experiments

    CERN Document Server

    Jäger, C; Jansa, I Llamas; Henning, T; Huisken, F

    2009-01-01

    Carbonaceous grains represent a major component of cosmic dust. In order to understand their formation pathways, they have been prepared in the laboratory by gas-phase condensation reactions such as laser pyrolysis and laser ablation. Our studies demonstrate that the temperature in the condensation zone determines the formation pathway of carbonaceous particles. At temperatures lower than 1700 K, the condensation by-products are mainly polycyclic aromatic hydrocarbons (PAHs), that are also the precursors or building blocks for the condensing soot grains. The low-temperature condensates contain PAH mixtures that are mainly composed of volatile 3-5 ring systems. At condensation temperatures higher than 3500 K, fullerene-like carbon grains and fullerene compounds are formed. Fullerene fragments or complete fullerenes equip the nucleating particles. Fullerenes can be identified as soluble components. Consequently, condensation products in cool and hot astrophysical environments such as cool and hot AGB stars or W...

  9. Measuring the efficiency of ice formation in mixed-phase clouds over Europe with Cloudnet

    Science.gov (United States)

    Bühl, Johannes; Engelmann, Ronny; Ansmann, Albert; Patric, Seifert

    2016-04-01

    Mixed-phase clouds play an important role in current weather and climate research. The complex interaction between aerosols, clouds and dynamics taking place within these clouds is still not understood. The unknown impact of ice formation on cloud lifetime and precipitation evolution introduces large uncertainties into numeric weather prediction and climate projections. In the framework of the BACCHUS project, we have evaluated combined remote sensing data gathered at different European Cloudnet sites (Leipzig, Lindenberg, Potenza and Mace-Head) to study the relation between ice and liquid water in mixed-phase cloud layers. In this way, we can quantify the efficiency of ice production within these clouds. The study also allows contrasting marine (Potenza and Mace-Head) and continental sites (Leipzig and Lindenberg). We derive liquid and ice water content together with vertical motions of ice particles falling through cloud base. The ice mass flux is quantified by combining measurements of ice water content and particle fall velocity. The efficiency of heterogeneous ice formation and its impact on cloud lifetime is estimated for different cloud-top temperatures by relating the ice mass flux and the liquid water content at cloud top. Cloud radar measurements of polarization and fall velocity yield, that ice crystals formed in cloud layers with a geometrical thickness of less than 350 m are mostly pristine when they fall out of the cloud. A difference of four orders of magnitude in ice formation efficiency in mixed-phase cloud layers is found over the cloud-top-temperature range from -40 to 0 °C.

  10. A Massive Galaxy in its Core Formation Phase Three Billion Years After the Big Bang

    CERN Document Server

    Nelson, Erica; Franx, Marijn; Brammer, Gabriel; Momcheva, Ivelina; Schreiber, Natascha Förster; da Cunha, Elisabete; Tacconi, Linda; Bezanson, Rachel; Kirkpatrick, Allison; Leja, Joel; Rix, Hans-Walter; Skelton, Rosalind; van der Wel, Arjen; Whitaker, Katherine; Wuyts, Stijn

    2014-01-01

    Most massive galaxies are thought to have formed their dense stellar cores at early cosmic epochs. However, cores in their formation phase have not yet been observed. Previous studies have found galaxies with high gas velocity dispersions or small apparent sizes but so far no objects have been identified with both the stellar structure and the gas dynamics of a forming core. Here we present a candidate core in formation 11 billion years ago, at z=2.3. GOODS-N-774 has a stellar mass of 1.0x10^11 Msun, a half-light radius of 1.0 kpc, and a star formation rate of 90[+45-20]Msun/yr. The star forming gas has a velocity dispersion 317+-30 km/s, amongst the highest ever measured. It is similar to the stellar velocity dispersions of the putative descendants of GOODS-N-774, compact quiescent galaxies at z~2 and giant elliptical galaxies in the nearby Universe. Galaxies such as GOODS-N-774 appear to be rare; however, from the star formation rate and size of the galaxy we infer that many star forming cores may be heavil...

  11. Bridging the gap: disk formation in the Class 0 phase with ambipolar diffusion and Ohmic dissipation

    CERN Document Server

    Dapp, Wolf B; Kunz, Matthew W

    2011-01-01

    Context: Ideal MHD simulations have revealed catastrophic magnetic braking (MB) in the protostellar phase, which prevents the formation of a centrifugal disk around a nascent protostar. Aims: We determine if non-ideal MHD, including the effects of ambipolar diffusion and Ohmic dissipation determined from a detailed chemical network model, allows for disk formation at the earliest stages of star formation (SF). Methods: We employ the axisymmetric thin-disk approximation in order to resolve a dynamic range of 9 orders of magnitude in length and 16 in density, while also calculating partial ionization using up to 19 species in a detailed chemical equilibrium model. MB is applied using a steady-state approximation, and a barotropic relation is used to capture the thermal evolution. Results: We resolve the formation of the first and second cores, with expansion waves at the periphery of each, a magnetic diffusion shock, and prestellar infall profiles at larger radii. Power-law profiles in each region can be unders...

  12. The general mechanisms of Cu cluster formation in the processes of condensation from the gas phase

    Indian Academy of Sciences (India)

    I V Chepkasov; Yu Ya Gafner; S L Gafner; S P Bardakhanov

    2015-06-01

    Technological applications of metallic clusters impose very strict requirements for particle size, shape, structure and defect density. Such geometrical characteristics of nanoparticles are mainly determined by the process of their growth. This work represents the basic mechanisms of cluster formation from the gas phase that has been studied on the example of copper. The process of Cu nanoclusters synthesis has been studied by the moleculardynamics method based on tight-binding potentials. It has been shown that depending on the size and temperature of the initial nanoclusters the process of nanoparticle formation can pass through different basic scenarios. The general conditions of different types of particles formation have been defined and clear dependence of the cluster shape from collision temperature of initial conglomerates has been shown. The simulation results demonstrate a very good agreement with the available experimental data. Thus, it has been shown that depending on the specific application of the synthesized particles or in electronics, where particles of a small size with a spherical shape are required, or in catalytic reactions, where the main factor of effectiveness is the maximum surface area with the help of temperature of the system it is possible to get the realization of a certain frequency of this or that scenario of the shape formation of nanocrystalline particles.

  13. A Massive Galaxy in Its Core Formation Phase Three Billion Years After the Big Bang

    Science.gov (United States)

    Nelson, Erica; van Dokkum, Pieter; Franx, Marijn; Brammer, Gabriel; Momcheva, Ivelina; Schreiber, Natascha M. Forster; da Cunha, Elisabete; Tacconi, Linda; Bezanson, Rachel; Kirkpatrick, Allison; Leja, Joel; Rix, Hans-Walter; Skelton, Rosalind; van der Wel, Arjen; Whitaker, Katherine; Wuyts, Stijn

    2014-01-01

    Most massive galaxies are thought to have formed their dense stellar cores at early cosmic epochs. However, cores in their formation phase have not yet been observed. Previous studies have found galaxies with high gas velocity dispersions or small apparent sizes but so far no objects have been identified with both the stellar structure and the gas dynamics of a forming core. Here we present a candidate core in formation 11 billion years ago, at z = 2.3. GOODS-N-774 has a stellar mass of 1.0 × 10 (exp 11) solar mass, a half-light radius of 1.0 kpc, and a star formation rate of 90 (sup +45 / sub -20) solar mass/yr. The star forming gas has a velocity dispersion 317 plus or minus 30 km/s, amongst the highest ever measured. It is similar to the stellar velocity dispersions of the putative descendants of GOODS-N-774, compact quiescent galaxies at z is approximately equal to 2 (exp 8-11) and giant elliptical galaxies in the nearby Universe. Galaxies such as GOODS-N-774 appear to be rare; however, from the star formation rate and size of the galaxy we infer that many star forming cores may be heavily obscured, and could be missed in optical and near-infrared surveys.

  14. HEXAGONAL CLOSE-PACKED C-60

    NARCIS (Netherlands)

    de Boer, Jan; van Smaalen, Sander; Petricek, Vaclav; Dusek, Michal P.; Verheijen, Marcel A.; Meijer, G.

    1994-01-01

    C60 crystals were grown from purified powder material with a multiple sublimation technique. In addition to crystals wit a cubic close-packed (ccp) arrangement, crystals were found with a hexagonal close-packed (hcp) structure. Detailed crystallographic evidence is given, including complete refineme

  15. Hexagonal LuMnO3 revisited

    NARCIS (Netherlands)

    Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T.M.

    2001-01-01

    The crystal structure of hexagonal LuMnO3 at room temperature is isomorphous with YMnO3 and deviates in important details from early work. Mn is near the centre of its oxygen coordination environment. On the threefold axes, the apical O-Lu bonds have alternating long and short bond lengths, leading

  16. Powdered Hexagonal Boron Nitride Reducing Nanoscale Wear

    Science.gov (United States)

    Chkhartishvili, L.; Matcharashvili, T.; Esiava, R.; Tsagareishvili, O.; Gabunia, D.; Margiev, B.; Gachechiladze, A.

    2013-05-01

    A morphology model is suggested for nano-powdered hexagonal boron nitride that can serve as an effective solid additive to liquid lubricants. It allows to estimate the specific surface, that is a hard-to-measure parameter, based on average size of powder particles. The model can be used also to control nanoscale wear processes.

  17. Polymer Wall Formation Using Liquid-Crystal/Polymer Phase Separation Induced on Patterned Polyimide Films

    Science.gov (United States)

    Murashige, Takeshi; Fujikake, Hideo; Sato, Hiroto; Kikuchi, Hiroshi; Kurita, Taiichiro; Sato, Fumio

    2004-12-01

    We could form lattice-shaped polymer walls in a liquid crystal (LC) layer through the thermal phase separation of an LC/polystyrene solution between substrates with polyimide films etched by short-wavelength ultraviolet irradiation using a photomask. The LC wetting difference between the polyimide and substrate surfaces caused the coalescence of growing LC droplets on patterned polyimide films with the progress of phase separation. Consequently, polymer walls were formed on substrate surface areas without polyimide films. The shape of the polymer wall formed became sharp with the use of rubbed polyimide films because the nucleation of growing LC droplets concentrated on the patterned polyimide films. It is thought that the increase in the alignment order of LC molecules in the solution near the rubbed polyimide films promotes the formation of LC molecular aggregation, which becomes the growth nuclei of LC droplets.

  18. Halo formation in three-dimensional bunches with various phase space distributions

    Science.gov (United States)

    Fedotov, A. V.; Gluckstern, R. L.; Kurennoy, S. S.; Ryne, R. D.

    1999-01-01

    A realistic treatment of halo formation must take into account 3D beam bunches and 6D phase space distributions. We recently constructed, analytically and numerically, a new class of self-consistent 6D phase space stationary distributions, which allowed us to study the halo development mechanism without being obscured by the effect of beam redistribution. In this paper we consider nonstationary distributions and study how the halo characteristics compare with those obtained using the stationary distribution. We then discuss the effect of redistribution on the halo development mechanism. In contrast to bunches with a large aspect ratio, we find that the effect of coupling between the r and z planes is especially important as the bunch shape becomes more spherical.

  19. Entropy landscape of phase formation associated with quantum criticality in Sr3Ru2O7.

    Science.gov (United States)

    Rost, A W; Perry, R S; Mercure, J-F; Mackenzie, A P; Grigera, S A

    2009-09-11

    Low-temperature phase transitions and the associated quantum critical points are a major field of research, but one in which experimental information about thermodynamics is sparse. Thermodynamic information is vital for the understanding of quantum many-body problems. We show that combining measurements of the magnetocaloric effect and specific heat allows a comprehensive study of the entropy of a system. We present a quantitative measurement of the entropic landscape of Sr3Ru2O7, a quantum critical system in which magnetic field is used as a tuning parameter. This allows us to track the development of the entropy as the quantum critical point is approached and to study the thermodynamic consequences of the formation of a novel electronic liquid crystalline phase in its vicinity.

  20. Oxidation Control and Non-equilibrium Phase Formation in Cu-Cr Alloys during Mechanical Alloying

    Institute of Scientific and Technical Information of China (English)

    Xiaolong CUI; Lai WANG; Min QI

    2001-01-01

    Using X-ray diffraction (XRD), scanning electron microscopy (SEM), differential scanning calorimeter (DSC) and optical microscopy, phase transformation of Cu-Cr alloys with various compositions during mechanical alloying process has been investigated. Besides the formation of supersaturated solid solution, the results show that a kind of amorphous oxide formed in the process,and the addition of carbon has obviously effect on the suppression of oxidation and the deoxidization of oxide. The reactive milling has a remarkable effect on the behavior of oxidation.

  1. Investigating Processes of Materials Formation via Liquid Phase and Cryogenic TEM

    Energy Technology Data Exchange (ETDEWEB)

    De Yoreo, James J.; Sommerdijk, Nico

    2016-06-14

    The formation of materials in solutions is a widespread phenomenon in synthetic, biological and geochemical systems, occurring through dynamic processes of nucleation, self-assembly, crystal growth, and coarsening. The recent advent of liquid phase TEM and advances in cryogenic TEM are transforming our understanding of these phenomena by providing new insights into the underlying physical and chemical mechanisms. The techniques have been applied to metallic and semiconductor nanoparticles, geochemical and biological minerals, electrochemical systems, macromolecular complexes, and selfassembling systems, both organic and inorganic. New instrumentation and methodologies currently on the horizon promise new opportunities for advancing the science of materials synthesis.

  2. Influence of Powder Metallurgical Processing Routes on Phase Formations in a Multicomponent NbSi-Alloy

    Science.gov (United States)

    Seemüller, C.; Hartwig, T.; Mulser, M.; Adkins, N.; Wickins, M.; Heilmaier, M.

    2014-09-01

    Refractory metal silicide composites on the basis of Nbss-Nb5Si3 have been investigated as potential alternatives for nickel-base superalloys for years because of their low densities and good high-temperature strengths. NbSi-based composites are typically produced by arc-melting or casting. Samples in this study, however, were produced by powder metallurgy because of the potential for near net-shape component fabrication with very homogeneous microstructures. Either gas atomized powder or high-energy mechanically alloyed elemental powders were compacted by powder injection molding or hot isostatic pressing. Heat treatments were applied for phase stability evaluation. Slight compositional changes (oxygen, nitrogen, or iron) introduced by the processing route, i.e., powder production and consolidation, can affect phase formations and phase transitions during the process. Special focus is put on the distinction between different silicides (Nb5Si3 and Nb3Si) and silicide modifications (α-, β-, and γ-Nb5Si3), respectively. These were evaluated by x-ray diffraction and energy-dispersive spectroscopy measurements with the additional inclusion of thermodynamic calculations using the calculated phase diagram method.

  3. Interdigitated lamella and bicontinuous cubic phases formation from natural cyclic surfactin and its linear derivative.

    Science.gov (United States)

    Imura, Tomohiro; Ikeda, Shintaro; Aburai, Kenichi; Taira, Toshiaki; Kitamoto, Dai

    2013-01-01

    The lyotropic phase behavior of the cyclic form surfactin (CS) produced by Bacillus subtilis and its linear derivative in aqueous solution was evaluated for the first time by using polarized light microscopy and small-angle X-ray scattering (SAXS). By polarized light microscopy, the aqueous solutions of CS at the concentrations above 50 wt% were optically anisotropic and gave mosaic textures, suggesting the formation of lamella structures, while those of the linear surfactin (LS) were optically isotropic and no distinctive textures were observed. SAXS diffractograms of the CS solution above 50 wt% clearly gave the three peaks whose spacing ratio of 1: 2: 3, indicating the presence of the lamellar (L(α)) phase, while those of the LS solution gave multiple peaks whose spacing ratios of √2: √3: √4: √6: √8, confirming the bicontinuous cubic (V₂) phase of the symmetry Pn3m. It was also found that the lamellar phase with CS was composed of not ordinary bilayer but interdigitated bilayer with the unusual packing of the acyl chain region. These results clearly demonstrated that the cyclic peptide structure plays a key role in regulating their self-assembly, and naturally occurring CS is likely to form lamellar structure by balancing bulky peptide headgroups with interdigitated packing of their acyl chains.

  4. L1{sub 0} phase formation in ternary FePdNi alloys

    Energy Technology Data Exchange (ETDEWEB)

    Montes-Arango, A.M. [Department of Mechanical and Industrial Engineering, Northeastern University, Boston, MA 02115 (United States); Bordeaux, N.C. [Department of Chemical Engineering, Northeastern University, Boston, MA 02115 (United States); Liu, J.; Barmak, K. [Department of Applied Physics and Applied Mathematics, Columbia University, New York, NY 10027 (United States); Lewis, L.H., E-mail: lhlewis@neu.edu [Department of Mechanical and Industrial Engineering, Northeastern University, Boston, MA 02115 (United States); Department of Chemical Engineering, Northeastern University, Boston, MA 02115 (United States)

    2015-11-05

    Metallurgical routes to highly metastable phases are required to access new materials with new functionalities. To this end, the stability of the tetragonal chemically ordered L1{sub 0} phase in the ternary Fe–Pd–Ni system is quantified to provide enabling information concerning synthesis of L1{sub 0}-type FeNi, a highly attractive yet highly elusive advanced permanent magnet candidate. Fe{sub 50}Pd{sub 50−x}Ni{sub x} (x = 0–7 at%) samples were arc-melted and annealed at 773 K (500 °C) for 100 h to induce formation of the chemically ordered L1{sub 0} phase. Coupled calorimetry, structural and magnetic investigations allow determination of an isothermal section of the ternary Fe–Pd–Ni phase diagram featuring a single phase L1{sub 0} region near the FePd boundary for x < 6 at%. It is demonstrated that increased Ni content in Fe{sub 50}Pd{sub 50−x}Ni{sub x} alloys systematically decreases the order-disorder transition temperature, resulting in a lower thermodynamic driving force for the ordering phase transformation. The Fe{sub 50}Pd{sub 50−x}Ni{sub x} L1{sub 0} → fcc disordering transformation is determined to occur via a two-step process, with compositionally-dependent enthalpies and transition temperatures. These results highlight the need to investigate ternary alloys with higher Ni content to determine the stability range of the L1{sub 0} phase near the FeNi boundary, thereby facilitating kinetic access to the important L1{sub 0} FeNi ferromagnetic phase. - Highlights: • Chemical ordering in FePdNi enhances intrinsic and extrinsic magnetic properties. • 773 K annealed FePdNi alloys studied show a stable L1{sub 0} phase for Ni ≤ 5.2 at%. • Chemical disordering in FePdNi occurs by a previously unreported two-step process. • Ni additions to FePd dramatically decrease the chemical order-disorder temperature. • The chemical-ordering transformation kinetics are greatly affected by Ni content.

  5. Determination of the hexagonal network parameters of the quartz {beta} using neutron multiple diffraction; Determinacao dos parametros da rede hexagonal do quartzo {beta} utilizando difracao multipla de neutrons

    Energy Technology Data Exchange (ETDEWEB)

    Campos, L.C.; Parente, C.B.R.; Mazzocchi, V.L. [Instituto de Pesquisas Energeticas e Nucleares (IPEN/CNEN-SP), Sao Paulo, SP (Brazil)], e-mail: lccampos@curiango.ipen.br; Helene, O. [Universidade de Sao Paulo (USP), SP (Brazil)], e-mail: otaviano@if.usp.br

    2000-07-01

    In this work, neutron multiple diffraction is employed for the determination of the parameters a and c of the {beta}-quartz hexagonal cell. This crystalline phase of silica (SiO{sub 2}) occurs in temperatures between ca. 846 and 1143 K. A {beta}-quartz neutron multiple diffraction pattern has been used in the determinations. This pattern was obtained with a natural quartz single crystal heated to 1003 K. During the indexing of the pattern it was verified that most of the pairs of secondary reflections, which are responsible for the formation of peaks, could be classified as 'good for the determination of a' or 'good for the determination of c'. With this classification, it became possible to employ an iterative method for the determination of both parameters. After 8 cycles of iteration the values found for the parameters were a = 4.9964 +- 0.0018 and c = 5.46268 +- 0.00052 A. (author)

  6. Observing Altshuler--Aronov--Spivak Oscillation in a Hexagonal Antidot Array of Monolayer Graphene

    Science.gov (United States)

    Yagi, Ryuta; Shimomura, Midori; Tahara, Fumiya; Kobara, Hiroaki; Fukada, Seiya

    2012-06-01

    We show that hexagonal antidot lattices of monolayer graphene exhibited the Altshuler--Aronov--Spivak (AAS) effect in low field magnetoresistance. In higher magnetic fields, Aharonov--Bohm-type oscillations were visible. The phase of AAS oscillation indicated that the chirality effect of graphene is suppressed because of inter-valley scattering due to boundary scatterings.

  7. Influence of the Heterogeneous Nucleation Sites on the Kinetics of Intermetallic Phase Formation in Aged Duplex Stainless Steel

    Science.gov (United States)

    Melo, Elis Almeida; Magnabosco, Rodrigo

    2017-09-01

    The aim of this work is to study the influence of the heterogeneous nucleation site quantity, observed in different ferrite and austenite grain size samples, on the phase transformations that result in intermetallic phases in a UNS S31803 duplex stainless steel (DSS). Solution treatment was conducted for 1, 24, 96, or 192 hours at 1373 K (1100 °C) to obtain different ferrite and austenite grain sizes. After solution treatment, isothermal aging treatments for 5, 8, 10, 20, 30, or 60 minutes at 1123 K (850 °C) were performed to verify the influence of different amounts of heterogeneous nucleation sites in the kinetics of intermetallic phase formation. The sample solution treated for 1 hour, with the highest surface area between matrix phases, was the one that presented, after 60 minutes at 1123 K (850 °C), the smaller volume fraction of ferrite (indicative of greater intermetallic phase formation), higher volume of sigma (that was present in coral-like and compact morphologies), and chi phase. It was not possible to identify which was the first nucleated phase, sigma or chi. It was also observed that the phase formation kinetics is higher for the sample solution treated for 1 hour. It was evidenced that, from a certain moment on, the chi phase begins to be consumed due to the sigma phase formation, and the austenite/ferrite interface presents higher S V for all solution treatment times. It was also observed that intermetallic phases form preferably in austenite-ferrite interfaces, although the higher occupation rate occurs at triple junction ferrite-ferrite-ferrite. It was verified that there was no saturation of nucleation sites in any interface type nor triple junction, and the equilibrium after 1 hour of aging at 1123 K (850 °C) was not achieved. It was then concluded that sigma phase formation is possibly controlled by diffusional processes, without saturation of nucleation sites.

  8. Interaction of multiferroic properties and interfaces in hexagonal LuMnO3 ceramics

    Science.gov (United States)

    Baghizadeh, A.; Vieira, J. M.; Stroppa, D. G.; Mirzadeh Vaghefi, P.; Graça, M. P.; Amaral, J. S.; Willinger, M.-G.; Amaral, V. S.

    2017-02-01

    A study on the underlying interaction mechanisms between lattice constants, magnetic and dielectric properties with inhomogeneities or internal interfaces in hexagonal, off-stoichiometric LuMnO3 oxide is presented. By increasing Mn content the a-axis constant and volume of the unit cell, the antiferromagnetic (AFM) Néel temperature, T N, and frustration factor of the frustrated Mn3+ trimmers in basal plane show decreasing trends. It was found that increasing the annealing time improves the properties of the lattices and progressively eliminates secondary phases for compositions within the solid solution stability limits. A magnetic contribution below T N is observed for all samples. Two regimes of magnetization below and above 45 K were observed in the AFM state. The magnetic contribution below T N is assigned to either the secondary phase or internal interfaces like ferroelectric (FE) domain walls. Magneto-dielectric coupling at T N is preserved in off-stoichiometric ceramics. The presence of a low temperature anomaly of the dielectric constant is correlated to the composition of the solid solution in off-stoichiometric ceramics. Large FE domains are observed in piezoresponse force microscopy (PFM) images of doped and un-doped ceramics, whereas atomic structure analysis indicates the parallel formation of nano-sized FE domains. A combination of measured properties and microscopy images of micron- and nano-sized domains ascertain the role of lattice distortion and stability of solid solution on multiferroic properties.

  9. High-Entropy Alloys in Hexagonal Close-Packed Structure

    Science.gov (United States)

    Gao, M. C.; Zhang, B.; Guo, S. M.; Qiao, J. W.; Hawk, J. A.

    2016-07-01

    The microstructures and properties of high-entropy alloys (HEAs) based on the face-centered cubic and body-centered cubic structures have been studied extensively in the literature, but reports on HEAs in the hexagonal close-packed (HCP) structure are very limited. Using an efficient strategy in combining phase diagram inspection, CALPHAD modeling, and ab initio molecular dynamics simulations, a variety of new compositions are suggested that may hold great potentials in forming single-phase HCP HEAs that comprise rare earth elements and transition metals, respectively. Experimental verification was carried out on CoFeReRu and CoReRuV using X-ray diffraction, scanning electron microscopy, and energy dispersion spectroscopy.

  10. Fabrication of hexagonal boron nitride based ceramics by combustion synthesis

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    Pure h-BN (hexagonal boron nitride) and h-BN based ceramic parts were fabricated by combustion synthesis technique, i.e. self-propagating high-temperature synthesis (SHS). Components were manufactured by the combustion reaction of 80  MPa nitrogen and the compact made by cool isostatic pressing. In h-BN based ceramic parts, h-BN powder was used as diluent and SiO2 powder as reinforcing phase. The density of pure h-BN and h-BN-based ceramic parts were 58% and 78% of theoretical density, respectively. With XRD and SEM, phases and microstructures of ceramic parts were analyzed. Mechanical properties were also tested.

  11. The formation of very wide binaries during the star cluster dissolution phase

    CERN Document Server

    Kouwenhoven, M B N; Parker, Richard J; Davies, M B; Malmberg, D; Kroupa, P

    2010-01-01

    Over the past few decades, numerous wide (>1000 au) binaries in the Galactic field and halo have been discovered. Their existence cannot be explained by the process of star formation or by dynamical interactions in the field, and their origin has long been a mystery. We explain the origin of these wide binaries by formation during the dissolution phase of young star clusters: an initially unbound pair of stars may form a binary when their distance in phase-space is small. Using N-body simulations, we find that the resulting wide binary fraction in the semi-major axis range 1000 au - 0.1 pc for individual clusters is 1-30%, depending on the initial conditions. The existence of numerous wide binaries in the field is consistent with observational evidence that most clusters start out with a large degree of substructure. The wide binary fraction decreases strongly with increasing cluster mass, and the semi-major axis of the newly formed binaries is determined by the initial cluster size. The resulting eccentricit...

  12. Electrochemical formation process and phase control of Mg-Li-Ce alloys in molten chlorides

    Institute of Scientific and Technical Information of China (English)

    ZHANG Meng; HAN Wei; ZHANG Milin; ZHU Fengyan; XUE Yun; ZHANG Zhijian

    2013-01-01

    An electrochemical approach for the preparation of Mg-Li-Ce alloys by co-reduction of Mg,Li and Ce on a molybdenum electrode in KCl-LiCl-MgCl2-CeCl3 melts at 873 K was investigated.Cyclic voltammograms (CVs) and square wave voltammograms indicated that the underpotential deposition (UPD) of cerium on pre-deposited magnesium led to the formation of Mg-Ce alloys at electrode potentials around-1.87 V.The order of electrode reactions was as follows:discharge of Mg(Ⅱ) to Mg-metal,UPD of Ce on the surface of pre-deposited Mg with formation of Mg-Ce alloys,discharge of Ce(Ⅲ) to Ce-metal and after that the discharge of Li+ with the deposition of Mg-Li-Ce alloys,which was investigated by CVs,chronoamperometry,chronopotentiometry and open circuit chronopotentiometry.X-ray diffraction (XRD) illuminated that Mg-Li-Ce alloys with different phases were obtained via galvanostatic electrolysis by different current densities.The microstructures of Mg-Li-Ce alloys were characterized by optical microscopy (OM) and scanning electron microscopy (SEM),respectively.The analysis of energy dispersive spectrometry (EDS) showed that Ce existed at grain boundaries to restrain the grain growth.The compositions and the average grain sizes of Mg-Li-Ce alloys could be obtained controllably corresponding with the phase structures of the XRD patterns.

  13. Kinetic modeling of Secondary Organic Aerosol formation: effects of particle- and gas-phase reactions of semivolatile products

    Directory of Open Access Journals (Sweden)

    A. W. H. Chan

    2007-05-01

    Full Text Available The distinguishing mechanism of formation of secondary organic aerosol (SOA is the partitioning of semivolatile hydrocarbon oxidation products between the gas and aerosol phases. While SOA formation is typically described in terms of partitioning only, the rate of formation and ultimate yield of SOA can also depend on the kinetics of both gas- and aerosol-phase processes. We present a general equilibrium/kinetic model of SOA formation that provides a framework for evaluating the extent to which the controlling mechanisms of SOA formation can be inferred from laboratory chamber data. With this model we examine the effect on SOA formation of gas-phase oxidation of first-generation products to either more or less volatile species, of particle-phase reaction (both first- and second-order kinetics, of the rate of parent hydrocarbon oxidation, and of the extent of reaction of the parent hydrocarbon. The effect of pre-existing organic aerosol mass on SOA yield, an issue of direct relevance to the translation of laboratory data to atmospheric applications, is examined. The importance of direct chemical measurements of gas- and particle-phase species is underscored in identifying SOA formation mechanisms.

  14. Kinetic modeling of secondary organic aerosol formation: effects of particle- and gas-phase reactions of semivolatile products

    Directory of Open Access Journals (Sweden)

    A. W. H. Chan

    2007-08-01

    Full Text Available The distinguishing mechanism of formation of secondary organic aerosol (SOA is the partitioning of semivolatile hydrocarbon oxidation products between the gas and aerosol phases. While SOA formation is typically described in terms of partitioning only, the rate of formation and ultimate yield of SOA can also depend on the kinetics of both gas- and aerosol-phase processes. We present a general equilibrium/kinetic model of SOA formation that provides a framework for evaluating the extent to which the controlling mechanisms of SOA formation can be inferred from laboratory chamber data. With this model we examine the effect on SOA formation of gas-phase oxidation of first-generation products to either more or less volatile species, of particle-phase reaction (both first- and second-order kinetics, of the rate of parent hydrocarbon oxidation, and of the extent of reaction of the parent hydrocarbon. The effect of pre-existing organic aerosol mass on SOA yield, an issue of direct relevance to the translation of laboratory data to atmospheric applications, is examined. The importance of direct chemical measurements of gas- and particle-phase species is underscored in identifying SOA formation mechanisms.

  15. Formation of organic solid phases in hydrocarbon reservoir fluids. Final report

    Energy Technology Data Exchange (ETDEWEB)

    Andersen, S.I.; Lindeloff, N.; Stenby, E.H.

    1998-12-31

    The occurrence of solid phases during oil recovery is a potential problem. The present work has mainly been concerned with wax formation due to cooling of oils with a large paraffin content. 8 oils have been included in this project, although only a few of these have till now been subject to all the experimental techniques applied. The oils and wax fractions from these have been characterized using techniques such as GC-MS and Ftir. The goal has in part been to get a detailed description of the oil composition for use in model evaluation and development and in part to get a fundamental understanding of waxy oil properties and behaviour. A high pressure (200 bar) equipment has been developed for automatic detection of wax appearance using a filtration technique and laser light turbidimetry. The latter was found to be far superior to the filtration. The filtration was used to sample the incipient solid phase for characterization. However entrapment of liquid in the filters currently used have hampered this part. A number of model systems and one gas condensate have been investigated. The GC-MS procedure was found only to been able to detect molecules up to n-C45 and the group type analysis was not accurate enough for modelling purposes. Using Ftir it was obvious that incipient phases may contain very complex molecules (asphaltenes) which are not captured by GC-MS especially when fractionation is done using the acetone precipitation at elevated temperature. The latter fractionation procedure has been investigated thoroughly as a tool for understanding wax distribution etc. Within thermodynamic modelling a delta lattice parameter model has been developed which incorporates the non-ideality of the solid phases into the calculation of SLE. The non-ideality is estimated from pure component properties. A new algorithm for phase equilibria involving gas-liquid-solid has been developed. Currently both the model work and the experimental works are continued. (au)

  16. Decomposition of BN and formation of Nd2Fe14BNx phase prepared by mechanical alloying

    Science.gov (United States)

    Liu, W.; Zhang, Z. D.; Sun, X. K.; He, J. F.; Zhao, X. G.

    1999-07-01

    The decomposition of pyrolytic boron nitride (p-BN) during milling is studied as a function of the milling time. It has been found that the p-BN compound can be partially decomposed by milling until an amorphous p-BN phase is formed so that the content of nitrogen in the p-BN system will not continue to be changed by the milling process. Furthermore, the structure and magnetic properties of Nd2Fe14BNx-based alloys prepared by mechanical alloying using either p-BN or milled p-BN as starting material have been investigated. The Nd2Fe14BNx phase with x up to 0.25 coexists with some amounts of NdN, the Nd-rich phase and icons/Journals/Common/alpha" ALT="alpha" ALIGN="TOP"/>-Fe. A pre-milling process of p-BN favours the formation of the Nd2Fe14BNx phase. The magnetic properties of Nd16Fe76B8Nx alloys prepared by using milled p-BN are better than those made of non-milled p-BN. The Curie temperature of the Nd2Fe14BN0.25 phase is 335 °C, which is slightly higher than that of the Nd2Fe14B compound. A coercivity higher than 20 kOe is achieved for Nd2Fe14BNx-based alloys by adding excess Nd, which is close to the value of Nd16Fe76B8 prepared by using pure B.

  17. Molten-salt Synthesis and Properties of ZnS with Hexagonal Prism Morphology

    Institute of Scientific and Technical Information of China (English)

    LIU, Jin-Song; JI, Guang-Bin; LI, Zi-Quan; CAO, Jie-Ming; ZHENG, Ming-Bo; KE, Xing-Fei

    2007-01-01

    ZnS with hexagonal prism morphology has been synthesized successfully by molten-salt method with ZnS nanoparticles as precursors, and the ZnS nanoparticles were prepared by one-step solid-state reaction of Zn(CH3COO)2·2H2O with Na2S·9H2O at ambient temperature. Crystal structure and morphology of the product were characterized by X-ray diffraction, scanning electron microscopy, transmission electron microscopy and HRTEM. Ultraviolet-visible optical absorption spectrum of the ZnS hexagonal prism shows a distinct red shift from that of bulk ZnS crystals and photoluminescence spectrum exhibits strong emissions at 380 and 500 nm, respectively. Further experiments were designed and the formation mechanism of the ZnS hexagonal prism has been also discussed in brief.

  18. Influence of head group methylation on the phase behavior of lipid monolayers

    DEFF Research Database (Denmark)

    Brezesinski, G.; Bringezu, F.; Weidemann, G.

    1998-01-01

    per three tails exceeds that per head, an influence of the head group methylation on the monolayer structure is observed. The tilt angles at lower lateral pressures and the transition pressure to a hexagonal packing of upright oriented chains increase with increasing methylation degree. The transition...... from the NN tilted rectangular to this hexagonal phase is connected with a pressure region where the in-plane components Q(xy) of the two peaks coincide while the out-of-plane components Q(z) differ. This indicates an undistorted hexagonal in-plane lattice even for tilted chains. The area-pressure...... and X-ray measurements below 10 mN/m, can be explained by the formation of holes in the monolayer. Possibly the tilting of the triple-chain molecules leads to an orientational ordering of the head group dipoles and therefore to an electrostatic repulsion between condensed phase domains. (C) 1998...

  19. Estimation of Gibbs Free Energy of Formation of Sialon (O‘—and X—Phases

    Institute of Scientific and Technical Information of China (English)

    WENHongjine; LIWenchao

    1999-01-01

    Based on introducing the quasi-parabolid rule,which indicates the relation of Gibbs free energy of formation of compounds and its compostitions,the Gibbs free energes of formation of Sialons (O'-and X-phases) were estimated.

  20. Formation of Small Gas Phase Carbonyls from Heterogeneous Oxidation of Polyunsaturated Fatty Acids (PUFA)

    Science.gov (United States)

    Zhou, S.; Zhao, R.; Lee, A.; Gao, S.; Abbatt, J.

    2011-12-01

    Fatty acids (FAs) are emitted into the atmosphere from gas and diesel powered vehicles, cooking, plants, and marine biota. Field measurements have suggested that FAs, including polyunsaturated fatty acids (PUFA), could make up an important contribution to the organic fraction of atmospheric aerosols. Due to the existence of carbon-carbon double bonds in their molecules, PUFA are believed to be highly reactive towards atmospheric oxidants such as OH and NO3 radicals and ozone, which will contribute to aerosol hygroscopicity and cloud condensation nuclei activity. Previous work from our group has shown that small carbonyls formed from the heterogeneous reaction of linoleic acid (LA) thin films with gas-phase O3. It is known that the formation of small carbonyls in the atmosphere is not only relevant to the atmospheric budget of volatile organic compounds but also to secondary organic aerosol formation. In the present study, using an online proton transfer reaction mass spectrometry (PTR-MS) and off-line gas chromatography-mass spectrometry (GC-MS) we again investigated carbonyl formation from the same reaction system, i.e. the heterogeneous ozonolysis of LA film. In addition to the previously reported carbonyls, malondialdehyde (MDA), a source of reactive oxygen species that is mutagenic, has been identified as a product for the first time. Small dicarbonyls, e.g. glyoxal, are expected to be formed from the further oxidation of MDA. In this presentation, the gas-phase chemistry of MDA with OH radicals using a newly built Teflon chamber in our group will also be presented.

  1. RPPAML/RIMS: A metadata format and an information management system for reverse phase protein arrays

    Science.gov (United States)

    Stanislaus, Romesh; Carey, Mark; Deus, Helena F; Coombes, Kevin; Hennessy, Bryan T; Mills, Gordon B; Almeida, Jonas S

    2008-01-01

    Background Reverse Phase Protein Arrays (RPPA) are convenient assay platforms to investigate the presence of biomarkers in tissue lysates. As with other high-throughput technologies, substantial amounts of analytical data are generated. Over 1000 samples may be printed on a single nitrocellulose slide. Up to 100 different proteins may be assessed using immunoperoxidase or immunoflorescence techniques in order to determine relative amounts of protein expression in the samples of interest. Results In this report an RPPA Information Management System (RIMS) is described and made available with open source software. In order to implement the proposed system, we propose a metadata format known as reverse phase protein array markup language (RPPAML). RPPAML would enable researchers to describe, document and disseminate RPPA data. The complexity of the data structure needed to describe the results and the graphic tools necessary to visualize them require a software deployment distributed between a client and a server application. This was achieved without sacrificing interoperability between individual deployments through the use of an open source semantic database, S3DB. This data service backbone is available to multiple client side applications that can also access other server side deployments. The RIMS platform was designed to interoperate with other data analysis and data visualization tools such as Cytoscape. Conclusion The proposed RPPAML data format hopes to standardize RPPA data. Standardization of data would result in diverse client applications being able to operate on the same set of data. Additionally, having data in a standard format would enable data dissemination and data analysis. PMID:19102773

  2. RPPAML/RIMS: A metadata format and an information management system for reverse phase protein arrays

    Directory of Open Access Journals (Sweden)

    Hennessy Bryan T

    2008-12-01

    Full Text Available Abstract Background Reverse Phase Protein Arrays (RPPA are convenient assay platforms to investigate the presence of biomarkers in tissue lysates. As with other high-throughput technologies, substantial amounts of analytical data are generated. Over 1000 samples may be printed on a single nitrocellulose slide. Up to 100 different proteins may be assessed using immunoperoxidase or immunoflorescence techniques in order to determine relative amounts of protein expression in the samples of interest. Results In this report an RPPA Information Management System (RIMS is described and made available with open source software. In order to implement the proposed system, we propose a metadata format known as reverse phase protein array markup language (RPPAML. RPPAML would enable researchers to describe, document and disseminate RPPA data. The complexity of the data structure needed to describe the results and the graphic tools necessary to visualize them require a software deployment distributed between a client and a server application. This was achieved without sacrificing interoperability between individual deployments through the use of an open source semantic database, S3DB. This data service backbone is available to multiple client side applications that can also access other server side deployments. The RIMS platform was designed to interoperate with other data analysis and data visualization tools such as Cytoscape. Conclusion The proposed RPPAML data format hopes to standardize RPPA data. Standardization of data would result in diverse client applications being able to operate on the same set of data. Additionally, having data in a standard format would enable data dissemination and data analysis.

  3. Chain hexagonal cacti with the extremal eccentric distance sum.

    Science.gov (United States)

    Qu, Hui; Yu, Guihai

    2014-01-01

    Eccentric distance sum (EDS), which can predict biological and physical properties, is a topological index based on the eccentricity of a graph. In this paper we characterize the chain hexagonal cactus with the minimal and the maximal eccentric distance sum among all chain hexagonal cacti of length n, respectively. Moreover, we present exact formulas for EDS of two types of hexagonal cacti.

  4. Secondary Organic Aerosol formation from the gas-phase reaction of catechol with ozone

    Science.gov (United States)

    Coeur-Tourneur, C.; Tomas, A.; Guilloteau, A.; Henry, F.; Ledoux, F.; Visez, N.; Riffault, V.; Wenger, J. C.; Bedjanian, Y.; Foulon, V.

    2009-04-01

    The formation of secondary organic aerosol from the gas-phase reaction of catechol (1,2-dihydroxybenzene) with ozone has been studied in two smog chambers (at the LPCA in France and at the CRAC in Ireland). Aerosol production was monitored using a scanning mobility particle sizer. The overall organic aerosol yield (Y) was determined as the ratio of the suspended aerosol mass corrected for wall losses (Mo) to the total reacted catechol concentrations, assuming a particle density of 1.4 g cm-3. Analysis of the data clearly shows that Y is a strong function of Mo and that secondary organic aerosol formation can be expressed by a one-product gas/particle partitioning absorption model. The aerosol formation is affected by the initial catechol concentration, which leads to aerosol yields ranging from 17% to 86%. The aerosol yields determined in the LPCA and CRAC smog chambers were comparable and were also in accordance with those determined in a previous study performed in EUPHORE (EUropean PHOto REactor, Spain).

  5. Two phase formation of massive elliptical galaxies : study through cross-correlation including spatial effect

    CERN Document Server

    Modak, Soumita; Chattopadhyay, Asis Kumar

    2016-01-01

    Formation mechanism of present day population of elliptical galaxies have been revisited in the context of hierarchical cosmological models accompanied by accretion and minor mergers through cross correlation function including spatial effect. The present work investigates the formation and evolution of several components of nearby massive early type galaxies (ETGs) through cross-correlation in the spatial coordinates, right ascension and declination (RA, DEC) and mass-size parameter space with high redshift $(0.5\\leq z\\leq2.7)$ ETGs. It is found that innermost components of nearby ETGs are highly correlated with ETGs in the redshift range $(2\\leq z\\leq2.7)$ known as 'red nuggets'. The intermediate and outermost parts have moderate correlations with ETGs in the redshift range $(0.5\\leq z\\leq0.75)$. The quantitative measures are highly consistent with the two phase formation scenario of massive nearby early type galaxies as suggested by various authors and resolves the conflict raised in a previous work sugges...

  6. Limiting racemization and aspartimide formation in microwave-enhanced Fmoc solid phase peptide synthesis.

    Science.gov (United States)

    Palasek, Stacey A; Cox, Zachary J; Collins, Jonathan M

    2007-03-01

    Microwave energy represents an efficient manner to accelerate both the deprotection and coupling reactions in 9-fluorenylmethyloxycarbonyl (Fmoc) solid phase peptide synthesis (SPPS). Typical SPPS side reactions including racemization and aspartimide formation can occur with microwave energy but can easily be controlled by routine use of optimized methods. Cysteine, histidine, and aspartic acid were susceptible to racemization during microwave SPPS of a model 20mer peptide containing all 20 natural amino acids. Lowering the microwave coupling temperature from 80 degrees C to 50 degrees C limited racemization of histidine and cysteine. Additionally, coupling of both histidine and cysteine can be performed conventionally while the rest of the peptide is synthesized using microwave without any deleterious effect, as racemization during the coupling reaction was limited to the activated ester state of the amino acids up to 80 degrees C. Use of the hindered amine, collidine, in the coupling reaction also minimized formation of D-cysteine. Aspartimide formation and subsequent racemization of aspartic acid was reduced by the addition of HOBt to the deprotection solution and/or use of piperazine in place of piperidine.

  7. Gas Phase Reactions of Ions Derived from Anionic Uranyl Formate and Uranyl Acetate Complexes

    Science.gov (United States)

    Perez, Evan; Hanley, Cassandra; Koehler, Stephen; Pestok, Jordan; Polonsky, Nevo; Van Stipdonk, Michael

    2016-12-01

    The speciation and reactivity of uranium are topics of sustained interest because of their importance to the development of nuclear fuel processing methods, and a more complete understanding of the factors that govern the mobility and fate of the element in the environment. Tandem mass spectrometry can be used to examine the intrinsic reactivity (i.e., free from influence of solvent and other condensed phase effects) of a wide range of metal ion complexes in a species-specific fashion. Here, electrospray ionization, collision-induced dissociation, and gas-phase ion-molecule reactions were used to create and characterize ions derived from precursors composed of uranyl cation (UVIO2 2+) coordinated by formate or acetate ligands. Anionic complexes containing UVIO2 2+ and formate ligands fragment by decarboxylation and elimination of CH2=O, ultimately to produce an oxo-hydride species [UVIO2(O)(H)]-. Cationic species ultimately dissociate to make [UVIO2(OH)]+. Anionic complexes containing acetate ligands exhibit an initial loss of acetyloxyl radical, CH3CO2•, with associated reduction of uranyl to UVO2 +. Subsequent CID steps cause elimination of CO2 and CH4, ultimately to produce [UVO2(O)]-. Loss of CH4 occurs by an intra-complex H+ transfer process that leaves UVO2 + coordinated by acetate and acetate enolate ligands. A subsequent dissociation step causes elimination of CH2=C=O to leave [UVO2(O)]-. Elimination of CH4 is also observed as a result of hydrolysis caused by ion-molecule reaction with H2O. The reactions of other anionic species with gas-phase H2O create hydroxyl products, presumably through the elimination of H2.

  8. EFFECT OF Nb ELEMENT CONTENT IN U-Zr ALLOY ON HARDNESS, MICROSTRUCTURE AND PHASE FORMATION

    Directory of Open Access Journals (Sweden)

    Masrukan Masrukan

    2015-07-01

    Full Text Available EFFECT OF Nb ELEMENT CONTENT IN U-Zr-Nb ALLOY ON HARDNESS, MICROSTRUCTURE AND PHASE FORMATION. Experiments to determine the effect of Nb element in the U-Zr alloys on hardness, microstructure and phase formation has been done. The addition of Nb element would effect the hardness, microstructure and phase which formed. The U-Zr-Nb alloy was made with the variation of Nb 2%, 5% and 8% by melting in an electric arc melting furnace that equipped with water cooling and the argon atmosphere. The U-Zr-Nb alloy to be cut divided to some testing, such as hardness test, microstructure, and phase analysis. Hardness testing was done by Vickers hardness testing equipment, microstructure by an optical microscope, and diffraction pattern by XRD and phase analysis was done by GSAS. Hardness testing results showed that the addition of 2% to 5% Nb element in U-Zr alloys will increased in hardness, but the addition of Nb element over 5% the hardness was decreased. Observations the microstructure showed that the addition of 2% to 5%Nb element, grains were formed from fine into coarse. Phase analysis for diffraction pattern showed that the phase changed from αU and γU (Zr,Nbat 2% Nb to be αU, γU (Zr,Nb and δ1 (UZr2 phase at 5% and 8% Nb. Phase changes was followed by changes in its compositions. The composition of αU at 2% Nb was 40% increased to 81% at 5% Nb and decreased to 3.9% at 8% Nb. The composition of γU decreased from 59,86% to 14,91% with increased Nb from 2% to 5% and further increased to 52,74% at 8% Nb.   PENGARUH KADAR UNSUR Nb PADA PADUAN U-Zr-Nb TERHADAP SIFAT MEKANIK, MIKROSTRUKTUR DAN PEMBENTUKAN FASA. Percobaan untuk mengtahui pengaruh kadar Nb pada paduan U-Zr-Nb terhadap sifat mekanik, mikrostruktur dan pembentukan fasa telah dilakukan. Penambahan unsur Nb diduga akan mempengaruhi sifat mekanik, mikrosruktur, ketahanan korosi dan fasa yang terbentuk. Penambahan unsur Nb ke dalam paduan U-Zr dimaksudkan untuk memperluas daerah fasa gamma

  9. Formation of liquid crystalline phases in aqueous suspensions of platelet-like tripalmitin nanoparticles

    Science.gov (United States)

    Schmiele, Martin; Gehrer, Simone; Westermann, Martin; Steiniger, Frank; Unruh, Tobias

    2014-06-01

    Suspensions of platelet-like shaped tripalmitin nanocrystals stabilized by the pure lecithin DLPC and the lecithin blend S100, respectively, have been studied by small-angle x-ray scattering (SAXS) and optical observation of their birefringence at different tripalmitin (PPP) concentrations φPPP. It could be demonstrated that the platelets of these potential drug delivery systems start to form a liquid crystalline phase already at pharmaceutically relevant concentrations φPPP of less than 10 wt. %. The details of this liquid crystalline phase are described here for the first time. As in a previous study [A. Illing et al., Pharm. Res. 21, 592 (2004)] some platelets are found to self-assemble into lamellar stacks above a critical tripalmitin concentration \\varphi _{PPP}^{st} of 4 wt. %. In this study another critical concentration \\varphi _{PPP}^{lc}≈ 7 wt. % for DLPC and \\varphi _{PPP}^{lc}≈ 9 wt. % for S100 stabilized dispersions, respectively, has been observed. \\varphi _{PPP}^{lc} describes the transition from a phase of randomly oriented stacked lamellae and remaining non-assembled individual platelets to a phase in which the stacks and non-assembled platelets exhibit an overall preferred orientation. A careful analysis of the experimental data indicates that for concentrations above \\varphi _{PPP}^{lc} the stacked lamellae start to coalesce to rather small liquid crystalline domains of nematically ordered stacks. These liquid crystalline domains can be individually very differently oriented but possess an overall preferred orientation over macroscopic length scales which becomes successively more expressed when further increasing φPPP. The lower critical concentration for the formation of liquid crystalline domains of the DLPC-stabilized suspension compared to \\varphi _{PPP}^{lc} of the S100-stabilized suspension can be explained by a larger aspect ratio of the corresponding tripalmitin platelets. A geometrical model based on the excluded volumes of

  10. Band gap effects of hexagonal boron nitride using oxygen plasma

    Energy Technology Data Exchange (ETDEWEB)

    Sevak Singh, Ram; Leong Chow, Wai [School of Electrical and Electronic Engineering, Nanyang Technological University, 50 Nanyang Avenue, Singapore 639798 (Singapore); Yingjie Tay, Roland [School of Electrical and Electronic Engineering, Nanyang Technological University, 50 Nanyang Avenue, Singapore 639798 (Singapore); Temasek Laboratories-NTU, 50 Nanyang Avenue, Singapore 639798 (Singapore); Hon Tsang, Siu [Temasek Laboratories-NTU, 50 Nanyang Avenue, Singapore 639798 (Singapore); Mallick, Govind [Temasek Laboratories-NTU, 50 Nanyang Avenue, Singapore 639798 (Singapore); Weapons and Materials Research Directorate, U.S. Army Research Laboratory, Aberdeen Proving Ground, Maryland 21005 (United States); Tong Teo, Edwin Hang, E-mail: htteo@ntu.edu.sg [School of Electrical and Electronic Engineering, Nanyang Technological University, 50 Nanyang Avenue, Singapore 639798 (Singapore); School of Materials Science and Engineering, Nanyang Technological University, 50 Nanyang Avenue, Singapore 639798 (Singapore)

    2014-04-21

    Tuning of band gap of hexagonal boron nitride (h-BN) has been a challenging problem due to its inherent chemical stability and inertness. In this work, we report the changes in band gaps in a few layers of chemical vapor deposition processed as-grown h-BN using a simple oxygen plasma treatment. Optical absorption spectra show a trend of band gap narrowing monotonically from 6 eV of pristine h-BN to 4.31 eV when exposed to oxygen plasma for 12 s. The narrowing of band gap causes the reduction in electrical resistance by ∼100 fold. The x-ray photoelectron spectroscopy results of plasma treated hexagonal boron nitride surface show the predominant doping of oxygen for the nitrogen vacancy. Energy sub-band formations inside the band gap of h-BN, due to the incorporation of oxygen dopants, cause a red shift in absorption edge corresponding to the band gap narrowing.

  11. Axion field and the quark nugget's formation at the QCD phase transition

    CERN Document Server

    Liang, Xunyu

    2016-01-01

    We study a testable dark matter (DM) model outside of the standard WIMP paradigm in which the observed ratio $\\Omega_{\\rm dark} \\simeq \\Omega_{\\rm visible}$ for visible and dark matter densities finds its natural explanation as a result of their common QCD origin when both types of matter (DM and visible) are formed at the QCD phase transition and both are proportional to $\\Lambda_{\\rm QCD}$. Instead of conventional "baryogenesis" mechanism we advocate a paradigm when the "baryogenesis" is actually a charge separation process which always occur in the presence of the $\\cal{CP}$ odd axion field $a(x)$. In this scenario the global baryon number of the Universe remains zero, while the unobserved anti-baryon charge is hidden in form of heavy nuggets, similar to Witten's strangelets and compromise the DM of the Universe. We argue that the nuggets will be inevitably produced during the QCD phase transition as a result of Kibble-Zurek mechanism on formation of the topological defects during a phase transition. Relev...

  12. Dune formation in dilute phase pneumatic transport system: PIV & PTV based analysis

    Science.gov (United States)

    Jhalani, Sumit; Patankar, Atharva; Makawana, Ajay; Bose, Manaswita

    2017-06-01

    Flow of gas-solid mixture through horizontal conveying section show a large variety of phenomena and is broadly classified into dilute and dense unstable regimes. Different types of instabilities are observed in the dense phase flow and are widely studied in literature; however, clustering instabilities are observed in the very dilute regime of flow with volume fraction 0.001. A recent study has shown that regular, stable dune shaped clusters are formed in a small regime of the dilute phase of conveying. The dunes become unstable as the superficial gas velocity is decreased before it finally leads to the dense mode of conveying. The motivation of the current work is to investigate the velocity distribution on the surface of the stable and unstable dunes and thereby understand the cause behind the formation of the dunes in the conveying section. To that end, particle image and tracking velocimetry techniques are employed with the specific objective to determine the volume fraction and the velocity profile of the solid phase on the stable dune surface. A drastic change in the solid fraction within a few particle diameters from the dune surface suggests that PTV is more appropriate in the bulk whereas PIV is suitable for near surface investigation.

  13. Fluctuations, conformational asymmetry and block copolymer phase behaviour

    DEFF Research Database (Denmark)

    Bates, F.S.; Schulz, M.F.; Khandpur, A.K.;

    1994-01-01

    Phase behaviour near the order-disorder transition (ODT) of 58 model hydrocarbon diblock copolymers, representing four different systems, is summarized. Six distinct ordered-state microstructures are reported, including hexagonally modulated lamellae (HML), hexagonally perforated layers (HPL) and...

  14. Vortex solitons at the interface separating square and hexagonal lattices

    Energy Technology Data Exchange (ETDEWEB)

    Jović Savić, Dragana, E-mail: jovic@ipb.ac.rs; Piper, Aleksandra; Žikić, Radomir; Timotijević, Dejan

    2015-06-19

    Vortex solitons at the interface separating two different photonic lattices – square and hexagonal – are demonstrated numerically. We consider the conditions for the existence of discrete vortex states at such interfaces and develop a concise picture of different scenarios of the vortex solutions behavior. Various vortices with different size and topological charges are considered, as well as various lattice interfaces. A novel type of discrete vortex surface solitons in a form of five-lobe solution is observed. Besides stable three-lobe and six-lobe discrete surface modes propagating for long distances, we observe various oscillatory vortex surface solitons, as well as dynamical instabilities of different kinds of solutions and study their angular momentum. Dynamical instabilities occur for higher values of the propagation constant, or at higher beam powers. - Highlights: • We demonstrate vortex solitons at the square–hexagonal photonic lattice interface. • A novel type of five-lobe surface vortex solitons is observed. • Different phase structures of surface solutions are studied. • Orbital angular momentum transfer of such solutions is investigated.

  15. Asymptotic Analysis of Fiber-Reinforced Composites of Hexagonal Structure

    Science.gov (United States)

    Kalamkarov, Alexander L.; Andrianov, Igor V.; Pacheco, Pedro M. C. L.; Savi, Marcelo A.; Starushenko, Galina A.

    2016-08-01

    The fiber-reinforced composite materials with periodic cylindrical inclusions of a circular cross-section arranged in a hexagonal array are analyzed. The governing analytical relations of the thermal conductivity problem for such composites are obtained using the asymptotic homogenization method. The lubrication theory is applied for the asymptotic solution of the unit cell problems in the cases of inclusions of large and close to limit diameters, and for inclusions with high conductivity. The lubrication method is further generalized to the cases of finite values of the physical properties of inclusions, as well as for the cases of medium-sized inclusions. The analytical formulas for the effective coefficient of thermal conductivity of the fiber-reinforced composite materials of a hexagonal structure are derived in the cases of small conductivity of inclusions, as well as in the cases of extremely low conductivity of inclusions. The three-phase composite model (TPhM) is applied for solving the unit cell problems in the cases of the inclusions with small diameters, and the asymptotic analysis of the obtained solutions is performed for inclusions of small sizes. The obtained results are analyzed and illustrated graphically, and the limits of their applicability are evaluated. They are compared with the known numerical and asymptotic data in some particular cases, and very good agreement is demonstrated.

  16. X-ray Bragg magnifier microscope as a linear shift invariant imaging system: image formation and phase retrieval.

    Science.gov (United States)

    Vagovič, P; Svéda, L; Cecilia, A; Hamann, E; Pelliccia, D; Gimenez, E N; Korytár, D; Pavlov, K M; Zápražný, Z; Zuber, M; Koenig, T; Olbinado, M; Yashiro, W; Momose, A; Fiederle, M; Baumbach, T

    2014-09-01

    We present the theoretical description of the image formation with the in-line germanium Bragg Magnifier Microscope (BMM) and the first successful phase retrieval of X-ray holograms recorded with this imaging system. The conditions under which the BMM acts as a linear shift invariant system are theoretically explained and supported by the experiment. Such an approach simplifies the mathematical treatment of the image formation and reconstruction as complicated propagation of the wavefront onto inclined planes can be avoided. Quantitative phase retrieval is demonstrated using a test sample and a proof of concept phase imaging of a spider leg is also presented.

  17. The Study of Kinetics of Diffusion and Phase Formation in the Layered Iron-Beryllium System

    Science.gov (United States)

    Kuterbekov, K. A.; Nurkenov, S. A.; Kislitsin, S. B.; Kuketayev, T. A.; Nurakhmetov, T. N.

    2017-02-01

    The methods of Mössbauer spectroscopy with X-ray phase analysis and Rutherford backscattering of protons were used to study the kinetics of diffusion and phase transformations in the layered iron-beryllium system. For the first time, the authors suggested and implemented a method for retardation of diffusion and phase formation processes in the layered iron-beryllium system using the barrier layer. It was established that the barrier layer limits the zone of beryllium dissolution in the area of implanted layer. The impact of the barrier layer on kinetics of thermally induced processes of diffusion and phase transformations in the layered Fe-Be system was determined using the example of Fe (10 μm): O+ - Be (0.7 μm) - 57Fe (0.1 μm). The authors suggested and implemented a method for recovery of the distribution function of the admixture atom concentration in the solid matrix-admixture solution on the basis of the X-ray diffraction data. The kinetics of mutual diffusion was determined for Fe and Be atoms in the α-Fe(Be) solution for both sides of the layered systems with a barrier layer and without it using the suggested method for recovery of the distribution function of the Be atom concentration. It was established that for the system without a barrier layer, the share of iron atoms ends at tann 5 h on the coating side and at tann 7.5 h on the iron side, while for the barrier layer case - at tann 20 h on the coating side and at tann 40 h on the iron side.

  18. Axion field and the quark nugget's formation at the QCD phase transition

    Science.gov (United States)

    Liang, Xunyu; Zhitnitsky, Ariel

    2016-10-01

    We study a testable dark-matter (DM) model outside of the standard weakly interacting massive particle paradigm in which the observed ratio Ωdark≃Ωvisible for visible and dark-matter densities finds its natural explanation as a result of their common QCD origin when both types of matter (DM and visible) are formed at the QCD phase transition and both are proportional to ΛQCD. Instead of the conventional "baryogenesis" mechanism, we advocate a paradigm when the "baryogenesis" is actually a charge separation process which always occurs in the presence of the C P odd axion field a (x ). In this scenario, the global baryon number of the Universe remains zero, while the unobserved antibaryon charge is hidden in the form of heavy nuggets, similar to Witten's strangelets and compromise the DM of the Universe. In the present work, we study in great detail a possible formation mechanism of such macroscopically large heavy objects. We argue that the nuggets will be inevitably produced during the QCD phase transition as a result of Kibble-Zurek mechanism on formation of the topological defects during a phase transition. Relevant topological defects in our scenario are the closed bubbles made of the NDW=1 axion domain walls. These bubbles, in general, accrete the baryon (or antibaryon) charge, which eventually results in the formation of the nuggets and antinuggets carrying a huge baryon (antibaryon) charge. A typical size and the baryon charge of these macroscopically large objects are mainly determined by the axion mass ma. However, the main consequence of the model, Ωdark≈Ωvisible, is insensitive to the axion mass which may assume any value within the observationally allowed window 10-6 eV ≲ma≲10-3 eV . We also estimate the baryon-to-entropy ratio η ≡nB/nγ˜10-10 within this scenario. Finally, we comment on implications of these results to the axion search experiments, including the microwave cavity and the Orpheus experiments.

  19. Experimental investigations of hexagonal crimping die failure

    Directory of Open Access Journals (Sweden)

    Veera kumar M

    2016-06-01

    Full Text Available This paper deals with the hexagonal crimping die failure of high carbon high chromium steel material. The failure modes were initially revealed and identified by the visual examination. Then the chemical analysis and metallographic examination havebeen carried at different positions of the failure die surface using scanning electron microscope (SEM. The microstructure evaluation reveals that failure occurs due to undissolved austenitic structure resulting in improper transition duringheat treatment.

  20. Restudy of the unusual phase behavior of the mesogen-jacketed liquid crystal polymers

    Institute of Scientific and Technical Information of China (English)

    ZHAO; Yongfeng; FAN; Xinghe; CHEN; Xiaofang; WAN; Xinhua

    2006-01-01

    A series of poly{2,5-bis[(4-butoxyphenyl)-oxycarbonyl]styrenes} (PBPCS) with low molecular weight distribution was synthesized by atom transfer radical polymerization (ATRP). The mesomorphic properties were investigated by differential scanning calorimetry (DSC), polarizing optical microscopy (POM) and rheometer. PBPCS showed the phase transition from isotropic into liquid crystal (LC) phase, and the LC phase formed at high temperature and disappeared in the subsequent cooling procedure. Using the WAXD fiber pattern, the phase structure of the PBPCS at higher temperature showed hexagonal columnar nematic phase. Experimental results demonstrated that the driving force of the entropy is an important factor during the unusual LC phase formation of PBPCS.

  1. Template-assisted mineral formation via an amorphous liquid phase precursor route

    Science.gov (United States)

    Amos, Fairland F.

    The search for alternative routes to synthesize inorganic materials has led to the biomimetic route of producing ceramics. In this method, materials are manufactured at ambient temperatures and in aqueous solutions with soluble additives and insoluble matrix, similar to the biological strategy for the formation of minerals by living organisms. Using this approach, an anionic polypeptide additive was used to induce an amorphous liquid-phase precursor to either calcium carbonate or calcium phosphate. This precursor was then templated on either organic or inorganic substrates. Non-equilibrium morphologies, such as two-dimensional calcium carbonate films, one-dimensional calcium carbonate mesostructures and "molten" calcium phosphate spherulites were produced, which are not typical of the traditional (additive-free) solution grown crystals in the laboratory. In the study of calcium carbonate, the amorphous calcium carbonate mineral formed via the liquid-phase precursor, either underwent a dissolution-recrystallization event or a pseudo-solid-state transformation to produce different morphologies and polymorphs of the mineral. Discrete or aggregate calcite crystals were formed via the dissolution of the amorphous phase to allow the reprecipitation of the stable crystal. Non-equilibrium morphologies, e.g., films, mesotubules and mesowires were templated using organic and inorganic substrates and compartments. These structures were generated via an amorphous solid to crystalline solid transformation. Single crystalline tablets and mesowires of aragonite, which are reported to be found only in nature as skeletal structures of marine organisms, such as mollusk nacre and echinoderm teeth, were successfully synthesized. These biomimetic structures were grown via the polymer-induced liquid-phase precursor route in the presence of magnesium. Only low magnesium-bearing calcite was formed in the absence of the polymer. A similar approach of using a polymeric additive was

  2. Study of structural transformations and phases formation upon calcination of Zn–Ni–Al hydrotalcite nanosheets

    Indian Academy of Sciences (India)

    Zhanshuang Li; Yanchao Song; Jun Wang; Qi Liu; Piaoping Yang; Milin Zhang

    2011-04-01

    In this paper, we describe a general process for the synthesis of highly crystalline Zn–Ni–Al hydrotalcitelike materials. The structure and thermal decomposition of the prepared samples are studied by XRD, FT–IR, TG–DSC, SEM, TEM and N2 adsorption/desorption. The morphology of large-sized, porous and hexagonal platelike Zn–Ni–Al hydrotalcite is affected by calcination temperature. BET specific surface area and pore volume are observed to increase with increase of the calcination temperature up to 700°C followed by a further decrease with increasing temperature.

  3. Template free-solvothermaly synthesized copper selenide (CuSe, Cu 2- xSe, β-Cu 2Se and Cu 2Se) hexagonal nanoplates from different precursors at low temperature

    Science.gov (United States)

    Kumar, Pushpendra; Singh, Kedar; Srivastava, O. N.

    2010-09-01

    Nonstoichiometric (Cu 2- xSe) and stoichiometric (CuSe, β-Cu 2Se and Cu 2Se) copper selenide hexagonal nanoplates have been synthesized using different general and convenient copper sources, e.g. copper chloride, copper sulphate, copper nitrate, copper acetate, elemental copper with elemental selenium, friendly ethylene glycol and hydrazine hydrate in a defined amount of water at 100 °C within 12 h adopting the solvothermal method. Phase analysis, purity and morphology of the product have been well studied by X-ray diffraction (XRD), field emission scanning electron microscopy (FESEM), transmission electron microscopy (TEM), high resolution transmission electron microscopy (HRTEM) and energy dispersive X-ray diffraction (EDAX) techniques. The structural and compositional analysis revealed that the products were of pure phase with corresponding atomic ratios. SEM, TEM and HRTEM analyses revealed that the nanoplates were in the range 200-450 nm and the as-prepared products were uniform and highly crystallized. The nanoplates consisted of {0 0 1} facets of top-bottom surfaces and {1 1 0} facets of the other six side surfaces. This new approach encompasses many advantages over the conventional solvothermal method in terms of product quality (better morphology control with high yield) and reaction conditions (lower temperatures). Copper selenide hexagonal nanoplates obtained by the described method could be potential building blocks to construct functional devices and solar cell. This work may open up a new rationale on designing the solution synthesis of nanostructures for materials possessing similar intrinsic crystal symmetry. On the basis of the carefully controlled experiments mentioned herein, a plausible formation mechanism of the hexagonal nanoplates was suggested and discussed. To the best of our knowledge, this is the first report on nonstoichiometric (Cu 2- xSe) as well as stoichiometric (CuSe, β-Cu 2Se and Cu 2Se) copper selenide hexagonal nanoplates with

  4. Solvation Dynamics in Different Phases of the Lyotropic Liquid Crystalline System.

    Science.gov (United States)

    Roy, Bibhisan; Satpathi, Sagar; Gavvala, Krishna; Koninti, Raj Kumar; Hazra, Partha

    2015-09-03

    Reverse hexagonal (HII) liquid crystalline material based on glycerol monooleate (GMO) is considered as a potential carrier for drugs and other important biomolecules due to its thermotropic phase change and excellent morphology. In this work, the dynamics of encapsulated water, which plays important role in stabilization and formation of reverse hexagonal mesophase, has been investigated by time dependent Stokes shift method using Coumarin-343 as a solvation probe. The formation of the reverse hexagonal mesophase (HII) and transformation to the L2 phase have been monitored using small-angle X-ray scattering and polarized light microscopy experiments. REES studies suggest the existence of different polar regions in both HII and L2 systems. The solvation dynamics study inside the reverse hexagonal (HII) phase reveals the existence of two different types of water molecules exhibiting dynamics on a 120-900 ps time scale. The estimated diffusion coefficients of both types of water molecules obtained from the observed dynamics are in good agreement with the measured diffusion coefficient collected from the NMR study. The calculated activation energy is found to be 2.05 kcal/mol, which is associated with coupled rotational-translational water relaxation dynamics upon the transition from "bound" to "quasi-free" state. The observed ∼2 ns faster dynamics of the L2 phase compared to the HII phase may be associated with both the phase transformation as well as thermotropic effect on the relaxation process. Microviscosities calculated from time-resolved anisotropy studies infer that the interface is almost ∼22 times higher viscous than the central part of the cylinder. Overall, our results reveal the unique dynamical features of water inside the cylinder of reverse hexagonal and inverse micellar phases.

  5. Exploring Systematic Effects in the Relation Between Stellar Mass, Gas Phase Metallicity, and Star Formation Rate

    CERN Document Server

    Telford, O Grace; Skillman, Evan D; Conroy, Charlie

    2016-01-01

    There is evidence that the well-established mass-metallicity relation in galaxies is correlated with a third parameter: star formation rate (SFR). The strength of this correlation may be used to disentangle the relative importance of different physical processes (e.g., infall of pristine gas, metal-enriched outflows) in governing chemical evolution. However, all three parameters are susceptible to biases that might affect the observed strength of the relation between them. We analyze possible sources of systematic error, including sample bias, application of S/N cuts on emission lines, choice of metallicity calibration, uncertainty in stellar mass determination, aperture effects, and dust. We present the first analysis of the relation between stellar mass, gas phase metallicity, and SFR using strong line abundance diagnostics from Dopita et al. (2013) for ~130,000 star-forming galaxies in the Sloan Digital Sky Survey and provide a detailed comparison of these diagnostics in an appendix. Using these abundance ...

  6. Laser-driven formation of a high-pressure phase in amorphous silica

    Energy Technology Data Exchange (ETDEWEB)

    Salleo, Alberto; Taylor, Seth T.; Martin, Michael C.; Panero, Wendy R.; Jeanloz, Raymond; Genin, Francois Y.; Sands, Timothy

    2002-05-31

    A combination of electron diffraction and infrared reflectance measurements shows that synthetic silica transforms partially into stishovite under high-intensity (GW/cm2) laser irradiation, probably by the formation of a dense ionized plasma above the silica surface. During the transformation the silicon coordination changes from four-fold to six-fold and the silicon-oxygen bond changes from mostly covalent to mostly ionic, such that optical properties of the transformed material differ significantly from those of the original glass. This phase transformation offers one suitable mechanism by which laser-induced damage grows catastrophically once initiated, thereby dramatically shortening the service lifetime of optics used for high-power photonics applications such as inertial confinement fusion.

  7. Anisotropic Hexagonal Boron Nitride Nanomaterials - Synthesis and Applications

    Energy Technology Data Exchange (ETDEWEB)

    Han,W.Q.

    2008-08-01

    Boron nitride (BN) is a synthetic binary compound located between III and V group elements in the Periodic Table. However, its properties, in terms of polymorphism and mechanical characteristics, are rather close to those of carbon compared with other III-V compounds, such as gallium nitride. BN crystallizes into a layered or a tetrahedrally linked structure, like those of graphite and diamond, respectively, depending on the conditions of its preparation, especially the pressure applied. Such correspondence between BN and carbon readily can be understood from their isoelectronic structures [1, 2]. On the other hand, in contrast to graphite, layered BN is transparent and is an insulator. This material has attracted great interest because, similar to carbon, it exists in various polymorphic forms exhibiting very different properties; however, these forms do not correspond strictly to those of carbon. Crystallographically, BN is classified into four polymorphic forms: Hexagonal BN (h-BN) (Figure 1(b)); rhombohedral BN (r-BN); cubic BN (c-BN); and wurtzite BN (w-BN). BN does not occur in nature. In 1842, Balmain [3] obtained BN as a reaction product between molten boric oxide and potassium cyanide under atmospheric pressure. Thereafter, many methods for its synthesis were reported. h-BN and r-BN are formed under ambient pressure. c-BN is synthesized from h-BN under high pressure at high temperature while w-BN is prepared from h-BN under high pressure at room temperature [1]. Each BN layer consists of stacks of hexagonal plate-like units of boron and nitrogen atoms linked by SP{sup 2} hybridized orbits and held together mainly by Van der Waals force (Fig 1(b)). The hexagonal polymorph has two-layered repeating units: AA'AA'... that differ from those in graphite: ABAB... (Figure 1(a)). Within the layers of h-BN there is coincidence between the same phases of the hexagons, although the boron atoms and nitrogen atoms are alternatively located along the c

  8. Factors influencing ice formation and growth in simulations of a mixed-phase wave cloud

    Directory of Open Access Journals (Sweden)

    C. Dearden

    2012-10-01

    Full Text Available In this paper, numerical simulations of an orographically induced wave cloud sampled in-situ during the ICE-L (Ice in Clouds Experiment - Layer clouds field campaign are performed and compared directly against the available observations along various straight and level flight paths. The simulations are based on a detailed mixed-phase bin microphysics model embedded within a 1-D column framework with the latest parameterizations for heterogeneous ice nucleation and an adaptive treatment of ice crystal growth based on the evolution of crystal habit. The study focuses on the second of two clouds sampled on 16th November 2007, the in-situ data from which exhibits some interesting and more complex microphysics than other flights from the campaign. The model is used to demonstrate the importance of both heterogeneous and homogeneous nucleation in explaining the in-situ observations of ice crystal concentration and habit, and how the ability to isolate the influence of both nucleation mechanisms helps when quantifying active IN concentrations. The aspect ratio and density of the simulated ice crystals is shown to evolve in a manner consistent with the in-situ observations along the flight track, particularly during the transition from the mixed-phase region of the cloud to the ice tail dominated by homogeneous nucleation. Some additional model runs are also performed to explore how changes in IN concentration and the value of the deposition coefficient for ice affect the competition between heterogeneous and homogeneous ice formation in the wave cloud, where the Factorial Method is used to isolate and quantify the effect of such non-linear interactions. The findings from this analysis show that the effect on homogeneous freezing rates is small, suggesting that any competition between the microphysical variables is largely overshadowed by the strong dynamical forcing of the cloud in the early stages of ice formation.

  9. Phase-field modeling of microstructural pattern formation during directional solidification of peritectic alloys without morphological instability.

    Science.gov (United States)

    Lo, T S; Karma, A; Plapp, M

    2001-03-01

    During the directional solidification of peritectic alloys, two stable solid phases (parent and peritectic) grow competitively into a metastable liquid phase of larger impurity content than either solid phase. When the parent or both solid phases are morphologically unstable, i.e., for a small temperature gradient/growth rate ratio (G/v(p)), one solid phase usually outgrows and covers the other phase, leading to a cellular-dendritic array structure closely analogous to the one formed during monophase solidification of a dilute binary alloy. In contrast, when G/v(p) is large enough for both phases to be morphologically stable, the formation of the microstructure becomes controlled by a subtle interplay between the nucleation and growth of the two solid phases. The structures that have been observed in this regime (in small samples where convection effects are suppressed) include alternate layers (bands) of the parent and peritectic phases perpendicular to the growth direction, which are formed by alternate nucleation and lateral spreading of one phase onto the other as proposed in a recent model [R. Trivedi, Metall. Mater. Trans. A 26, 1 (1995)], as well as partially filled bands (islands), where the peritectic phase does not fully cover the parent phase which grows continuously. We develop a phase-field model of peritectic solidification that incorporates nucleation processes in order to explore the formation of these structures. Simulations of this model shed light on the morphology transition from islands to bands, the dynamics of spreading of the peritectic phase on the parent phase following nucleation, which turns out to be characterized by a remarkably constant acceleration, and the types of growth morphology that one might expect to observe in large samples under purely diffusive growth conditions.

  10. Prebiotic molecules formation through the gas-phase reaction between HNO and CH2CHOH2+

    Science.gov (United States)

    Redondo, Pilar; Martínez, Henar; Largo, Antonio; Barrientos, Carmen

    2017-07-01

    Context. Knowing how the molecules that are present in the ISM can evolve to more complex ones is an interesting topic in interstellar chemistry. The study of possible reactions between detected species can help to understand the evolution in complexity of the interstellar matter and also allows knowing the formation of new molecules which could be candidates to be detected. We focus our attention on two molecules detected in space, vinyl alcohol (CH2CHOH) and azanone (HNO). Aims: We aim to carry out a theoretical study of the ion-molecule reaction between protonated vinyl alcohol and azanone. The viability of formation of complex organic molecules (COMs) from these reactants is expected to provide some insight into the formation of prebiotic species through gas phase reactions. Methods: The reaction of protonated vinyl alcohol with azanone has been theoretically studied by using ab initio methods. Stationary points on the potential energy surface (PES) were characterized at the second-order Moller-Plesset level in conjunction with the aug-cc-pVTZ (correlation-consistent polarized valence triple-zeta) basis set. In addition, the electronic energies were refined by means of single-point calculations at the CCSD(T) level (coupled cluster single and double excitation model augmented with a non-iterative treatment of triple excitations) with the same basis set. Results: From a thermodynamic point of view, twelve products, composed of carbon, oxygen, nitrogen, and hydrogen which could be precursors in the formation of more complex biological molecules, can be obtained from this reaction. Among these, we focus especially on ionized glycine and two of its isomers. The analysis of the PES shows that only formation of cis- and trans-O-protonated imine acetaldehyde, CH2NHCOH+ and, CHNHCHOH+, are viable under interstellar conditions. Conclusions: The reaction of protonated vinyl alcohol with azanone can evolve in the interstellar medium to more complex organic molecules of

  11. Unveiling the Role of CNTs on the Phase Formation of 1D Ferroelectrics

    KAUST Repository

    Mahajan, Amit

    2015-05-21

    Carbon nanotubes (CNTs) have the potential to act as templates or bottom electrodes for three dimension (3D) capacitor arrays, which utilise one dimension (1D) ferroelectric nanostructures to increase memory size and density. However, growing a ferroelectric on the surface of CNTs is non-trivial. Here, we demonstrate that multi-walled (MW) CNTs decrease the time and temperature for formation of lead zirconium titanate Pb(Zr1-xTix)O3 (PZT) by ~100 ºC commensurate with a decrease in activation energy from 68±15 kJ/mol to 27±2 kJ/mol. As a consequence, monophasic PZT was obtained at 575 ºC for MWCNTs/PZT whereas for pure PZT traces of pyrochlore were still present at 650 ºC, where PZT phase formed due to homogeneous nucleation. The piezoelectric nature of MWCNT/PZT synthesised at 500 ºC for 1 h was proved. Although further work is required to prove the concept of 3D capacitor arrays, our result suggests that it is feasible to utilise MWCNTs as templates/electrodes for the formation of 1D PZT nano ferroelectrics.

  12. Austenite phase formation in rapidly solidified Fe-Cr-Mn-C steels

    Energy Technology Data Exchange (ETDEWEB)

    Chen, S.R.; Davies, H.A.; Rainforth, W.M.

    1999-12-10

    Steels having compositions (wt%) 0.05--0.5C, 12.5--20Cr, 8--25Mn and 0--0.51N have been chill-block melt-spun to ribbons in order to investigate systematically, by X-ray diffractometry and electron microscopy, the effects of rapid solidification and of solute concentrations on the formation of the austenite phase. The austenite is most easily formed at (wt%) 16Cr--8Mn for 0.3C ribbons while {alpha}{prime}-martensite or {epsilon}-martensite was observed at lower concentrations of Cr or Mn and {alpha}-ferrite appeared for Cr {gt} 18 wt%. The volume fraction of austenite in the steel ribbons studied was found, by multiple regression analysis, to obey the equation {gamma}(%) = 94 + 26.8C + Mn x (8.4 {minus} 0.08Mn {minus} 0.44Cr) {minus} (Cr {minus} 17.7){sup 2}. Thus, the effect of Mn on {gamma} formation followed a non-linear function, containing an interaction term including the Cr and Mn contents, and first- and second-order terms involving the Mn concentration. This indicates the ranges over when Mn is a {gamma}-former or an {alpha}-former. Iso-austenitic lines, constructed on the basis of this new equation, are nearly orthogonal to those in the Schaeffler diagram for Cr-Mn steels so that use of the latter for prediction of the austenite content in the present case would be inappropriate.

  13. Analytical model of chemical phase and formation of DSB in chromosomes by ionizing radiation.

    Science.gov (United States)

    Barilla, Jiří; Lokajíček, Miloš; Pisaková, Hana; Simr, Pavel

    2013-03-01

    Mathematical analytical model of the processes running in individual radical clusters during the chemical phase (under the presence of radiomodifiers) proposed by us earlier has been further developed and improved. It has been applied to the data presented by Blok and Loman characterizing the oxygen effect in SSB and DSB formation (in water solution and at low-LET radiation) also in the region of very small oxygen concentrations, which cannot be studied with the help of experiments done with living cells. In this new analysis the values of all reaction rates and diffusion parameters known from literature have been made use of. The great increase of SSB and DSB at zero oxygen concentration may follow from the fact that at small oxygen concentrations the oxygen absorbs other radicals while at higher concentrations the formation of oxygen radicals prevails. It explains the double oxygen effect found already earlier by Ewing. The model may be easily extended to include also the effects of other radiomodifiers present in medium during irradiation.

  14. Formation mechanism of gas bubble superlattice in UMo metal fuels: Phase-field modeling investigation

    Science.gov (United States)

    Hu, Shenyang; Burkes, Douglas E.; Lavender, Curt A.; Senor, David J.; Setyawan, Wahyu; Xu, Zhijie

    2016-10-01

    Nano-gas bubble superlattices are often observed in irradiated UMo nuclear fuels. However, the formation mechanism of gas bubble superlattices is not well understood. A number of physical processes may affect the gas bubble nucleation and growth; hence, the morphology of gas bubble microstructures including size and spatial distributions. In this work, a phase-field model integrating a first-passage Monte Carlo method to investigate the formation mechanism of gas bubble superlattices was developed. Six physical processes are taken into account in the model: 1) heterogeneous generation of gas atoms, vacancies, and interstitials informed from atomistic simulations; 2) one-dimensional (1-D) migration of interstitials; 3) irradiation-induced dissolution of gas atoms; 4) recombination between vacancies and interstitials; 5) elastic interaction; and 6) heterogeneous nucleation of gas bubbles. We found that the elastic interaction doesn't cause the gas bubble alignment, and fast 1-D migration of interstitials along directions in the body-centered cubic U matrix causes the gas bubble alignment along directions. It implies that 1-D interstitial migration along [110] direction should be the primary mechanism of a fcc gas bubble superlattice which is observed in bcc UMo alloys. Simulations also show that fission rates, saturated gas concentration, and elastic interaction all affect the morphology of gas bubble microstructures.

  15. Primordial black hole formation in the matter-dominated phase of the Universe

    CERN Document Server

    Harada, Tomohiro; Kohri, Kazunori; Nakao, Ken-ichi; Jhingan, Sanjay

    2016-01-01

    We investigate primordial black hole formation in the matter-dominated phase of the Universe, where nonspherical effects in gravitational collapse play a crucial role. This is in contrast to the black hole formation in a radiation-dominated era. We apply the Zel'dovich approximation, Thorne's hoop conjecture, and Doroshkevich's probability distribution and subsequently derive the production probability $\\beta_{0}$ of primordial black holes. The numerical result obtained is applicable even if the density fluctuation $\\sigma$ at horizon entry is of the order of unity. For $\\sigma\\ll 1$, we find a semi-analytic formula $\\beta_{0}\\simeq 0.05556 \\sigma^{5}$, which is comparable with the Khlopov-Polnarev formula. We find that the production probability in the matter-dominated era is much larger than that in the radiation-dominated era for $\\sigma\\lesssim 0.05$, while they are comparable with each other for $\\sigma\\gtrsim 0.05$. We also discuss how $\\sigma$ can be written in terms of primordial curvature perturbatio...

  16. Influence of powder pre-annealing on the phase formation and critical current of Bi-2223/Ag tapes

    DEFF Research Database (Denmark)

    Chen, X.P.; Grivel, Jean-Claude; Li, M.Y.;

    2004-01-01

    the precursor with Ca2PbO4 phase (tape T1) had lower transformation rate of 2223 phase than tapes fabricated using the precursor with 3321 phase (tape T2). SEM results show that a large fraction of secondary phases with big particle size was formed in the tape T1 during the subsequent sintering, which might......The influence of precursor powders with different lead-rich phases, such as Ca2PbO4 and Pb-3(Sr,Bi)(3)Ca2CuOy (3 3 2 1), on the phase formation and critical current of Bi-2223/Ag tapes has been studied. Three precursors with different phase assemblages were prepared and used to make the tapes...

  17. Microtwin formation in the {alpha} phase of duplex titanium alloys affected by strain rate

    Energy Technology Data Exchange (ETDEWEB)

    Lin, Yi-Hsiang; Wu, Shu-Ming [Department of Mechanical and Mechatronic Engineering, National Taiwan Ocean University, No. 2 Pei Ning Road, Keelung 20224, Taiwan (China); Kao, Fang-Hsin [Department of Materials Science and Engineering, National Taiwan University, Taipei 10617, Taiwan (China); Wang, Shing-Hoa, E-mail: shwang@ntou.edu.tw [Department of Mechanical and Mechatronic Engineering, National Taiwan Ocean University, No. 2 Pei Ning Road, Keelung 20224, Taiwan (China); Yang, Jer-Ren [Department of Materials Science and Engineering, National Taiwan University, Taipei 10617, Taiwan (China); Yang, Chia-Chih [Department of Mechanical and Mechatronic Engineering, National Taiwan Ocean University, No. 2 Pei Ning Road, Keelung 20224, Taiwan (China); Chiou, Chuan-Sheng [Department of Mechanical Engineering, Yuan Ze University, Taoyuan 32003, Taiwan (China)

    2011-03-15

    Research highlights: {yields} The long and dense twins in {alpha} phase of SP700 alloy occurring at lower strain rates promote a good ductility. {yields} The deformation in SP700 alloy changed to micro twins-controlled mechanism in {alpha} as the strain rate decreases. {yields} The material has time to redistribute the deformed strain between {alpha} and {beta} as the strain rate decreases. - Abstract: The effect of tensile strain rate on deformation microstructure was investigated in Ti-6-4 (Ti-6Al-4V) and SP700 (Ti-4.5Al-3V-2Mo-2Fe) of the duplex titanium alloys. Below a strain rate of 10{sup -2} s{sup -1}, Ti-6-4 alloy had a higher ultimate tensile strength than SP700 alloy. However, the yield strength of SP700 was consistently greater than Ti-6-4 at different strain rates. The ductility of SP700 alloy associated with twin formation (especially at the slow strain rate of 10{sup -4} s{sup -1}), always exceeded that of Ti-6-4 alloy at different strain rates. It is caused by a large quantity of deformation twins took place in the {alpha} phase of SP700 due to the lower stacking fault energy by the {beta} stabilizer of molybdenum alloying. In addition, the local deformation more was imposed on the {alpha} grains from the surrounding {beta}-rich grains by redistributing strain as the strain rate decreased in SP700 duplex alloy.

  18. Austenite formation during intercritical annealing in C-Mn cold-rolled dual phase steel

    Institute of Scientific and Technical Information of China (English)

    李声慈; 康永林; 朱国明; 邝霜

    2015-01-01

    Two different kinds of experimental techniques were used to in-situ study the austenite formation during intercritical annealing in C-Mn dual phase steel. The microstructure evolution was observed by confocal laser scanning microscope, and the austenite isothermal and non-isothermal transformation kinetics were studied by dilatometry. The results indicate that banded structure is produced for the reason of composition segregation and the competition between recrystallization and phase transformation. Austenite prefers to nucleate not only at ferrite/ferrite grain boundaries, but also inside the grains of ferrite. Furthermore, the austenitizing process is accomplished mainly via migration of the existing austenite/ferrite interface rather than nucleation of new grains. The incubation process can be divided into two stages which are controlled by carbon and manganese diffusion, respectively. During the incubation process, the nucleation rate of austenite decreases, and austenite growth changes from two-dimensional to one-dimensional. The partitioning coefficient, defined as the ratio of manganese content in the austenite to that in the adjacent ferrite, increases with increasing soaking time.

  19. Phase transformations, microstructure formation and in vitro osteoblast response in calcium silicate/brushite cement composites.

    Science.gov (United States)

    Sopcak, T; Medvecky, L; Giretova, M; Kovalcikova, A; Stulajterova, R; Durisin, J

    2016-08-10

    Self-setting simple calcium silicate/brushite (B) biocements with various Ca/P ratios were prepared by mutual mixing of both monocalcium silicate hydrate (CSH) or β-wollastonite (woll) powders with B and the addition of 2 wt% NaH2PO4 solution as a hardening liquid. The phase composition of the final composites and the texture of the surface calcium phosphate/silica layer were controlled by the starting Ca/P ratio in composites and the pH during setting. It was verified that the presence of continuous bone-like calcium phosphate coating on the surface of the samples was not essential for in vitro osteoblast proliferation. The nanocrystalline calcium deficient hydroxyapatite and amorphous silica were found as the main setting products in composite mixtures with a Ca/P ratio close to the region of the formation of deficient hydroxyapatite-like calcium phosphates. No CSH phase with a lower Ca/Si ratio was identified after transformation. The results confirmed a small effect of the monocalcium silicate addition on the compressive strength (CS) of cements up to 30 wt% (around 20-25 MPa) and a significant rise of the value in 50 woll/B cement (65 MPa). The final setting times of the cement composites varied between 5 and 43 min depending on the P/L ratio and the type of monocalcium silicate phase in the cement mixture. 10CSH/B and 50 woll/B cements with different textures but free of both the needle-like and perpendicularly-oriented hydroxyapatite particles on the surface of the samples had low cytotoxicity.

  20. Secondary organic aerosol (trans)formation through aqueous phase guaiacol photonitration: chemical characterization of the products

    Science.gov (United States)

    Grgić, Irena; Kitanovski, Zoran; Kroflič, Ana; Čusak, Alen

    2014-05-01

    One of the largest primary sources of organic aerosol in the atmosphere is biomass burning (BB) (Laskin et al. 2009); in Europe its contribution to annual mean of PM10 is between 3 and 14 % (Maenhaut et al. 2012). During the process of wood burning many different products are formed via thermal degradation of wood lignin. Hardwood burning produces mainly syringol (2,6-dimetoxyphenol) derivatives, while softwood burning exclusively guaiacol (2-methoxyphenol) and its derivatives. Taking into account physical properties of methoxyphenols only, their concentrations in atmospheric waters might be underestimated. So, their aqueous phase reactions can be an additional source of SOA, especially in regions under significant influence of wood combustion. An important class of compounds formed during physical and chemical aging of the primary BBA in the atmosphere is nitrocatechols, known as strong absorbers of UV and Vis light (Claeys et al. 2012). Very recently, methyl-nitrocatechols were proposed as suitable markers for highly oxidized secondary BBA (Iinuma et al. 2010, Kitanovski et al. 2012). In the present work, the formation of SOA through aqueous phase photooxidation and nitration of guaiacol was examined. The key objective was to chemically characterize the main low-volatility products and further to check their possible presence in the urban atmospheric aerosols. The aqueous phase reactions were performed in a thermostated reactor under simulated sunlight in the presence of H2O2 and nitrite. Guaiacol reaction products were first concentrated by solid-phase extraction (SPE) and then subjected to semi-preparative liquid chromatography.The main product compounds were fractionated and isolated as pure solids and their structure was further elucidated by using nuclear magnetic resonance spectroscopy (1H, 13C and 2D NMR) and direct infusion negative ion electro-spray ionization tandem mass spectrometry (( )ESI-MS/MS). The main photonitration products of guaiacol (4

  1. Method for exfoliation of hexagonal boron nitride

    Science.gov (United States)

    Lin, Yi (Inventor); Connell, John W. (Inventor)

    2012-01-01

    A new method is disclosed for the exfoliation of hexagonal boron nitride into mono- and few-layered nanosheets (or nanoplatelets, nanomesh, nanoribbons). The method does not necessarily require high temperature or vacuum, but uses commercially available h-BN powders (or those derived from these materials, bulk crystals) and only requires wet chemical processing. The method is facile, cost efficient, and scalable. The resultant exfoliated h-BN is dispersible in an organic solvent or water thus amenable for solution processing for unique microelectronic or composite applications.

  2. Diagonal form factors and hexagon form factors

    Energy Technology Data Exchange (ETDEWEB)

    Jiang, Yunfeng [Institute for Theoretical Physics, ETH Zürich,Honggerberg, Zürich, 8093 (Switzerland); Petrovskii, Andrei [Institut de Physique Théorique, CEA, URA 2306 CNRS Saclay,Gif-sur-Yvette, F91191 (France)

    2016-07-25

    We study the heavy-heavy-light (HHL) three-point functions in the planar N=4 super-Yang-Mills theory using the recently proposed hexagon bootstrap program http://arxiv.org/abs/1505.06745. We prove the conjecture of Bajnok, Janik and Wereszczynski http://dx.doi.org/10.1007/JHEP09(2014)050 on the polynomial L-dependence of HHL structure constant up to the leading finite-size corrections, where L is the length of the heavy operators. The proof is presented for a specific set-up but the method can be applied to more general situations.

  3. Thermodynamic Analysis of the Formation of In-situ Reinforced Phases In Cast AI-4.5Cu Alloy

    Institute of Scientific and Technical Information of China (English)

    LIANG Yanfeng; ZHOU Jing'en; DONG Shengquan; YANG Tong

    2008-01-01

    The thermodynamic analysis of the formation of in-situ reinforced phases in (TiB2+Al3Ti)/Al-4.5Cu composites prepared by mixed salts reaction was conducted, and heat changes of mixed salts system were analyzed by differential thermal analysis (DTA). The results show that although TiB2 possesses the strongest formation ability in Al-Ti-B ternary system, [Ti] is relatively excessive in the in-situ reaction and it combines with Al to form Al3Ti phase. The reinforced phases are TiB2 and Al3Ti in the produced composites due to the reaction taking place to form reinforced phase with the addition of mixed salts into Al-4.5Cu melt between 900℃ and 1032℃.

  4. Control of Y₂O₃ phase and its nanostructure formation through a very high energy mechanical milling

    Energy Technology Data Exchange (ETDEWEB)

    Lee, M.K., E-mail: leeminku@kaeri.re.kr [Nuclear Materials Development Division, Korea Atomic Energy Research Institute, P.O. Box 105, Yuseong, Daejeon 305-353 (Korea, Republic of); Park, E.K.; Park, J.J.; Rhee, C.K. [Nuclear Materials Development Division, Korea Atomic Energy Research Institute, P.O. Box 105, Yuseong, Daejeon 305-353 (Korea, Republic of)

    2013-05-01

    The formation behavior of Y₂O₃ ceramic particles was studied by employing a very high energy ball milling (milling energy: ~165 kJ/g·hit, milling speed: 1000 rpm). Both the XRD and HRTEM studies revealed that the high impact strain energy generated during the milling caused a drastic phase transition from the original C-type cubic (space group Ia3, a=10.58 Å) to the metastable B-type monoclinic (space group C2/m, a=13.89 Å), finally followed by a partial solid-state amorphization. The cubic phase was difficult to be reduced down to smaller than 10 nm, while the monoclinic phase was stabilized at sizes smaller than 10 nm with a mean crystallite size of 7.57 nm. Consequently, the existence of Y₂O₃ at a nanoscale smaller than 10 nm is possible by forming metastable monoclinic crystals, which are strain-induced. - Graphical abstract: The fig shows the solid-state phase formation of Y₂O₃ by very high energy input into the particles during milling: ordered body-centered cubic phase (space group Ia3, a=10.58 Å) nanocrystalline monoclinic phase (space group C2/m, a=13.89 Å) disordered monoclinic phase partial amorphous phase. The formation of Y₂O₃ smaller than 10 nm was strongly dependent on whether the phase transition from cubic to monoclinic occurred. Highlights: • This paper analyses very high energy milling behavior of coarse Y₂O₃ particles. • A drastic phase transition from cubic to monoclinic occurred with a partial amorphization. • An existence of Y₂O₃ smaller than 10 nm is possible by forming strain-induced monoclinic crystals.

  5. Phase segregation through transient network formation in a binary particle suspension in simple shear: Application to dough

    Science.gov (United States)

    van Opheusden, Joost H. J.; Molenaar, J.

    2014-04-01

    In this paper we describe a viscoelastic type of phase separation in a simulated binary fluid with a sticky and an inert component, without any external gradients. Phase segregation under simple shear occurs due to transient network formation of the sticky component, expelling the inert particles from the network. When model parameters are adjusted to reduce network formation and rearrangement, the segregation effect is significantly smaller or absent. The behavior is independent of shear rate; segregation increases mainly with shear strain. The model is applied to wheat dough. Recent experiments have shown that prolonged shear flow of wheat dough can even give macroscopic segregation.

  6. Araçatuba Formation: palustrine deposits from the initial sedimentation phase of the Bauru Basin

    Directory of Open Access Journals (Sweden)

    Luiz A. Fernandes

    2003-06-01

    Full Text Available The Bauru Basin (Upper Cretaceous accumulated an essentially sandy continental sedimentary sequence. In a first desertic phase the basaltic substratum was covered by a widespread and homogeneous aeolian sand unit with minor loess intercalations. The substratum relief favored the formation of an endorheic drainage system under semi-arid climate, a process that started the development of the Araçatuba Paleoswamp. The palustrine deposits (Araçatuba Formation comprise siltstone and tipically greenish gray narrow tabular strata of sandstone cemented by carbonate. Moulds and gypsite and dolomite pseudomorphs were identified. The moulds seem to be genetically associated with desiccation cracks, root marks and climbing ripple lamination levels, that, on the whole, indicate calm shallow saline waters undergoing phases of subaerial exposition. At the boundaries of the study area, sand units may exhibit sigmoidal features and convolute bedding structure, which is characteristic of marginal deltaic deposits. The Araçatuba Formation is enclosed in and later overlaid by the aeolian deposits of the Vale do Rio do Peixe Formation.A Bacia Bauru (Cretáceo Superior, acumulou uma seqüência sedimentar continental essencialmente arenosa. Numa fase inicial desértica, o seu substrato basáltico foi soterrado por extensa e monótona cobertura de areias eólicas com intercalações subordinadas de depósitos de loesse. O relevo original do substrato favoreceu a formação de uma drenagem regional endorrêica, sob clima semi-árido, propiciando assim condições de formação do Paleopantanal Araçatuba. Os depósitos paludiais (Formação Araçatuba constituem estratos tabulares de siltitos e arenitos de cor cinza claro esverdeado típica, eventualmente cimentados por carbonato de cálcio. Moldes e pseudomorfos de cristais de gipsita e dolomita foram identificados na unidade. Aparentemente, estão associados com gretas de ressecação, marcas de raízes e

  7. Enthalpy of formation of quasicrystalline phase and ternary solid solutions in the Al-Fe-Cu system

    Institute of Scientific and Technical Information of China (English)

    I.A. Tomilin; S.D. Kaloshkin; V. V. Tcherdyntsev

    2006-01-01

    Standard enthalpies of formation of quasicrystalline phase and the ternary solid solutions in the Al-Fe-Cu system and the intermetallic compound FeAl were determined by the means of solution calorimetry. The quasicrystalline phase was prepared using two different methods. The first method (Ⅰ) consisted of ball milling the mixture of powders of pure aluminum copper and iron in a planetary mill with subsequent compacting by hot pressing and annealing. The second method (Ⅱ) consisted of arc melting of the components in argon atmosphere followed by annealing. The latter method was used for preparing the compound FeAl and the solid solutions. The phases were identified using the XRD method. The enthalpy of the formation was determined for the quasicrystalline phase of the composition Al62Cu25.5Fe12.5 and the ternary BCC solid solutions Al35Cu14Fe51, Al40Cu17Fe43, and Al50.4Cu19.6Fe30. The measured enthalpy of formation of the intermetallic com pound FeAl is in good agreement with the earlier published data. The enthaipies of formation of the quasicrystalline phases prepared using two different methods are close to each other, namely, -22.7±3.4 (method Ⅰ) and -21.3±2.1 (method Ⅱ)k J/mol.

  8. Phase Formation and Transformations in Transmutation Fuel Materials for the LIFE Engine Part I - Path Forward

    Energy Technology Data Exchange (ETDEWEB)

    Turchi, P E; Kaufman, L; Fluss, M J

    2008-11-10

    The current specifications of the LLNL fusion-fission hybrid proposal, namely LIFE, impose severe constraints on materials, and in particular on the nuclear fissile or fertile nuclear fuel and its immediate environment. This constitutes the focus of the present report with special emphasis on phase formation and phase transformations of the transmutation fuel and their consequences on particle and pebble thermal, chemical and mechanical integrities. We first review the work that has been done in recent years to improve materials properties under the Gen-IV project, and with in particular applications to HTGR and MSR, and also under GNEP and AFCI in the USA. Our goal is to assess the nuclear fuel options that currently exist together with their issues. Among the options, it is worth mentioning TRISO, IMF, and molten salts. The later option will not be discussed in details since an entire report is dedicated to it. Then, in a second part, with the specific LIFE specifications in mind, the various fuel options with their most critical issues are revisited with a path forward for each of them in terms of research, both experimental and theoretical. Since LIFE is applicable to very high burn-up of various fuels, distinctions will be made depending on the mission, i.e., energy production or incineration. Finally a few conclusions are drawn in terms of the specific needs for integrated materials modeling and the in depth knowledge on time-evolution thermochemistry that controls and drastically affects the performance of the nuclear materials and their immediate environment. Although LIFE demands materials that very likely have not yet been fully optimized, the challenge are not insurmountable and a well concerted experimental-modeling effort should lead to dramatic advances that should well serve other fission programs such as Gen-IV, GNEP, AFCI as well as the international fusion program, ITER.

  9. Role of stirring assist during solvothermal synthesis for preparing single-crystal bismuth telluride hexagonal nanoplates

    Energy Technology Data Exchange (ETDEWEB)

    Takashiri, Masayuki, E-mail: takashiri@tokai-u.jp [Department of Materials Science, Tokai University, 4-1-1 Kitakaname, Hiratsuka, Kanagawa 259-1292 (Japan); Kai, Shintaro; Wada, Kodai [Department of Materials Science, Tokai University, 4-1-1 Kitakaname, Hiratsuka, Kanagawa 259-1292 (Japan); Takasugi, Soichi [Graduate School of Science and Technology, Tokai University, 4-1-1 Kitakaname, Hiratsuka, Kanagawa 259-1292 (Japan); Tomita, Koji [Department of Chemistry, Tokai University, 4-1-1 Kitakaname, Hiratsuka, Kanagawa 259-1292 (Japan)

    2016-04-15

    We investigated the role of stirring assist during solvothermal synthesis for preparing high quality bismuth telluride (Bi{sub 2}Te{sub 3}) hexagonal nanoplates. We performed a series of experiments that comprised solvothermal synthesis with stirring assist at 500 rpm and without stirring assist. As a result, high purity Bi{sub 2}Te{sub 3} hexagonal nanoplates with uniform morphology and edge length of 400–800 nm were obtained by solvothermal synthesis using stirring assist, whereas intermediate products such as tellurium and tellurium oxide compounds were also produced besides the Bi{sub 2}Te{sub 3} hexagonal nanoplates by solvothermal synthesis without stirring assist. To further study the nanostructure of the nanoplates with stirring assist, we performed high-resolution transmission electron microscopy and selected-area electron diffraction analysis. It was found that the Bi{sub 2}Te{sub 3} hexagonal nanoplates were composed of rhombohedral phases and highly single-crystalline structures. Based on the experimental and analytical results, we propose a possible reaction process and growth mechanism of the Bi{sub 2}Te{sub 3} hexagonal nanoplates. The reaction rate is the key factor to control the shapes of nanostructures. When the reaction rate was sufficient, it proceeded to the final stage, and then Bi{sub 2}Te{sub 3} nanoplates were produced. However, when the reaction rate was insufficient, the entire morphology evolution process was terminated at the intermediate stage, and intermediate products besides Bi{sub 2}Te{sub 3} nanoplates were also produced. - Highlights: • High quality Bi{sub 2}Te{sub 3} hexagonal nanoplates were prepared by solvothermal synthesis. • Role of stirring assist during the solvothermal synthesis were investigated. • Bi{sub 2}Te{sub 3} hexagonal nanoplates with edge length of 400–800 nm were obtained. • Bi{sub 2}Te{sub 3} hexagonal nanoplates were composed of single-crystalline structures. • The reaction rate is the key

  10. Neutral interstellar medium phases and star formation tracers in dwarf galaxies

    Science.gov (United States)

    Cigan, Phillip Johnathan

    Dwarf galaxies present interesting observational challenges for the studies of various galaxy properties: despite their abundance and proximity to the Milky Way, they typically have very low surface brightnesses and small physical sizes. Until now, only the extreme variety of dwarfs --- those undergoing strong bouts of star formation --- have been observed in the FIR, due to observational difficulties. However, this population does not represent the majority of dwarfs, which have only moderate star formation rates and extremely low metallicity (the fraction of heavy elements to hydrogen). The advent of the Herschel Space Telescope, with its superior resolution and sensitivity over previous generations of telescopes, has made it possible to measure FIR spectral lines and broadband continuum in normal dwarf galaxies, expanding the scope of studies beyond the brighter, but more extreme, varieties. The general goal of my research was to study the conditions in the interstellar media (ISM) of typical dwarf galaxies. The LITTLE THINGS (Local Irregulars That Trace Luminosity Extremes, TheHI Nearby Galaxy Survey) project aims to unravel many mysteries of nearby dwarfs using a suite of multi-wavelength data, and the new additions from Herschel help provide insight into the physics of these systems. I reduced and analyzed FIR fine-structure spectral line data for the LITTLE THINGS sample to study the different phases of the ISM, as well as FIR photometry data to access the dust properties and infrared continuum emission in these systems. The FIR spectral lines are diagnostics for the conditions in the ISM of galaxies, telling us about heating efficiency, the fraction of gas that resides in photodissociation regions (PDRs), abundance of highly ionized gas from massive stars, and other physical descriptions. The photometric continuum observations enable the modeling of interstellar dust properties -- dust plays an important role in shielding and cooling molecular clouds which

  11. Nylon flocked swab severely reduces Hexagon Obti sensibility.

    Science.gov (United States)

    Frippiat, Christophe; De Roy, Gilbert; Fontaine, Louis-Marie; Dognaux, Sophie; Noel, Fabrice; Heudt, Laeticia; Lepot, Laurent

    2015-02-01

    Hexagon Obti immunological blood test and flocked swab are widely used in forensic laboratories. Nevertheless, up to now, no compatibility tests have been published between sampling with the ethylene oxide treated flocked swab and the Hexagon Obti blood detection strip. In this study, we investigated this compatibility. Our work shows that sampling with ethylene oxide treated flocked swab reduces by a factor of at least 100 the detection threshold of blood using the Hexagon Obti immunological test.

  12. Two-dimensional hexagonal semiconductors beyond graphene

    Science.gov (United States)

    Nguyen, Bich Ha; Hieu Nguyen, Van

    2016-12-01

    The rapid and successful development of the research on graphene and graphene-based nanostructures has been substantially enlarged to include many other two-dimensional hexagonal semiconductors (THS): phosphorene, silicene, germanene, hexagonal boron nitride (h-BN) and transition metal dichalcogenides (TMDCs) such as MoS2, MoSe2, WS2, WSe2 as well as the van der Waals heterostructures of various THSs (including graphene). The present article is a review of recent works on THSs beyond graphene and van der Waals heterostructures composed of different pairs of all THSs. One among the priorities of new THSs compared to graphene is the presence of a non-vanishing energy bandgap which opened up the ability to fabricate a large number of electronic, optoelectronic and photonic devices on the basis of these new materials and their van der Waals heterostructures. Moreover, a significant progress in the research on TMDCs was the discovery of valley degree of freedom. The results of research on valley degree of freedom and the development of a new technology based on valley degree of freedom-valleytronics are also presented. Thus the scientific contents of the basic research and practical applications os THSs are very rich and extremely promising.

  13. Measurement of Throughput Variation Across A Large Format Volume-Phase Holographic Grating

    CERN Document Server

    Tamura, N; Sharples, R M; Robertson, D J; Allington-Smith, J R; Tamura, Naoyuki; Murray, Graham J.; Sharples, Ray M.; Robertson, David J.

    2005-01-01

    In this paper, we report measurements of diffraction efficiency and angular dispersion for a large format (~ 25 cm diameter) Volume-Phase Holographic (VPH) grating optimized for near-infrared wavelengths (0.9 -- 1.8 micron). The aim of this experiment is to see whether optical characteristics vary significantly across the grating. We sampled three positions in the grating aperture with a separation of 5 cm between each. A 2 cm diameter beam is used to illuminate the grating. At each position, throughput and diffraction angle were measured at several wavelengths. It is found that whilst the relationship between diffraction angle and wavelength is nearly the same at the three positions, the throughputs vary by up to ~ 10\\% from position to position. We explore the origin of the throughput variation by comparing the data with predictions from coupled-wave analysis. We find that it can be explained by a combination of small variations over the grating aperture in gelatin depth and/or refractive index modulation a...

  14. On the study of phase formation and critical current density in superconducting MgB2

    Indian Academy of Sciences (India)

    Suchitra Rajput; Sujeet Chaudhary; Subhash C Kashyap; Pankaj Srivastava

    2006-06-01

    Superconducting bulk MgB2 samples have been synthesized by employing sintering technique without using any additional process steps, generally undertaken in view of the substantial loss of magnesium, during heat treatment. Starting with Mg rich powders having different atomic ratios of Mg : B, as against the nominally required Mg : B = 1 : 2 ratio, we have obtained superconducting MgB2 samples of different characteristics. The effect of excess Mg in the starting mixture and processing temperature on the phase-formation, transition temperature (C) and critical current density (C) have been investigated by electrical transport and a.c. susceptibility measurements. The X-ray diffraction and X-ray photoelectron spectroscopic analyses of MgB2 bulk samples have been carried out to understand the role of excess Mg and the effect of processing temperature. It is established that MgB2 samples with high critical current density can be synthesized from a Mg rich powder having Mg : B in 2 : 2 ratio, at temperatures around 790°C. Critical current density has been found to vary systematically with processing temperature.

  15. Formation mechanism of gas bubble superlattice in UMo metal fuels: Phase-field modeling investigation

    Energy Technology Data Exchange (ETDEWEB)

    Hu, Shenyang [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Burkes, Douglas E. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Lavender, Curt A. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Senor, David J. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Setyawan, Wahyu [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Xu, Zhijie [Pacific Northwest National Lab. (PNNL), Richland, WA (United States)

    2016-07-08

    Nano-gas bubble superlattices are often observed in irradiated UMo nuclear fuels. However, the for- mation mechanism of gas bubble superlattices is not well understood. A number of physical processes may affect the gas bubble nucleation and growth; hence, the morphology of gas bubble microstructures including size and spatial distributions. In this work, a phase-field model integrating a first-passage Monte Carlo method to investigate the formation mechanism of gas bubble superlattices was devel- oped. Six physical processes are taken into account in the model: 1) heterogeneous generation of gas atoms, vacancies, and interstitials informed from atomistic simulations; 2) one-dimensional (1-D) migration of interstitials; 3) irradiation-induced dissolution of gas atoms; 4) recombination between vacancies and interstitials; 5) elastic interaction; and 6) heterogeneous nucleation of gas bubbles. We found that the elastic interaction doesn’t cause the gas bubble alignment, and fast 1-D migration of interstitials along $\\langle$110$\\rangle$ directions in the body-centered cubic U matrix causes the gas bubble alignment along $\\langle$110$\\rangle$ directions. It implies that 1-D interstitial migration along [110] direction should be the primary mechanism of a fcc gas bubble superlattice which is observed in bcc UMo alloys. Simulations also show that fission rates, saturated gas concentration, and elastic interaction all affect the morphology of gas bubble microstructures.

  16. Formation of Carbamate Anions by the Gas-phase Reaction of Anilide Ions with CO2.

    Science.gov (United States)

    Liu, Chongming; Nishshanka, Upul; Attygalle, Athula B

    2016-05-01

    The anilide anion (m/z 92) generated directly from aniline, or indirectly as a fragmentation product of deprotonated acetanilide, captures CO2 readily to form the carbamate anion (m/z 136) in the collision cell, when CO2 is used as the collision gas in a tandem-quadrupole mass spectrometer. The gas-phase affinity of the anilide ion to CO2 is significantly higher than that of the phenoxide anion (m/z 93), which adds to CO2 only very sluggishly. Our results suggest that the efficacy of CO2 capture depends on the natural charge density on the nitrogen atom, and relative nucleophilicity of the anilide anion. Generally, conjugate bases generated from aniline derivatives with proton affinities (PA) less than 350 kcal/mol do not tend to add CO2 to form gaseous carbamate ions. For example, the anion generated from p-methoxyaniline (PA = 367 kcal/mol) reacts significantly faster than that obtained from p-nitroaniline (PA = 343 kcal/mol). Although deprotonated p-aminobenzoic acid adds very poorly because the negative charge is now located primarily on the carboxylate group, it reacts more efficiently with CO2 if the carboxyl group is esterified. Moreover, mixture of CO2 and He as the collision gas was found to afford more efficient adduct formation than CO2 alone, or as mixtures made with nitrogen or argon, because helium acts as an effective "cooling" gas and reduces the internal energy of reactant ions.

  17. Formation of titanium dioxide core-shell microcapsules through a binary-phase spray technique.

    Science.gov (United States)

    Bergek, Jonatan; Elgh, Björn; Palmqvist, Anders E C; Nordstierna, Lars

    2017-09-13

    Core-shell microcapsules consisting of a titanium dioxide shell and a hydrophobic solvent core have been prepared with diameters of a few micrometers and a narrow size distribution using a simple and fast airbrush technique. These microcapsules were prepared at room temperature in a single-step process in which an oil with a dissolved titanium alkoxide precursor was forced together with an aqueous solution, containing a surface-active polymer, through a narrow spray nozzle using a nitrogen gas propellant. Several different parameters of chemical, physical, and processing origin were investigated to find an optimal recipe. Two different alkanes, one ketone, and four alcohols were tested and evaluated as core materials, alone or together with the antifungal biocide 2-n-octyl-4-isothiazolin-3-one (OIT). Long-chain alcohols were found suitable as core oil due to their low solubility in water and surface activity. The addition of the surface-active polymers in the water phase was important in aiding the formation and stabilization of the titanium dioxide shell. An impressive loading of 50 wt% of the semi-hydrophobic OIT was possible to encapsulate using this simple and applicable procedure.

  18. Formation of Carbamate Anions by the Gas-phase Reaction of Anilide Ions with CO2

    Science.gov (United States)

    Liu, Chongming; Nishshanka, Upul; Attygalle, Athula B.

    2016-05-01

    The anilide anion ( m/z 92) generated directly from aniline, or indirectly as a fragmentation product of deprotonated acetanilide, captures CO2 readily to form the carbamate anion ( m/z 136) in the collision cell, when CO2 is used as the collision gas in a tandem-quadrupole mass spectrometer. The gas-phase affinity of the anilide ion to CO2 is significantly higher than that of the phenoxide anion ( m/z 93), which adds to CO2 only very sluggishly. Our results suggest that the efficacy of CO2 capture depends on the natural charge density on the nitrogen atom, and relative nucleophilicity of the anilide anion. Generally, conjugate bases generated from aniline derivatives with proton affinities (PA) less than 350 kcal/mol do not tend to add CO2 to form gaseous carbamate ions. For example, the anion generated from p-methoxyaniline (PA = 367 kcal/mol) reacts significantly faster than that obtained from p-nitroaniline (PA = 343 kcal/mol). Although deprotonated p-aminobenzoic acid adds very poorly because the negative charge is now located primarily on the carboxylate group, it reacts more efficiently with CO2 if the carboxyl group is esterified. Moreover, mixture of CO2 and He as the collision gas was found to afford more efficient adduct formation than CO2 alone, or as mixtures made with nitrogen or argon, because helium acts as an effective "cooling" gas and reduces the internal energy of reactant ions.

  19. Two-phase equilibrium and molecular hydrogen formation in damped Lyman-alpha systems

    CERN Document Server

    Liszt, H S

    2002-01-01

    Molecular hydrogen is quite underabundant in damped Lyman-alpha systems at high redshift, when compared to the interstellar medium near the Sun. This has been interpreted as implying that the gas in damped Lyman-alpha systems is warm. like the nearby neutral intercloud medium, rather than cool, as in the clouds which give rise to most H I absorption in the Milky Way. Other lines of evidence suggest that the gas in damped Lyman-alpha systems -- in whole or part -- is actually cool; spectroscopy of neutral and ionized carbon, discussed here, shows that the damped Lyman-alpha systems observed at lower redshift z $$ 2.8 are warm (though not devoid of H2). To interpret the observations of carbon and hydrogen we constructed detailed numerical models of H2 formation under the conditions of two-phase thermal equilibrium, like those which account for conditions near the Sun, but with varying metallicity, dust-gas ratio, $etc$. We find that the low metallicity of damped Lyman-alpha systems is enough to suppress H2 form...

  20. A study about dimers formation of formic acid in gas phase and in the valence region

    Energy Technology Data Exchange (ETDEWEB)

    Arruda, M.S. [Universidade Federal do Reconcavo da Bahia (UFRB), Amargosa, BA (Brazil); Prudente, F.V.; Marinho, R.R.T.; Nascimento, E.M. [Universidade Federal da Bahia (UFBA), Salvador, BA (Brazil)

    2012-07-01

    Full text: Study of simple pre-biotic molecules takes great importance for understanding about complex organic molecules formation like amino acids, proteins and nucleobases within the DNA and RNA. A hypothesis for the appearance of nucleobases is that they could have been synthesized from simpler organic composites contained in interstellar medium (ISM), meteorites and asteroids. Lots of experiments have demonstrated that it is possible to produce complex pre-biotic molecules from simpler molecules under environments that simulate the ISM. Thus, we have performed a theoretical and experimental study about photoionization and photofragmentation processes of simple pre-biotic molecules that are important in the synthesis of complex biomolecules. In this work particularly, we performed photoionization and photofragmentation process of formic acid-D2 (CDOOD) in order to verify if some molecular fragmentations coming from dimers that could be formed before ionization region at TOF mass spectrometer. Experimentally, we measured these molecules mass spectra in gaseous phase. These spectra were got as function of pressures in experimental chamber, temperature samples and photon energy, in the vacuum ultraviolet region, between 11 and 20 eV. These data had been obtained in the Brazilian Laboratory of Synchrotron Light, by using mass spectrometer of flight time. The mass spectra had been obtained by using the photoelectron photoion coincidence technique, PEPICO. For a better understanding of experimental results, we have made a theoretical analysis of the photofragmentation by using Density Functional Theory. (author)

  1. Thermodynamic Aspects of the Formation of Sulfate Minerals from Hot Gaseous Phase

    Science.gov (United States)

    Giere, R.; Majzlan, J.

    2006-12-01

    Minerals may form by solid-state reactions or by dissolution and precipitation from a fluid phase, be it magma, aqueous medium, or gas. The latter phase was traditionally not considered as important as the other ones, although it may be essential in some geological environments. Components of minerals (e.g., sulfur) are commonly transported by hot gases in volcanoes. Others may form in burning coal dumps or by burning fossil fuels for energy production. We have identified a number of minerals which precipitated from the hot gases escaping into the atmosphere from the smoke stack of a coal-fired power plant. This power plant uses coal or a mixture of coal and used tires to produce electricity. The phases identified by TEM are anglesite (PbSO4), gunningite (ZnSO4?H2O), anhydrite (CaSO4), and yavapaiite (KFe(SO4)2). In addition to these crystalline phases, amorphous sulfate materials and soot have been identified. All these materials were captured by filtering the escaping gases beyond the last filters intended to remove any particles from the gas stream. Therefore, they must have formed by precipitation from the hot gas and may present a significant pollution load in the vicinity of power plants. Verhulst et al. (1996) have shown that several metals are most likely transported as chloride complexes in the gas phase. Their assumption correlates well with the finding that the chloride-richer coal+tire mixture increases considerably amounts of emitted metals. Using thermodynamic data for these and other sulfate minerals, we are trying to understand and model the precipitation process of these minerals from hot gases at ambient pressures. In this contribution, we focus on the mineral mikasaite (trigonal Fe2(SO4)3). This mineral has been reported only from burning coal dumps (Miura et al. 1994). Using acid-solution calorimetry, we have determined the enthalpy of formation of mikasaite from elements at T = 298.15 K. We have further estimated the standard entropy of this

  2. Existence and stability of multisite breathers in honeycomb and hexagonal lattices

    Energy Technology Data Exchange (ETDEWEB)

    Koukouloyannis, V [Department of Physics, Section of Astrophysics, Astronomy and Mechanics, Aristotle University of Thessaloniki, 54124 Thessaloniki (Greece); Kevrekidis, P G; Law, K J H [Department of Mathematics and Statistics, University of Massachusetts, Amherst MA 01003-4515 (United States); Kourakis, I [Centre for Plasma Physics, Queen' s University Belfast, BT7 1 NN (United Kingdom); Frantzeskakis, D J, E-mail: vkouk@physics.auth.g [Department of Physics, University of Athens, Panepistimiopolis, Zografos, Athens 15784 (Greece)

    2010-06-11

    We study the existence and stability of multisite discrete breathers in two prototypical non-square Klein-Gordon lattices, namely a honeycomb and a hexagonal one. In the honeycomb case we consider six-site configurations and find that for soft potential and positive coupling the out-of-phase breather configuration and the charge-two vortex breather are linearly stable, while the in-phase and charge-one vortex states are unstable. In the hexagonal lattice, we first consider three-site configurations. In the case of soft potential and positive coupling, the in-phase configuration is unstable and the charge-one vortex is linearly stable. The out-of-phase configuration here is found to always be linearly unstable. We then turn to six-site configurations in the hexagonal lattice. The stability results in this case are the same as in the six-site configurations in the honeycomb lattice. For all configurations in both lattices, the stability results are reversed in the setting of either hard potential or negative coupling. The study is complemented by numerical simulations which are in very good agreement with the theoretical predictions. Since neither the form of the on-site potential nor the sign of the coupling parameter involved have been prescribed, this description can accommodate inverse-dispersive systems (e.g. supporting backward waves) such as transverse dust-lattice oscillations in dusty plasma (Debye) crystals or analogous modes in molecular chains.

  3. Formats

    Directory of Open Access Journals (Sweden)

    Gehmann, Ulrich

    2012-03-01

    Full Text Available In the following, a new conceptual framework for investigating nowadays’ “technical” phenomena shall be introduced, that of formats. The thesis is that processes of formatting account for our recent conditions of life, and will do so in the very next future. It are processes whose foundations have been laid in modernity and which will further unfold for the time being. These processes are embedded in the format of the value chain, a circumstance making them resilient to change. In addition, they are resilient in themselves since forming interconnected systems of reciprocal causal circuits.Which leads to an overall situation that our entire “Lebenswelt” became formatted to an extent we don’t fully realize, even influencing our very percep-tion of it.

  4. Fabrication and Photoluminescence Properties of Hexagonal Micro-pyramids ZnO Powders by Combustion Synthesis

    Institute of Scientific and Technical Information of China (English)

    CHEN Ai; ZHANG Ying; MENG Fancheng; WANG Hairong; LI Zesong; SHEN Yingping

    2011-01-01

    The ZnO powder with hexagonal-pyramids structure was prepared by the low-temperature combustion process.Ammonium acetate was used as the fuels,whereas zinc nitrate acted as the oxidant.The effect of different ration between fuel and oxidant on the morphology and photoluminescence(PL)characteristic was studied.The formation of hexagonal-pyramids structure was discussed.The optimum preparing parameter for fine morphology is that the ratio of zinc nitrate and ammonium acetate is 1:5,and ignition temperature is 500 ℃.The PL measurement indicates all samples have the strong blue and yellow emission peak.The changes of surface energy of the polar surfaces result in the formation of micro-pyramids structure.

  5. Mechanism of Phase Transformation and Formation of Barium Hexaferrite Doped with Rare-Earths in Sol-Gel Process

    Institute of Scientific and Technical Information of China (English)

    甘树才; 洪广言; 张军; 车平; 唐娟

    2003-01-01

    The phase-transformation in sol-gel preparation of barium hexaferrite and the formation of barium hexaferrite doped with La3+ were studied by chemical phase analysis, X-ray diffraction and infrared spectrometry analysis. The experimental results show that phase transformation reactions of FeCO3, Fe2O3 and BaFe2O4, barium hexaferrite and γ-Fe2O3 take place in the heat treatment of gel. While the doping lanthanide ion replace barium ion, an equivalent quantity of Fe3+ are reduced to Fe2+ to maintain the charge equilibrium.

  6. Key parameters controlling OH-initiated formation of secondary organic aerosol in the aqueous phase (aqSOA)

    Science.gov (United States)

    Ervens, Barbara; Sorooshian, Armin; Lim, Yong B.; Turpin, Barbara J.

    2014-04-01

    Secondary organic aerosol formation in the aqueous phase of cloud droplets and aerosol particles (aqSOA) might contribute substantially to the total SOA burden and help to explain discrepancies between observed and predicted SOA properties. In order to implement aqSOA formation in models, key processes controlling formation within the multiphase system have to be identified. We explore parameters affecting phase transfer and OH(aq)-initiated aqSOA formation as a function of OH(aq) availability. Box model results suggest OH(aq)-limited photochemical aqSOA formation in cloud water even if aqueous OH(aq) sources are present. This limitation manifests itself as an apparent surface dependence of aqSOA formation. We estimate chemical OH(aq) production fluxes, necessary to establish thermodynamic equilibrium between the phases (based on Henry's law constants) for both cloud and aqueous particles. Estimates show that no (currently known) OH(aq) source in cloud water can remove this limitation, whereas in aerosol water, it might be feasible. Ambient organic mass (oxalate) measurements in stratocumulus clouds as a function of cloud drop surface area and liquid water content exhibit trends similar to model results. These findings support the use of parameterizations of cloud-aqSOA using effective droplet radius rather than liquid water volume or drop surface area. Sensitivity studies suggest that future laboratory studies should explore aqSOA yields in multiphase systems as a function of these parameters and at atmospherically relevant OH(aq) levels. Since aerosol-aqSOA formation significantly depends on OH(aq) availability, parameterizations might be less straightforward, and oxidant (OH) sources within aerosol water emerge as one of the major uncertainties in aerosol-aqSOA formation.

  7. Phase formation and chemical phase equilibria in aqueous-based systems pertinent to waste-management: calcium oxide-alluminum oxide-borate-water, calcium oxide-lead oxide-phosphate-water and calcium oxide-arsenate-water

    Science.gov (United States)

    Bothe, James Vincent, Jr.

    This thesis explores three aqueous-based systems that have importance in the area of waste-management: (1) CaO-Alsb2Osb3-Bsb2Osb3-Hsb2O, (2) CaO-PbO-Psb2Osb5-Hsb2O and (3) CaO-Assb2Osb5-Hsb2O. More specifically, the objective of this research is to identify various precipitated compounds that can effectively immobilize certain elements that either directly or indirectly have an adverse effect on the environment. In the first quaternary system, CaO-Alsb2Osb3-Bsb2Osb3-Hsb2O, boron is the element desired to be ``fixed'' because ``free'' boron is the cause of delayed hardening in cement paste intended for the encapsulation of nuclear waste. Soluble boron also causes the cement paste to prematurely set, a phenomenon called ``flash-set.'' Isothermal calorimetry was used to track the progress of tricalcium aluminate hydration in the presence of boric acid and Ca(OH)sb2 and revealed the presence of a pronounced induction period, the length of which varied with both temperature and boric acid concentration. It was determined that a diffusion barrier, most likely an amorphous calcium borate, deposited onto the active anhydrous tricalcium aluminate grains inhibiting further hydration. Also, under certain conditions, the precipitation of crystalline 4CaO{*}Alsb2Osb3{*}1/2Bsb2Osb3{*}12Hsb2O may be responsible for the observed flash-set due to its flat, plate-like morphology. Another quaternary hydrate, 6CaO{*}Alsb2Osb3{*}2Bsb2Osb3{*}39Hsb2O (boro-ettringite) was also synthesized during this research and crystallized as hexagonal prisms. In contrast to the fast crystallization of 4CaO{*}Alsb2Osb3{*}1/2Bsb2Osb3{*}12Hsb2O, boro-ettringite was observed to form slowly and in stages with the precipitation of the transient phase CaO-Bsb2Osb3{*}6Hsb2O preceding it. Further investigation of these two hydrates lead to the construction of a quaternary phase diagram and to the determination of their solubility products (pKsp = -logKsp), which were determined to be 44.23 for boro

  8. Cement Formation:A Success Story in a Black Box: High Temperature Phase Formation of Portland Cement Clinker

    OpenAIRE

    2012-01-01

    Cement production has been subject to several technological changes, each of which requires detailed knowledgeabout the high multiplicity of processes, especially the high temperature process involved in the rotary kiln. This article gives an introduction to the topic of cement, including an overview of cement production, selected cement properties, and clinker phase relations. An extended summary of laboratory-scale investigations on clinkerization reactions, the most important reactions in ...

  9. (Bi,Pb)2Sr2Ca2Cu3Ox phase formation in a silver-sheathed multifilament tape

    DEFF Research Database (Denmark)

    Liu, Yi-Lin; Wang, W.G.; Kindl, B.

    2000-01-01

    The 2223 formation is studied on tape samples air-quenched from the annealing temperature. The morphology, dimension and distribution of 2223 phase at the early stage of annealing are revealed by SEM on a scale of several grains. Based on this observation a tentative model of nucleation...

  10. Formation process,microstructure and mechanical property of transient liquid phase bonded aluminium-based metal matrix composite joint

    Institute of Scientific and Technical Information of China (English)

    孙大谦; 刘卫红; 贾树盛; 邱小明

    2004-01-01

    The formation process, microstructure and mechanical properties of transient liquid phase (TLP) bonded aluminium-based metal matrix composite (MMC) joint with copper interlayer were investigated. The formation process of the TLP joint comprises a number of stages: plastic deformation and solid diffusion (stage 1), dissolution of interlayer and base metal (stage 2), isothermal solidification (stage 3) and homogenization (stage 4). The microstructure of the joint depends on the joint formation process (distinct stages). The plastic deformation and solid diffusion in stage 1 favoure the intimate contact at interfaces and liquid layer formation. The microstructure of joint consists of aluminium solid solution, alumina particle, Al2Cu and MgAl2O4 compounds in stage 2. The most pronounced feature of joint microstructure in stage 3 is the alumina particle segregation in the center of the joint. The increase of joint shear strength with increasing bonding temperature is mainly attributed to improving the fluidity and wettability of liquid phase and decreasing the amount of Al2Cu brittle phase in the joint. The principal reason of higher bonding temperature (>600 ℃) resulting in lowering obviously the joint shear strength is the widening of alumina particle segregation region that acts as a preferential site for failure. The increase of joint shear strength with increasing holding time is mainly associated with decreasing the amount of Al2 Cu brittle phase and promoting homogenization of joint.

  11. Phase transitions during formation of Ag nanoparticles on In{sub 2}S{sub 3} precursor layers

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Yang, E-mail: yang.liu@helmholtz-berlin.de; Fu, Yanpeng; Dittrich, Thomas; Sáez-Araoz, Rodrigo; Schmid, Martina; Hinrichs, Volker; Lux-Steiner, Martha Ch.; Fischer, Christian-Herbert

    2015-09-01

    Phase transitions have been investigated for silver deposition onto In{sub 2}S{sub 3} precursor layers by spray chemical vapor deposition from a trimethylphosphine (hexafluoroacetylacetonato) silver (Ag(hfacac)(PMe{sub 3})) solution. The formation of Ag nanoparticles (Ag NPs) on top of the semiconductor layer set on concomitant with the formation of AgIn{sub 5}S{sub 8}. The increase of the diameter of Ag NPs was accompanied by the evolution of orthorhombic AgInS{sub 2}. The formation of Ag{sub 2}S at the interface between Ag NPs and the semiconductor layer was observed. Surface photovoltage spectroscopy indicated charge separation and electronic transitions in the ranges of corresponding band gaps. The phase transition approach is aimed to be applied for the formation of plasmonic nanostructures on top of extremely thin semiconducting layers. - Highlights: • Silver nanoparticles were deposited onto In{sub 2}S{sub 3} precursor layer by spray pyrolysis. • The silver nanoparticle size and density could be controlled by deposition time. • Phase transitions during deposition and material properties were investigated. • The layers still show semiconducting properties after phase transitions. • Plasmonic absorption enhancement has been demonstrated.

  12. Thermodynamics of phase formation and heavy quasiparticles in Sr{sub 3}Ru{sub 2}O{sub 7}

    Energy Technology Data Exchange (ETDEWEB)

    Rost, Andreas W.; Bruin, Jan A.N.; Tian, Demian; Mackenzie, Andrew P. [SUPA, School of Physics and Astronomy, University of St Andrews, St Andrews KY169SS (United Kingdom); Grigera, Santiago A. [SUPA, School of Physics and Astronomy, University of St Andrews, St Andrews KY169SS (United Kingdom); Instituto de Fisica de Liquidos y Sistemas Biologicos, UNLP-CONICET, La Plata 1900 (Argentina); Perry, Robin S. [SUPA, School of Physics, University of Edinburgh, Mayfield Road, Edinburgh EH93JZ (United Kingdom); Raghu, Sri [Department of Physics and Astronomy, Rice University, Houston, Texas, 77005 (United States); Kivelson, Steve A. [Department of Physics, Stanford University, Stanford, California, 94305 (United States)

    2012-07-01

    The itinerant metamagnet Sr{sub 3}Ru{sub 2}O{sub 7} has motivated a wide range of experimental and theoretical work in recent years because of the discovery of an unusual low temperature phase which is forming in the vicinity of a proposed quantum critical point. A major challenge is the investigation of the thermodynamic properties of both this unusual phase and the fluctuations associated with the quantum critical point. Here we report on new specific heat measurements extending previous work to the wider phase diagram. Our results shed light on two important aspects of the system. First we discuss the entropic details of the formation of heavy quasiparticles as a function of temperature in this compound relevant for a wide class of materials. Secondly we present thermodynamic evidence for the anomalous low temperature phase forming directly out of the critical high temperature phase.

  13. Energy spectrum of an electron confined in the hexagon-shaped quantum well

    Institute of Scientific and Technical Information of China (English)

    Yu.; V.; VOROBIEV; V.; R.; VIEIRA; P.; P.; HORLEY; P.; N.; GORLEY; J.; GONZLEZ-HERNNDEZ

    2009-01-01

    Considering the hexagonal-shaped quantum-scale formations on the surface of thin semiconductor films, a methodology was developed to obtain the analytical solution of the Schrdinger equation when impenetrable walls of a quantum well are treated as mirrors. The results obtained allowed the calculation of the space probability distributions and the energy spectrum of the particle confined in a hex-agonal-shaped well.

  14. Energy spectrum of an electron confined in the hexagon-shaped quantum well

    Institute of Scientific and Technical Information of China (English)

    Yu.V.VOROBIEV; V.R.VlEIRA; P.P.HORLEY; P.N.GORLEY; J.GONZ(A)LEZ-HERN(A)NDEZ

    2009-01-01

    Considering the hexagonal-shaped quantum-scale formations on the surface of thin semiconductor films, a methodology was developed to obtain the analytical solution of the Schr(o)dinger equation when impenetrable walls of a quantum well are treated as mirrors. The results obtained allowed the calcula-tion of the space probability distributions and the energy spectrum of the particle confined in a hex-agonal-shaped well.

  15. Formation of FeMo2B2 phase in boron containing 9Cr-1.5Mo ferritic steels

    Institute of Scientific and Technical Information of China (English)

    JUNG Woo-Sang; HONG Suk-Woo; SONG Sang-Min; SOOK-In Kwun; CHUNG Soon-Hyo

    2006-01-01

    The segregation and diffusion of boron during heat treatments were studied.The influence of boron contents, aging time and applied stress on FeMo2B2 formation was also studied.Finally, the effects of boron contents and FeMo2B2 formation on the high temperature strength were studied.Boron atoms were segregated to prior austenite grain boundary during normalizing treatment.And these boron atoms were slowly diffused into the grain interior during tempering and aging at 700 ℃.The FeMo2B2 phase was only formed after 1,000 h aging at 700 ℃ in alloy containing 196 ppm boron.The formation of FeMo2B2 phase is accelerated by the applied stress.It was expected that the formation of FeMo2B2 is closely related to the redistribution of boron atoms.The tensile strengths at 700 ℃ are increased with the increase of boron contents.However, the formation of FeMo2B2 phase results in lower tensile strength.

  16. Generating a hexagonal lattice wave-field with a gradient basis structure

    CERN Document Server

    Kumar, Manish

    2016-01-01

    We present a new, single step approach for generating a hexagonal lattice wave-field with a gradient local basis structure. We incorporate this by coherently superposing two (or more) hexagonal lattice wave-fields which differ in their basis structures. The basis of the resultant lattice wave-field is highly dependent on the relative strengths of constituent wave-fields and a desired spatial modulation of basis structure is thus obtained by controlling the spatial modulation of relative strengths of constituent wave-fields. The experimental realization of gradient lattice is achieved by using a phase only spatial light modulator (SLM) in an optical 4f Fourier filter setup where the SLM is displayed with numerically calculated gradient phase mask. The presented method is wavelength independent and is completely scalable making it very promising for micro-fabrication of corresponding structures.

  17. Self-Assembly of Cubes into 2D Hexagonal and Honeycomb Lattices by Hexapolar Capillary Interactions

    Science.gov (United States)

    Soligno, Giuseppe; Dijkstra, Marjolein; van Roij, René

    2016-06-01

    Particles adsorbed at a fluid-fluid interface induce capillary deformations that determine their orientations and generate mutual capillary interactions which drive them to assemble into 2D ordered structures. We numerically calculate, by energy minimization, the capillary deformations induced by adsorbed cubes for various Young's contact angles. First, we show that capillarity is crucial not only for quantitative, but also for qualitative predictions of equilibrium configurations of a single cube. For a Young's contact angle close to 90°, we show that a single-adsorbed cube generates a hexapolar interface deformation with three rises and three depressions. Thanks to the threefold symmetry of this hexapole, strongly directional capillary interactions drive the cubes to self-assemble into hexagonal or graphenelike honeycomb lattices. By a simple free-energy model, we predict a density-temperature phase diagram in which both the honeycomb and hexagonal lattice phases are present as stable states.

  18. Modification of linear prepolymers to tailor heterogeneous network formation through photo-initiated Polymerization-Induced Phase Separation.

    Science.gov (United States)

    Szczepanski, Caroline R; Stansbury, Jeffrey W

    2015-07-23

    Polymerization-induced phase separation (PIPS) was studied in ambient photopolymerizations of triethylene glycol dimethacrylate (TEGDMA) modified by poly(methyl methacrylate) (PMMA). The molecular weight of PMMA and the rate of network formation (through incident UV-irradiation) were varied to influence both the promotion of phase separation through increases in overall free energy, as well as the extent to which phase development occurs during polymerization through diffusion prior to network gelation. The overall free energy of the polymerizing system increases with PMMA molecular weight, such that PIPS is promoted thermodynamically at low loading levels (5 wt%) of a higher molecular weight PMMA (120 kDa), while a higher loading level (20 wt%) is needed to induce PIPS with lower PMMA molecular weight (11 kDa), and phase separation was not promoted at any loading level tested of the lowest molecular weight PMMA (1 kDa). Due to these differences in overall free energy, systems modified by PMMA (11 kDa) underwent phase separation via Nucleation and Growth, and systems modified by PMMA (120 kDa), followed the Spinodal Decomposition mechanism. Despite differences in phase structure, all materials form a continuous phase rich in TEGDMA homopolymer. At high irradiation intensity (Io=20mW/cm(2)), the rate of network formation prohibited significant phase separation, even when thermodynamically preferred. A staged curing approach, which utilizes low intensity irradiation (Io=300µW/cm(2)) for the first ~50% of reaction to allow phase separation via diffusion, followed by a high intensity flood-cure to achieve a high degree of conversion, was employed to form phase-separated networks with reduced polymerization stress yet equivalent final conversion and modulus.

  19. Electrochemical and SEM properties of Co2+ ion in hexagonal mesophase of pluronic lyotropic liquid crystal template

    Indian Academy of Sciences (India)

    I S El-Hallag

    2009-10-01

    The electrochemical and SEM properties of Co2+ ion in hexagonal mesophase of the pluronic lyotropic liquid crystal template are reported. The cyclic voltammetric studies evidenced the occurrence of two slow electron transfer reduction processes. Such a reaction presumably related to the reduction of Co2+ ion to Co metal. The hexagonal (H1) lyotropic liquid crystalline phases of P84 surfactant have been used to template the electrochemical deposition of nanostructured cobalt films as well as its uses as background electrolyte. Electrochemical studies show that these films have very high surface areas, which reveals that the deposited film exhibits promising properties. The electrode parameters of Co(II) ion in hexagonal meso phase of the lyotropic liquid crystal ternary system (pluronic P84/cobalt/-xylene) is determined using cyclic voltammetry, deduced convolutive voltammetry and chronoamperometry techniques. The morphology of nanostructured deposited films of Co2+ ion in pluronic lyotropic liquid crystal template was investigated via scanning electron microscopy (SEM) technique.

  20. Nepheline Formation Study for Sludge Batch 4 (SB4): Phase 1 Experimental Results

    Energy Technology Data Exchange (ETDEWEB)

    Peeler, D. K.; Edwards, T. B.; Reamer, I.A.; Workman, R. J.

    2005-09-30

    Although it is well known that the addition of Al{sub 2}O{sub 3} to borosilicate glasses enhances the durability of the waste form (through creation of network-forming tetrahedral Na+-[AlO{sub 4/2}]{sup -} pairs), the combination of high Al{sub 2}O{sub 3} and Na{sub 2}O can lead to the formation of nepheline (NaAlSiO{sub 4})--which can negatively impact durability. Given the projected high concentration of Al{sub 2}O{sub 3} in SB4 (Lilliston 2005) and the potential use of a high Na{sub 2}O based frit to improve melt rate and a high Na{sub 2}O sludge due to settling problems, the potential formation of nepheline in various SB4 systems continues to be assessed. Twelve SB4-based glasses were fabricated and their durabilities (via the Product Consistency Test [PCT]) measured to assess the potential for nepheline formation and its potential negative impact on durability. In terms of ''acceptability'', the results indicate that all of the study glasses produced are acceptable with respect to durability as defined by the PCT (normalized boron release values for all nepheline (NEPH) glasses were much lower than that of the Environmental Assessment (EA) glass (16.695 g/L)). The most durable glass is NEPH-04 (quenched) with a normalized boron release (NL [B]) of 0.61 g/L, while the least durable glass is NEPH-01 centerline canister cooled (ccc) with an NL [B] of 2.47 g/L (based on the measured composition). In terms of predictability, most of the study glasses are predictable by the {Delta}G{sub p} model. Those that are not predictable (i.e., they fall outside of the prediction limits) actually fall below the prediction interval (i.e., they are over predicted by the model) suggesting the model is conservative. The Phase 1 PCT results suggest that for those glasses prone to nepheline formation (using the 0.62 value developed by Li et al. (2003) as a guide), a statistically significant difference in PCT response was observed for the two heat treatments but

  1. Formation of a lamellar phase : Rearrangement of amphiphiles from the bulk isotropic phase into a lamellar fashion

    NARCIS (Netherlands)

    Sein, A; Engberts, JBFN

    1996-01-01

    The dynamics of the formation of a lyotropic lamellar arrangement. of surfactant molecules has been studied by means of a contact experiment. Technical grade dodecylbenzenesulfonic acid (HDoBS) was brought into contact with water or an aqueous solution containing sodium hydroxide or sodium hydroxide

  2. Control over self-assembly of diblock copolymers on hexagonal and square templates for high area density circuit boards.

    Science.gov (United States)

    Feng, Jie; Cavicchi, Kevin A; Heinz, Hendrik

    2011-12-27

    Self-assembled diblock copolymer melts on patterned substrates can induce a smaller characteristic domain spacing compared to predefined lithographic patterns and enable the manufacture of circuit boards with a high area density of computing and storage units. Monte Carlo simulation using coarse-grain models of polystyrene-b-polydimethylsiloxane shows that the generation of high-density hexagonal and square patterns is controlled by the ratio N(D) of the surface area per post and the surface area per spherical domain of neat block copolymer. N(D) represents the preferred number of block copolymer domains per post. Selected integer numbers support the formation of ordered structures on hexagonal (1, 3, 4, 7, 9) and square (1, 2, 5, 7) templates. On square templates, only smaller numbers of block copolymer domains per post support the formation of ordered arrays with significant stabilization energies relative to hexagonal morphology. Deviation from suitable integer numbers N(D) increases the likelihood of transitional morphologies between square and hexagonal. Upon increasing the spacing of posts on the substrate, square arrays, nested square arrays, and disordered hexagonal morphologies with multiple coordination numbers were identified, accompanied by a decrease in stabilization energy. Control over the main design parameter N(D) may allow an up to 7-fold increase in density of spherical block copolymer domains per surface area in comparison to the density of square posts and provide access to a wide range of high-density nanostructures to pattern electronic devices.

  3. Formation of macroporous gel morphology by phase separation in the silica sol-gel system containing nonionic surfactant

    Institute of Scientific and Technical Information of China (English)

    Junsheng Wu; Xiaogang Li; Wei Du; Hua Chen

    2005-01-01

    The phase separation and gel formation behavior in an alkoxy-derived silica sol-gel system containing Ci6EOi5 has been investigated. Various gel morphologies similar to other sol-gel systems containing organic additives were obtained by changing the preparation conditions. Micrometer-range interconnected porous gels were obtained by freezing transitional structures of phase separation in the sol-gel process. The dependence of the resulting gel morphology on several important reaction parameters such as the starting composition, reaction temperature and acid catalyst concentration was studied in detail. The experimental results indicate that the gel morphology is mainly determined by the time relation between the onset of phase separation and gel formation.

  4. Nucleation and Growth of MOCVD Grown (Cr, Zn)O Films – Uniform Doping vs. Secondary Phase Formation

    Energy Technology Data Exchange (ETDEWEB)

    Saraf, Laxmikant V.; Engelhard, Mark H.; Nachimuthu, Ponnusamy; Shutthanandan, V.; Wang, Chong M.; Heald, Steve M.; McCready, David E.; Lea, Alan S.; Baer, Donald R.; Chambers, Scott A.

    2007-01-17

    We report a detailed study of chromium solubility and secondary phase formation in MOCVD grown (Cr, Zn)O-based films on silicon (100). Simultaneous deposition of 0.15M Cr(TMHD) and 0.025M Zn(TMHD) based precursors in an oxidizing environment with a flow ratio of 1:10 resulted in secondary phase formation rather than uniform Cr doping. Based on several surface and micro-structural techniques, we have identified nano-crystalline ZnCr2O4 and disordered Cr2O3 as the secondary Cr-containing phases that nucleate. Analysis suggests that ZnCr2O4 crystallites are dispersed throughout the film and that disordered Cr2O3 layer may form at the interface. These results reveal a strong tendency for Cr to exist in octahedral, rather than tetrahedral coordination.

  5. The formation of α-phase SnS nanorods by PVP assisted polyol synthesis: Phase stability, micro structure, thermal stability and defects induced energy band transitions

    Energy Technology Data Exchange (ETDEWEB)

    Baby, Benjamin Hudson; Mohan, D. Bharathi, E-mail: d.bharathimohan@gmail.com

    2017-05-01

    We report the formation of single phase of SnS nanostructure through PVP assisted polyol synthesis by varying the source concentration ratio (Sn:S) from 1:1M to 1:12M. The effect of PVP concentration and reaction medium towards the preparation of SnS nanostructure is systematically studied through confocal Raman spectrometer, X-ray diffraction, thermogravimetry analysis, scanning electron microscope, transmission electron microscopy, X-ray photoelectron spectroscopy, UV–Vis–NIR absorption and fluorescence spectrophotometers. The surface morphology of SnS nanostructure changes from nanorods to spherical shape with increasing PVP concentration from 0.15M to 0.5M. Raman analysis corroborates that Raman active modes of different phases of Sn-S are highly active when Raman excitation energy is slightly greater than the energy band gap of the material. The presence of intrinsic defects and large number of grain boundaries resulted in an improved thermal stability of 20 °C during the phase transition of α-SnS. Band gap calculation from tauc plot showed the direct band gap of 1.5 eV which is attributed to the single phase of SnS, could directly meet the requirement of an absorber layer in thin film solar cells. Finally, we proposed an energy band diagram for as synthesized single phase SnS nanostructure based on the experimental results obtained from optical studies showing the energy transitions attributed to band edge transition and also due to the presence of intrinsic defects. - Highlights: • PVP stabilizes the orthorhombic (α) phase of SnS. • Optical band gap of P type SnS tuned by PVP for photovoltaic applications. • The formation of Sn rich SnS phase is investigated through XPS analysis. • Intrinsic defects enhance the thermal stability of α-SnS. • The feasibility of energy transition liable to point defects is discussed.

  6. Electronic Origins of Anomalous Twin Boundary Energies in Hexagonal Close Packed Transition Metals

    OpenAIRE

    de Jong, M.; Kacher, J.; Sluiter, M.H.F.; L. Qi; Olmsted, D. L.; van de Walle, A.; Morris, J. W., Jr.; Minor, A. M.; Asta, M.

    2015-01-01

    Density-functional-theory calculations of twin-boundary energies in hexagonal close packed metals reveal anomalously low values for elemental Tc and Re, which can be lowered further by alloying with solutes that reduce the electron per atom ratio. The anomalous behavior is linked to atomic geometries in the interface similar to those observed in bulk tetrahedrally close packed phases. The results establish a link between twin-boundary energetics and the theory of bulk structural stability in ...

  7. Hexagonal Boron Nitride Nanosheets as High-Performance Binder-Free Fire-Resistant Wood Coatings.

    Science.gov (United States)

    Liu, Juanjuan; Kutty, Rajendrannair Govindan; Zheng, Qingshen; Eswariah, Varrla; Sreejith, Sivaramapanicker; Liu, Zheng

    2017-01-01

    Hexagonal boron nitride (h-BN) nanosheets are synthesized through a facile shear force liquid phase exfoliation method and their use as a binder-free oxidation and fire-resistant wood coating is demonstrated. Characterized by intrinsic low thermal diffusivity and thermal effusivity, h-BN nanosheet coatings show an excellent fire resistance and oxidation resistance up to 900 °C in air.

  8. Templated Growth of Hexagonal Nickel Carbide Nanocrystals on Vertically Aligned Carbon Nanotubes (PREPRINT)

    Science.gov (United States)

    2010-01-01

    centered cubic ( FCC ) structure . Interestingly, there have been reports in the literature related to the stabilization of a non-equilibrium hexagonal...crystallite size (~ 4 nm) and changes to the equilibrium FCC structure for larger crystallite sizes [9-10]. Nickel does not form a carbide under equilibrium...a single weak ring corresponding to the face-centered cubic ( FCC ) structure of Ni. The lattice parameter of the HCP phase was determined to be a

  9. Simulation of aromatic SOA formation using the lumping model integrated with explicit gas-phase kinetic mechanisms and aerosol-phase reactions

    Science.gov (United States)

    Im, Y.; Jang, M.; Beardsley, R. L.

    2014-04-01

    The Unified Partitioning-Aerosol phase Reaction (UNIPAR) model has been developed to predict the secondary organic aerosol (SOA) formation through multiphase reactions. The model was evaluated with aromatic SOA data produced from the photooxidation of toluene and 1,3,5-trimethylbenzene (135-TMB) under various concentrations of NOx and SO2 using an outdoor reactor (University of Florida Atmospheric PHotochemical Outdoor Reactor (UF-APHOR) chamber). When inorganic species (sulfate, ammonium and water) are present in aerosol, the prediction of both toluene SOA and 135-TMB SOA, in which the oxygen-to-carbon (O : C) ratio is lower than 0.62, are approached under the assumption of a complete organic/electrolyte-phase separation below a certain relative humidity. An explicit gas-kinetic model was employed to express gas-phase oxidation of aromatic hydrocarbons. Gas-phase products are grouped based on their volatility (6 levels) and reactivity (5 levels) and exploited to construct the stoichiometric coefficient (αi,j) matrix, the set of parameters used to describe the concentrations of organic compounds in multiphase. Weighting of the αi,j matrix as a function of NOx improved the evaluation of NOx effects on aromatic SOA. The total amount of organic matter (OMT) is predicted by two modules in the UNIPAR model: OMP by a partitioning process and OMAR by aerosol-phase reactions. The OMAR module predicts multiphase reactions of organic compounds, such as oligomerization, acid-catalyzed reactions, and organosulfate (OS) formation. The model reasonably simulates SOA formation under various aerosol acidities, NOx concentrations, humidities and temperatures. Furthermore, the OS fractions in the SOA predicted by the model were in good agreement with the experimentally measured OS fractions.

  10. Experimental study of Gas Phase Formation and Evolution in Low fO2 Planetary Basalts.

    Science.gov (United States)

    Rutherford, M. J.; Wetzel, D. T.; Saal, A. E.; Hauri, E. H.

    2012-12-01

    The existence of a gas phase in planetary basaltic magmas is demonstrated by the ubiquitous presence of vesicles in returned lunar samples and meteorites as well as basalts from Earth and Mars. Additionally, formation of the fine-grained glass bead deposits during eruption of lunar picritic glasses required a large gas-bubble volume (> 90%) at the time of eruption/fragmentation. Up to 100-200 ppm levels of H, S, Cl and F still remain as diffusion-loss profiles in individual lunar glass beads SIMS (1), and higher volatile concentrations occur in olivine melt inclusions (2). The composition and origin of such volcanic gases were investigated by experiments on a volatile (C-O-H-S-Cl-F)-bearing picritic glass composition as a function of fO2 near iron-wustite (IW). The C-O-H species dissolved in gas-saturated basaltic melt above IW-0.5 are carbonate, OH and H2O with 100 to 10,000 ppm H2O in the sample; below IW-0.5, the C-species present (Raman and FTIR) are Fe(CO)5 (iron pentacarbonyl) and lesser CH4 [3]. The change in melt speciation in part reflects a change in calculated speciation in the coexisting gas [4]. The carbon solubility in these experimental melts increases linearly with increasing pressure; the more oxidized glasses contain 32-620 ppm C for pressures of 98 to 980 MPa, the reduced glasses contain 8-240 ppm C for pressures between 36 and 900 MPa. Thus, the C solubility of the more reduced Fe-carbonyl and CH4 is about one-half that of carbonate at the same pressure, and indicates the carrying capacity for C in reduced (i.e., lunar) magmas is much lower than it is in present day terrestrial magmas. Varioles up to 200 um in diameter formed in some experiments with higher dissolved water contents (1%); they have radiating crystalline textures (olivine, glass and poorly crystallized graphite) initiated at a central nucleation site. A sharp peak in the variole Ramen spectra indicates methane as well as CO is released during variole formation and a reaction such

  11. FOSSIL EVIDENCE FOR THE TWO-PHASE FORMATION OF ELLIPTICAL GALAXIES

    Energy Technology Data Exchange (ETDEWEB)

    Huang Song [School of Astronomy and Space Science, Nanjing University, Nanjing 210093 (China); Ho, Luis C. [The Observatories of the Carnegie Institution for Science, 813 Santa Barbara Street, Pasadena, CA 91101 (United States); Peng, Chien Y. [Giant Magellan Telescope Organization, 251 South Lake Avenue, Suite 300, Pasadena, CA 91101 (United States); Li Zhaoyu [Key Laboratory for Research in Galaxies and Cosmology, Shanghai Astronomical Observatory, Chinese Academy of Sciences, 80 Nandan Road, Shanghai 200030 (China); Barth, Aaron J. [Department of Physics and Astronomy, 4129 Frederick Reines Hall, University of California, Irvine, CA 92697-4575 (United States)

    2013-05-10

    Massive early-type galaxies (ETGs) have undergone dramatic structural evolution over the last 10 Gyr. A companion paper shows that nearby elliptical galaxies with M{sub *} {>=} 1.3 Multiplication-Sign 10{sup 11} M{sub Sun} generically contain three photometric subcomponents: a compact inner component with effective radius R{sub e} {approx}< 1 kpc, an intermediate-scale middle component with R{sub e} Almost-Equal-To 2.5 kpc, and an extended outer envelope with R{sub e} Almost-Equal-To 10 kpc. Here we attempt to relate these substructures with the properties of ETGs observed at higher redshifts. We find that a hypothetical structure formed from combining the inner and middle components of local ellipticals follows a strikingly tight stellar mass-size relation, one that resembles the distribution of ETGs at z Almost-Equal-To 1. Outside of the central kpc, the median stellar mass surface density profiles of this composite structure agree closest with those of massive galaxies that have similar cumulative number density at 1.5 < z < 2.0 within the uncertainty. We propose that the central substructures in nearby ellipticals are the evolutionary descendants of the ''red nuggets'' formed under highly dissipative (''wet'') conditions at high redshifts, as envisioned in the initial stages of the two-phase formation scenario recently advocated for massive galaxies. Subsequent accretion, plausibly through dissipationless (''dry'') minor mergers, builds the outer regions of the galaxy identified as the outer envelope in our decomposition. The large scatter exhibited by this component on the stellar mass-size plane testifies to the stochastic nature of the accretion events.

  12. Molecularly imprinted polymer grafted to porous polyethylene frits: a new selective solid-phase extraction format.

    Science.gov (United States)

    Barahona, Francisco; Turiel, Esther; Martín-Esteban, Antonio

    2011-10-07

    In this paper, a novel format for selective solid-phase extraction based on a molecularly imprinted polymer (MIP) is described. A small amount of MIP has been synthesized within the pores of commercial polyethylene (PE) frits and attached to its surface using benzophenone (BP), a photo-initiator capable to start the polymerisation from the surface of the support material. Key properties affecting the obtainment of a proper polymeric layer, such as polymerisation time and kind of cross-linker were optimised. The developed imprinted material has been applied as a selective sorbent for cleaning extracts of thiabendazole (TBZ), as model compound, from citrus samples. The use of different solvents for loading the analyte in the imprinted frits was investigated, as well as the binding capacity of the imprinted polymer. Imprinted frits showed good selectivity when loads were performed using toluene and a linear relationship was obtained for the target analyte up to 1000 ng of loaded analyte. Prepared composite material was applied to the SPE of TBZ in real samples extracts, showing an impressive clean-up ability. Calibrations showed good linearity in the concentration range of 0.05-5.00 μg g(-1), referred to the original solid sample, and the regression coefficients obtained were greater than 0.996. The calculated detection limit was 0.016 μg g(-1), low enough to satisfactory analysis of TBZ in real samples. RSDs at different spiking levels ranged below 15% in all the cases and imprinted frits were reusable without loss in their performance.

  13. Formation of secondary organic aerosols from gas-phase emissions of heated cooking oils

    Science.gov (United States)

    Liu, Tengyu; Li, Zijun; Chan, ManNin; Chan, Chak K.

    2017-06-01

    Cooking emissions can potentially contribute to secondary organic aerosol (SOA) but remain poorly understood. In this study, formation of SOA from gas-phase emissions of five heated vegetable oils (i.e., corn, canola, sunflower, peanut and olive oils) was investigated in a potential aerosol mass (PAM) chamber. Experiments were conducted at 19-20 °C and 65-70 % relative humidity (RH). The characterization instruments included a scanning mobility particle sizer (SMPS) and a high-resolution time-of-flight aerosol mass spectrometer (HR-TOF-AMS). The efficiency of SOA production, in ascending order, was peanut oil, olive oil, canola oil, corn oil and sunflower oil. The major SOA precursors from heated cooking oils were related to the content of monounsaturated fat and omega-6 fatty acids in cooking oils. The average production rate of SOA, after aging at an OH exposure of 1. 7 × 1011 molecules cm-3 s, was 1. 35 ± 0. 30 µg min-1, 3 orders of magnitude lower compared with emission rates of fine particulate matter (PM2. 5) from heated cooking oils in previous studies. The mass spectra of cooking SOA highly resemble field-derived COA (cooking-related organic aerosol) in ambient air, with R2 ranging from 0.74 to 0.88. The average carbon oxidation state (OSc) of SOA was -1.51 to -0.81, falling in the range between ambient hydrocarbon-like organic aerosol (HOA) and semi-volatile oxygenated organic aerosol (SV-OOA), indicating that SOA in these experiments was lightly oxidized.

  14. Formation and characteristics of aqueous two-phase systems formed by a cationic surfactant and a series of ionic liquids.

    Science.gov (United States)

    Wei, Xi-Lian; Wang, Xiu-Hong; Ping, A-Li; Du, Pan-Pan; Sun, De-Zhi; Zhang, Qing-Fu; Liu, Jie

    2013-11-15

    Aqueous two-phase systems (ATPS) were obtained in the aqueous mixtures of a cationic surfactant and a series of ionic liquids (ILs). The effects of IL structure, temperature and additives on the phase separation were systematically investigated. The microstructures of some ATPS were observed by freeze-fracture replication technique. Lyotropic liquid crystal was found in the bottom phase besides micelles under different conditions. Remarkably, both IL structure and additives profoundly affected the formation and properties of the ATPSs. The phase separation can be attributed to the existence of different aggregates and the cation-π interactions of the cationic surfactant with the ILs, which has a significant role in the formation of ATPS. The extraction capacity of the studied ATPS was also evaluated through their application in the extraction of two biosubstances. The results indicate that the ILs with BF4(-) as anion show much better extraction efficiencies than the corresponding ILs with Br(-) as anion do under the same conditions. l-Tryptophan was mainly distributed into the NPTAB-rich phase, while methylene blue and capsochrome were mainly in the IL-rich phase.

  15. Elliptically distributed lozenge tilings of a hexagon

    CERN Document Server

    Betea, Dan

    2011-01-01

    We present a detailed study of a 4 parameter family of elliptic weights on tilings of a hexagon introduced by Borodin, Gorin and Rains, and generalize some of their results. In the process, we connect the combinatorics of the model with the theory of elliptic special functions. We first analyze some properties of the measure and introduce canonical coordinates that are useful for combinatorially interpreting results. We then show how the computed $n$-point function (called the elliptic Selberg density) and transitional probabilities connect to the theory of $BC_n$-symmetric multivariate elliptic special functions and difference operators discovered by Rains. In particular, the difference operators intrinsically capture the combinatorial model under study, while the elliptic Selberg density is a generalization (deformation) of probability distributions pervasive in the theory of random matrices and interacting particle systems. Based on quasi-commutation relations between elliptic difference operators, we cons...

  16. Quantum emission from hexagonal boron nitride monolayers

    Science.gov (United States)

    Tran, Toan Trong; Bray, Kerem; Ford, Michael J.; Toth, Milos; Aharonovich, Igor

    2016-01-01

    Artificial atomic systems in solids are widely considered the leading physical system for a variety of quantum technologies, including quantum communications, computing and metrology. To date, however, room-temperature quantum emitters have only been observed in wide-bandgap semiconductors such as diamond and silicon carbide, nanocrystal quantum dots, and most recently in carbon nanotubes. Single-photon emission from two-dimensional materials has been reported, but only at cryogenic temperatures. Here, we demonstrate room-temperature, polarized and ultrabright single-photon emission from a colour centre in two-dimensional hexagonal boron nitride. Density functional theory calculations indicate that vacancy-related defects are a probable source of the emission. Our results demonstrate the unprecedented potential of van der Waals crystals for large-scale nanophotonics and quantum information processing.

  17. Mechanical Hysteresis of Hexagonal Boron Nitride

    Institute of Scientific and Technical Information of China (English)

    ZHOU Aiguo; LI Haoran

    2011-01-01

    Hexagonal boron nitride (h-BN) is an important structural material with layered microstructure.Because of the plastic anisotropy,this material shows obvious mechanical hysteresis (nonlinear elastic deformation).There are hysteretic loops at the cyclical load-unload stress-strain curves of h-BN.Consequently,two hot-pressed h-BN cylinders with different textures were studied.The mechanical hysteresis is heavily texture-dependent.The area of hysteretic loop is linearly related with the square of loading stresslevel.Two minor loops attached on the hysteretic loops with the same extreme stresses have congruent shapes.It can be concluded that the mechanical hysteresis of h-BN can he explained by a Kink Nonlinear Elastic model developed from the study of a ternary carbide Ti3SiC2.

  18. Permeation of Light Gases through Hexagonal Ice

    Directory of Open Access Journals (Sweden)

    Luis Gales

    2012-09-01

    Full Text Available Gas separation using porous solids have attracted great attention due to their energetic applications. There is an enormous economic and environmental interest in the development of improved technologies for relevant processes, such as H2 production, CO2 separation or O2 and N2 purification from air. New materials are needed for achieving major improvements. Crystalline materials, displaying unidirectional and single-sized pores, preferentially with low pore tortuosity and high pore density, are promising candidates for membrane synthesis. Herein, we study hexagonal ice crystals as an example of this class of materials. By slowly growing ice crystals inside capillary tubes we were able to measure the permeation of several gas species through ice crystals and investigate its relation with both the size of the guest molecules and temperature of the crystal.

  19. Dancoff Correction in Square and Hexagonal Lattices

    Energy Technology Data Exchange (ETDEWEB)

    Carlvik, I.

    1966-11-15

    This report presents the results of a series of calculations of Dancoff corrections for square and hexagonal rod lattices. The tables cover a wide range of volume ratios and moderator cross sections. The results were utilized for checking the approximative formula of Sauer and also the modification of Bonalumi to Sauer's formula. The modified formula calculates the Dancoff correction with an accuracy of 0.01 - 0.02 in cases of practical interest. Calculations have also been performed on square lattices with an empty gap surrounding the rods. The results demonstrate the error involved in treating this kind of geometry by means of homogenizing the gap and the moderator. The calculations were made on the Ferranti Mercury computer of AB Atomenergi before it was closed down. Since then FORTRAN routines for Dancoff corrections have been written, and a subroutine DASQHE is included in the report.

  20. Combinatorics of giant hexagonal bilayer hemoglobins.

    Science.gov (United States)

    Hanin, L G; Vinogradov, S N

    2000-01-01

    The paper discusses combinatorial and probabilistic models allowing to characterize various aspects of spacial symmetry and structural heterogeneity of the giant hexagonal bilayer hemoglobins (HBL Hb). Linker-dodecamer configurations of HBL are described for two and four linker types (occurring in the two most studied HBL Hb of Arenicola and Lumbricus, respectively), and the most probable configurations are found. It is shown that, for HBL with marked dodecamers, the number of 'normal-marked' pairs of dodecamers in homological position follows a binomial distribution. The group of symmetries of the dodecamer substructure of HBL is identified with the dihedral group D6. Under natural symmetry assumptions, the total dipole moment of the dodecamer substructure of HBL is shown to be zero. Biological implications of the mathematical findings are discussed.

  1. Structure of grain boundaries in hexagonal materials

    CERN Document Server

    Sarrazit, F

    1998-01-01

    which allows the behaviour of line-defects to be studied in complex interfacial processes. The work presented in this thesis describes experimental and theoretical aspects associated with the structure of grain boundaries in hexagonal materials. It has been found useful to classify grain boundaries as low-angle, special or general on the basis of their structure. High-angle grain boundaries were investigated in tungsten carbide (WC) using conventional electron microscopy techniques, and three examples characteristic of the interfaces observed in this material were studied extensively. Three-dimensionally periodic patterns are proposed as plausible reference configurations, and the Burgers vectors of observed interfacial dislocations were predicted using a theory developed recently. The comparison of experimental observations with theoretical predictions proved to be difficult as contrast simulation techniques require further development for analysis to be completed confidently. Another part of this work invol...

  2. A hexagonal orthogonal-oriented pyramid as a model of image representation in visual cortex

    Science.gov (United States)

    Watson, Andrew B.; Ahumada, Albert J., Jr.

    1989-01-01

    Retinal ganglion cells represent the visual image with a spatial code, in which each cell conveys information about a small region in the image. In contrast, cells of the primary visual cortex use a hybrid space-frequency code in which each cell conveys information about a region that is local in space, spatial frequency, and orientation. A mathematical model for this transformation is described. The hexagonal orthogonal-oriented quadrature pyramid (HOP) transform, which operates on a hexagonal input lattice, uses basis functions that are orthogonal, self-similar, and localized in space, spatial frequency, orientation, and phase. The basis functions, which are generated from seven basic types through a recursive process, form an image code of the pyramid type. The seven basis functions, six bandpass and one low-pass, occupy a point and a hexagon of six nearest neighbors on a hexagonal lattice. The six bandpass basis functions consist of three with even symmetry, and three with odd symmetry. At the lowest level, the inputs are image samples. At each higher level, the input lattice is provided by the low-pass coefficients computed at the previous level. At each level, the output is subsampled in such a way as to yield a new hexagonal lattice with a spacing square root of 7 larger than the previous level, so that the number of coefficients is reduced by a factor of seven at each level. In the biological model, the input lattice is the retinal ganglion cell array. The resulting scheme provides a compact, efficient code of the image and generates receptive fields that resemble those of the primary visual cortex.

  3. Correlative theoretical and experimental investigation of the formation of AlYB{sub 14} and competing phases

    Energy Technology Data Exchange (ETDEWEB)

    Hunold, Oliver, E-mail: hunold@mch.rwth-aachen.de; Chen, Yen-Ting; Music, Denis; Baben, Moritz to; Achenbach, Jan-Ole; Keuter, Philipp; Schneider, Jochen M. [Materials Chemistry, RWTH Aachen University, Kopernikusstr. 10, D-52074 Aachen (Germany); Persson, Per O. Å. [Department of Physics, Chemistry and Biology (IFM), Linköping University, S-58183 Linköping (Sweden); Primetzhofer, Daniel [Department of Physics and Astronomy, Uppsala University, Lägerhyddsvägen 1, S-75120 Uppsala (Sweden)

    2016-02-28

    The phase formation in the boron-rich section of the Al-Y-B system has been explored by a correlative theoretical and experimental research approach. The structure of coatings deposited via high power pulsed magnetron sputtering from a compound target was studied using elastic recoil detection analysis, electron energy loss spectroscopy spectrum imaging, as well as X-ray and electron diffraction data. The formation of AlYB{sub 14} together with the (Y,Al)B{sub 6} impurity phase, containing 1.8 at. % less B than AlYB{sub 14}, was observed at a growth temperature of 800 °C and hence 600 °C below the bulk synthesis temperature. Based on quantum mechanical calculations, we infer that minute compositional variations within the film may be responsible for the formation of both icosahedrally bonded AlYB{sub 14} and cubic (Y,Al)B{sub 6} phases. These findings are relevant for synthesis attempts of all boron rich icosahedrally bonded compounds with the space group: Imma that form ternary phases at similar compositions.

  4. Reticular Chemistry at Its Best: Directed Assembly of Hexagonal Building Units into the Awaited Metal-Organic Framework with the Intricate Polybenzene Topology, pbz-MOF.

    Science.gov (United States)

    Alezi, Dalal; Spanopoulos, Ioannis; Tsangarakis, Constantinos; Shkurenko, Aleksander; Adil, Karim; Belmabkhout, Youssef; O Keeffe, Michael; Eddaoudi, Mohamed; Trikalitis, Pantelis N

    2016-10-05

    The ability to direct the assembly of hexagonal building units offers great prospective to construct the awaited and looked-for hypothetical polybenzene (pbz) or "cubic graphite" structure, described 70 years ago. Here, we demonstrate the successful use of reticular chemistry as an appropriate strategy for the design and deliberate construction of a zirconium-based metal-organic framework (MOF) with the intricate pbz underlying net topology. The judicious selection of the perquisite hexagonal building units, six connected organic and inorganic building blocks, allowed the formation of the pbz-MOF-1, the first example of a Zr(IV)-based MOF with pbz topology. Prominently, pbz-MOF-1 is highly porous, with associated pore size and pore volume of 13 Å and 0.99 cm(3) g(-1), respectively, and offers high gravimetric and volumetric methane storage capacities (0.23 g g(-1) and 210.4 cm(3) (STP) cm(-3) at 80 bar). Notably, the pbz-MOF-1 pore system permits the attainment of one of the highest CH4 adsorbed phase density enhancements at high pressures (0.15 and 0.21 g cm(-3) at 35 and 65 bar, respectively) as compared to benchmark microporous MOFs.

  5. Reticular Chemistry at Its Best: Directed Assembly of Hexagonal Building Units into the Awaited Metal-Organic Framework with the Intricate Polybenzene Topology, pbz-MOF

    KAUST Repository

    Alezi, Dalal

    2016-10-05

    The ability to direct the assembly of hexagonal building units offers great prospective to construct the awaited and looked-for hypothetical polybenzene (pbz) or “cubic graphite” structure, described 70 years ago. Here, we demonstrate the successful use of reticular chemistry as an appropriate strategy for the design and deliberate construction of a zirconium-based metal–organic framework (MOF) with the intricate pbz underlying net topology. The judicious selection of the perquisite hexagonal building units, six connected organic and inorganic building blocks, allowed the formation of the pbz-MOF-1, the first example of a Zr(IV)-based MOF with pbz topology. Prominently, pbz-MOF-1 is highly porous, with associated pore size and pore volume of 13 Å and 0.99 cm3 g–1, respectively, and offers high gravimetric and volumetric methane storage capacities (0.23 g g–1 and 210.4 cm3 (STP) cm–3 at 80 bar). Notably, the pbz-MOF-1 pore system permits the attainment of one of the highest CH4 adsorbed phase density enhancements at high pressures (0.15 and 0.21 g cm–3 at 35 and 65 bar, respectively) as compared to benchmark microporous MOFs.

  6. A phase field study of stress effects on microstructure formation during laser-aided direct metal deposition process

    Science.gov (United States)

    Mirzade, Fikret K.

    2017-06-01

    We present a phase-field model for predicting elastic effects on microstructure evolution at the process of laser sintering with powder injection. We derive a system of governing equations describing coupling effects among phase variable, concentration, thermal and elastic displacement fields based on the principle of entropy production positiveness, in which thermal and concentration expansions, mechanical anisotropy effects, transformation dilatation, and strain dependency on phase transformation are considered. The microstructure model is coupled with a macroscopic thermodynamic model. Effects of thermo-capillary and thermo-gravitation convections are included. The possibility to describe the process of structure formation at the phase interface during the melt crystallization is discussed. This model enables prediction and visualization of grain structures during and after the laser sintering process.

  7. Phase formation and UV luminescence of Gd3+ doped perovskite-type YScO3

    Science.gov (United States)

    Shimizu, Yuhei; Ueda, Kazushige

    2016-10-01

    Synthesis of pure and Gd3+doped perovskite-type YScO3 was attempted by a polymerized complex (PC) method and solid state reaction (SSR) method. Crystalline phases and UV luminescence of samples were examined with varying heating temperatures. The perovskite-type single phase was not simply formed in the SSR method, as reported in some literatures, and two cubic C-type phases of starting oxide materials remained forming slightly mixed solid solutions. UV luminescence of Gd3+ doped samples increased with an increase in heating temperatures and volume of the perovskite-type phase. In contrast, a non-crystalline precursor was crystallized to a single C-type phase at 800 °C in the PC method forming a completely mixed solid solution. Then, the phase of perovskite-type YScO3 formed at 1200 °C and its single phase was obtained at 1400 °C. It was revealed that high homogeneousness of cations was essential to generate the single perovskite-phase of YScO3. Because Gd3+ ions were also dissolved into the single C-type phase in Gd3+ doped samples, intense UV luminescence was observed above 800 °C in both C-type phase and perovskite-type phase.

  8. Theoretical Mechanistic and Kinetic Studies on Homogeneous Gas-Phase Formation of Polychlorinated Naphthalene from 2-Chlorophenol as Forerunner

    Directory of Open Access Journals (Sweden)

    Fei Xu

    2015-10-01

    Full Text Available Polychlorinated naphthalenes (PCNs are dioxins-like compounds and are formed along with polychlorinated dibenzo-p-dioxins (PCDDs and polychlorinated dibenzofurans (PCDFs in thermal and combustion procedures. Chlorophenols (CPs are the most important forerunners of PCNs. A comprehensive comprehension of PCN formation procedure from CPs is a precondition for reducing the discharge of PCNs. Experiments on the formation of PCNs from CPs have been hindered by PCN toxicity and short of precise detection methods for active intermediate radicals. In this work, PCN formation mechanism in gas-phase condition from 2-chlorophenol (2-CP as forerunner was studied by quantum chemistry calculations. Numbers of energetically advantaged formation routes were proposed. The rate constants of key elementary steps were calculated over 600–1200 K using canonical variational transition-state theory (CVT with small curvature tunneling contribution (SCT method. This study illustrates formation of PCNs with one chlorine atom loss from 2-CP is preferred over that without chlorine atom loss. In comparison with formation of PCDFs from 2-CP, PCN products are less chlorinated and have lower formation potential.

  9. Quantum chemical approach for condensed-phase thermochemistry (II): Applications to formation and combustion reactions of liquid organic molecules

    Science.gov (United States)

    Ishikawa, Atsushi; Nakai, Hiromi

    2015-03-01

    The harmonic solvation model (HSM), which was recently developed for evaluating condensed-phase thermodynamics by quantum chemical calculations (Nakai and Ishikawa, 2014), was applied to formation and combustion reactions of simple organic molecules. The conventional ideal gas model (IGM) considerably overestimated the entropies of the liquid molecules. The HSM could significantly improve this overestimation; mean absolute deviations for the Gibbs energies of the formation and combustion reactions were (49.6, 26.7) for the IGM and (9.7, 5.4) for the HSM in kJ/mol.

  10. Heterogeneity-enhanced gas phase formation in shallow aquifers during leakage of CO2-saturated water from geologic sequestration sites

    Science.gov (United States)

    Plampin, Michael R.; Lassen, Rune N.; Sakaki, Toshihiro; Porter, Mark L.; Pawar, Rajesh J.; Jensen, Karsten H.; Illangasekare, Tissa H.

    2014-12-01

    A primary concern for geologic carbon storage is the potential for leakage of stored carbon dioxide (CO2) into the shallow subsurface where it could degrade the quality of groundwater and surface water. In order to predict and mitigate the potentially negative impacts of CO2 leakage, it is important to understand the physical processes that CO2 will undergo as it moves through naturally heterogeneous porous media formations. Previous studies have shown that heterogeneity can enhance the evolution of gas phase CO2 in some cases, but the conditions under which this occurs have not yet been quantitatively defined, nor tested through laboratory experiments. This study quantitatively investigates the effects of geologic heterogeneity on the process of gas phase CO2 evolution in shallow aquifers through an extensive set of experiments conducted in a column that was packed with layers of various test sands. Soil moisture sensors were utilized to observe the formation of gas phase near the porous media interfaces. Results indicate that the conditions under which heterogeneity controls gas phase evolution can be successfully predicted through analysis of simple parameters, including the dissolved CO2 concentration in the flowing water, the distance between the heterogeneity and the leakage location, and some fundamental properties of the porous media. Results also show that interfaces where a less permeable material overlies a more permeable material affect gas phase evolution more significantly than interfaces with the opposite layering.

  11. Study on the Formation and Precipitation Mechanism of Mn5Si3 Phase in the MBA-2 Brass Alloy

    Science.gov (United States)

    Li, Hang; Jie, Jinchuan; Zhang, Pengchao; Jia, Chunxu; Wang, Tongmin; Li, Tingju

    2016-06-01

    Mn5Si3 is an attractive dispersion in the special brass, owing to its high hardness and high wear resistance. In the present study, synchrotron X-ray radiography and rapid cooling were applied to investigate the formation mechanism of Mn5Si3 phase in the MBA-2 brass alloy. The primary Mn5Si3 phase is proved to exist stably in the alloy melt and nucleate from the melt at temperatures above 1373 K (1100 °C). In addition, the precipitation mechanism of Mn5Si3 phase is addressed systematically by the isothermal heat treatment. The Mn5Si3 particles are observed to precipitate from the matrix at temperatures above 1023 K (750 °C), and a crystallographic orientation relationship is found between the precipitated Mn5Si3 particle and β phase: (110)_{β } //(1overline{1} 00)_{{{{Mn}}5 {{Si}}3 }} and [overline{1} 11]_{β } //[11overline{2} overline{2} ]_{{{{Mn}}5 {{Si}}3 }} . However, the precipitation of Mn5Si3 phase is thermodynamically inhibited at lower temperatures, which can be ascribed to the increase in the Gibbs free energy of formation of Mn5Si3 with decreasing the temperature.

  12. Amorphous and nanocrystalline phase formation in highly-driven Al-based binary alloys

    Energy Technology Data Exchange (ETDEWEB)

    Kalay, Yunus Eren [Iowa State Univ., Ames, IA (United States)

    2009-01-01

    Remarkable advances have been made since rapid solidification was first introduced to the field of materials science and technology. New types of materials such as amorphous alloys and nanostructure materials have been developed as a result of rapid solidification techniques. While these advances are, in many respects, ground breaking, much remains to be discerned concerning the fundamental relationships that exist between a liquid and a rapidly solidified solid. The scope of the current dissertation involves an extensive set of experimental, analytical, and computational studies designed to increase the overall understanding of morphological selection, phase competition, and structural hierarchy that occurs under far-from equilibrium conditions. High pressure gas atomization and Cu-block melt-spinning are the two different rapid solidification techniques applied in this study. The research is mainly focused on Al-Si and Al-Sm alloy systems. Silicon and samarium produce different, yet favorable, systems for exploration when alloyed with aluminum under far-from equilibrium conditions. One of the main differences comes from the positions of their respective T0 curves, which makes Al-Si a good candidate for solubility extension while the plunging T0 line in Al-Sm promotes glass formation. The rapidly solidified gas-atomized Al-Si powders within a composition range of 15 to 50 wt% Si are examined using scanning and transmission electron microscopy. The non-equilibrium partitioning and morphological selection observed by examining powders at different size classes are described via a microstructure map. The interface velocities and the amount of undercooling present in the powders are estimated from measured eutectic spacings based on Jackson-Hunt (JH) and Trivedi-Magnin-Kurz (TMK) models, which permit a direct comparison of theoretical predictions. For an average particle size of 10 {micro}m with a Peclet number of ~0.2, JH and TMK deviate from

  13. Effect of the formation process of transient liquid phase (TLP) on the interface structure of TiAl joints

    Institute of Scientific and Technical Information of China (English)

    Huiping Duan; Jun Luo; Karl-Heinz Bohm; Mustafa Ko(c)ak

    2005-01-01

    TiAl has been joined employing the transient liquid phase (TLP) bonding with Ti combined with Cu, Ni or Fe foils. Experimental results showed that though the interface structures of the joints are quite different, all the joined zones are composed of five sublayers, i.e. two diffusion zones, two interfacial zones and an interlayer. It has been convinced that the formation process of the transient liquid phase controls the diffusion behavior of melting point depressant (MPD) Cu, Ni, and Fe atoms, which leads to form different interface structures of the joints.

  14. Accurate Gas Phase Formation Enthalpies of Alloys and Refractories Decomposition Products

    KAUST Repository

    Minenkov, Yury

    2017-01-17

    Accurate gas phase formation enthalpies, ΔHf, of metal oxides and halides are critical for the prediction of the stability of high temperature materials used in the aerospace and nuclear industries. Unfortunately, the experimental ΔHf values of these compounds in the most used databases, such as the NIST-JANAF database, are often reported with large inaccuracy, while some other ΔHf values clearly differ from the value predicted by CCSD(T) methods. To address this point, in this work we systematically predicted the ΔHf values of a series of these compounds having a group 4, 6, or 14 metal. The ΔHf values in question were derived within a composite Feller-Dixon-Peterson (FDP) scheme based protocol that combines the DLPNO-CCSD(T) enthalpy of ad hoc designed reactions and the experimental ΔHf values of few reference complexes. In agreement with other theoretical studies, we predict the ΔHf values for TiOCl2, TiOF2, GeF2, and SnF4 to be significantly different from the values tabulated in NIST-JANAF and other sources, which suggests that the tabulated experimental values are inaccurate. Similarly, the predicted ΔHf values for HfCl2, HfBr2, HfI2, MoOF4, MoCl6, WOF4, WOCl4, GeO2, SnO2, PbBr4, PbI4, and PbO2 also clearly differ from the tabulated experimental values, again suggesting large inaccuracy in the experimental values. In the case when largely different experimental values are available, we point to the value that is in better agreement with our results. We expect the ΔHf values reported in this work to be quite accurate, and thus, they might be used in thermodynamic calculations, because the effects from core correlation, relativistic effects, and basis set incompleteness were included in the DLPNO-CCSD(T) calculations. T1 and T2 values were thoroughly monitored as indicators of the quality of the reference Hartree-Fock orbitals (T1) and potential multireference character of the systems (T2).

  15. Thermal relations leading to the formation of gaseous phase within the ice covering lakes and ponds

    Science.gov (United States)

    Hruba, J.; Kletetschka, G.

    2013-12-01

    When cutting the ice from the lakes and ponds gaseous phase displays often ubiquitous bubble textures along the ice thickness. The occurrence of bubbles (enclosures filled with the gas) in ice relates to a content of the dissolved gas in the lake/pond water prior to freezing over the surface. When water freezes, dissolved gases are rejected and redistributed at the ice-water interface, depending on the saturation ratio between the gas and water. If the concentration of dissolved gases surpasses a critical value (as freezing progresses), the water at the interface becomes supersaturated, and gas bubbles nucleate and grow to a visible size along the interface. The bubbles generated at the ice-water interface are either incorporated into the ice crystal as the water-ice interface advances, thus forming gas pores in the ice, or released from the interface. If there is incorporation or release is determined by several factors. The bubbles nucleated at the advancing ice-water interface may be characterized by concentration, shape, and size, which depend on growth rate of ice, the amount of gases dissolved in water, and the particulate content of water. Our work focused on the relation between growth rates of the ice and the occurrence of bubbles in the pond ice. We monitored the temperature of the ice formed under natural conditions over the pond Dolní Tušimy in Mokrovraty, Czech Republic. Distinct layers of gas bubbles were observed when the ice samples have been retrieved. These layers may relate to fast growth rates of ice. In this case the maximum growth rates were about 1 μm/s. The results were compared with similar work done (Bari and Hallett, 1974; Carte 1961; Yoshimura et al., 2008). This comparison showed distinction that may be due to different methods of ice formation (laboratory condition vs. natural conditions). References: Bari, S.A., Hallett, J. (1974): Nucleation and Growth of Bubbles at an Ice-Water Interface. Journal of Glaciology, Vol. 13, No. 69, p

  16. Formation of secondary phase at grain boundary of flash-sintered BaTiO3.

    Science.gov (United States)

    Uehashi, Akinori; Sasaki, Katsuhiro; Tokunaga, Tomoharu; Yoshida, Hidehiro; Yamamoto, Takahisa

    2014-11-01

    decrease with an increase in electric fields, which is very different from the case of ZrO2-3mol%Y2O3 and Y2O3 ceramics. This fact means that application of high electric fields does not effectively operate for enhancement of shrinkage rates in the case of BaTiO3. In contrast, only gradual current increment was observed at 25V/cm, which is categorized in field-assisted sintering (FAST) process. The density of the green compact at 25V/cm was more than 95%.To investigate the mechanism of the decrease in a total shrinkage with electric fields, the microstructure of flash-sintered compact was observed. As a result, it was found that discharge occurs during flash-sintering process, indicating that the input power due to high electric fields does not work effectively. A typical example of the microstructure near the discharge area is shown in Fig. 1. Fig. 1 is a TEM bright field image taken from BaTiO3 flash-sintered at 100V/cm. As seen in the image, the formation of a secondary phase along the grain boundary can be clearly seen. Diffractometric and EDS analysis have revealed that the secondary phase is BaTi4O9, one of compounds between BaO and TiO2 system. By discharging, grain boundaries partially melt and a part of Ba vaporizes to form BaTi4O9 with cooling. To investigate flash-sintering behaviors, it was concluded that FAST process play an important role to enhance the shrinklage rate in the case of BaTiO3.jmicro;63/suppl_1/i19/DFU048F1F1DFU048F1Fig. 1.TEM bright field image of a secondary phase and the electron diffraction pattern taken from the secondary phase. © The Author 2014. Published by Oxford University Press on behalf of The Japanese Society of Microscopy. All rights reserved. For permissions, please e-mail: journals.permissions@oup.com.

  17. On the possible formation of Aurivillius phases in the oxide system Bi2O5–ZnO–Nb2O5

    Directory of Open Access Journals (Sweden)

    ALICE RUSU

    2004-01-01

    Full Text Available This paper presents results concerning the possible synthesis of double perovskite and Aurivillius phases in the BZN system. A crystal chemical criterion based on an elastic model for the structure was used in order to determine if the formation of layered bismuth compounds is favoured in the above system. The tempeature seems to be the decisive factor influencing Aurivillius phase formation.

  18. An Easy Approach to Control β-Phase Formation in PFO Films for Optimized Emission Properties

    Directory of Open Access Journals (Sweden)

    Qi Zhang

    2017-02-01

    Full Text Available We demonstrate a novel approach to control β-phase content generated in poly(9,9-dioctylfluorene (PFO films. A very small amount of paraffin oil was used as the additive to the PFO solution in toluene. The β-phase fraction in the spin-coated PFO films can be modified from 0% to 20% simply by changing the volume percentage of paraffin oil in the mixed solution. Organic light emitting diodes (OLEDs and amplified spontaneous emission (ASE study confirmed low β-phase fraction promise better OLEDs device, while high β-phase fraction benefits ASE performance.

  19. Phase separation during silica gel formation followed by time-resolved SAXS

    Energy Technology Data Exchange (ETDEWEB)

    Gommes, Cedric J. [Universite de Liege, Laboratoire de Genie Chimique, Bat B6a, Allee du 6 aout 3, B-4000 Sart Tilman Liege (Belgium)]. E-mail: cedric.gommes@ulg.ac.be; Blacher, Silvia [Universite de Liege, Laboratoire de Genie Chimique, Bat B6a, Allee du 6 aout 3, B-4000 Sart Tilman Liege (Belgium); Goderis, Bart [Katholieke Universiteit Leuven, Laboratorium voor Macromoleculaire Structuurchemie, Celestijnenlann 200F, B-3001 Heverlee (Belgium); Pirard, Jean-Paul [Universite de Liege, Laboratoire de Genie Chimique, Bat B6a, Allee du 6 aout 3, B-4000 Sart Tilman Liege (Belgium)

    2005-08-15

    Time-resolved small angle X-ray scattering data are collected during the formation of silica gels from the base catalyzed polymerization of tetraethoxysilane in ethanol with 3-(2-aminoethylamino)propyltrimethoxysilane and 3-aminopropyltriethoxysilane as additives. It is shown that a polymerization-induced spinodal demixing occurs during the gel formation.

  20. PHASE COHERENT STAR FORMATION PROCESSES IN THE DISKS OF GRAND DESIGN SPIRALS

    NARCIS (Netherlands)

    BECKMAN, JE; CEPA, J; KNAPEN, JH

    1991-01-01

    We show examples of a new technique we have devised to compare star formation efficiencies in the arms and discs of spirals. First results show striking evidence of the presence and influence of density wave systems of star formation in grand design galaxies.

  1. Vacancy enhanced formation and phase transition of Cu-rich precipitates in α - iron under neutron irradiation

    Directory of Open Access Journals (Sweden)

    G. C. Lv

    2016-04-01

    Full Text Available In this paper, we employed both molecular statics and molecular dynamics simulation methods to investigate the role of vacancies in the formation and phase transition of Cu-rich precipitates in α-iron. The results indicated that vacancies promoted the diffusion of Cu atoms to form Cu-rich precipitates. After Cu-rich precipitates formed, they further trapped vacancies. The supersaturated vacancy concentration in the Cu-rich precipitate induced a shear strain, which triggered the phase transition from bcc to fcc structure by transforming the initial bcc (110 plane into fcc (111 plane. In addition, the formation of the fcc-twin structure and the stacking fault structure in the Cu-rich precipitates was observed in dynamics simulations.

  2. Vacancy enhanced formation and phase transition of Cu-rich precipitates in α - iron under neutron irradiation

    Science.gov (United States)

    Lv, G. C.; Zhang, H.; He, X. F.; Yang, W.; Su, Y. J.

    2016-04-01

    In this paper, we employed both molecular statics and molecular dynamics simulation methods to investigate the role of vacancies in the formation and phase transition of Cu-rich precipitates in α-iron. The results indicated that vacancies promoted the diffusion of Cu atoms to form Cu-rich precipitates. After Cu-rich precipitates formed, they further trapped vacancies. The supersaturated vacancy concentration in the Cu-rich precipitate induced a shear strain, which triggered the phase transition from bcc to fcc structure by transforming the initial bcc (110) plane into fcc (111) plane. In addition, the formation of the fcc-twin structure and the stacking fault structure in the Cu-rich precipitates was observed in dynamics simulations.

  3. Effect of substrates on phase formation in PMN-PT 68/32 thin films by sol-gel process

    Energy Technology Data Exchange (ETDEWEB)

    Kumar, P. [Department of Physics, National Institute of Technology, Rourkela 769008 (India)], E-mail: pvn77@rediffmail.com; Sonia; Patel, R.K. [Department of Chemistry, National Institute of Technology, Rourkela 769008 (India); Prakash, C. [DRDO Bhawan, Rajaji Marg, New Delhi 110011 (India); Goel, T.C. [BITS Pilani-Goa Campus, Goa 403720 (India)

    2008-07-15

    PMN-PT 68/32 thin films have been prepared on Pt/Si, ITO coated glass, stainless steel and silicon substrates in the identical processing conditions by sol-gel process. Annealing temperature of 600 deg. C was ascertained by thermo gravimetric analysis (TGA) study of the dried sol-gel powder of PMNT-PT 68/32 composition. X-ray diffraction (XRD) study showed {approx}95% perovskite phase formation on Pt/Si and ITO coated glass substrates. SEM micrographs showed the formation of sub micron size grains on Pt/Si and ITO coated glass substrates. Diffuse phase transition with transition temperature (T{sub c}) {approx}190 deg. C was observed in 0.8 {mu}m thick PMN-PT 68/32 films deposited on Pt/Si and ITO coated glass substrates.

  4. EXTERNAL ACTION EFFECT ON THE STRUCTURE OF THE LIQUID PHASE, THE CRYSTALLIZATION PROCESS, STRUCTURE FORMATION OF COPPER

    Directory of Open Access Journals (Sweden)

    Mr. Eduard A. Dmitriev

    2016-09-01

    Full Text Available The paper presents the research results of a fluid phase overheating and alloying effect on cuprum mechanical characteristics. Careful analysis of poly-thermal cross-sections of electro-resistance proved that in order to obtain the maximum values of cuprum mechanical properties, it should be overheated 30 °С above the temperature threshold of abnormal electro-resistance change of a fluid phase (1320 °С. The paper presents the research results of the influence of thermal and thermo-high-speed treatment of cuprum melting on its structure, crystallization and structure formation processes. Regularities of structure change, crystallization parameters and structure formation depending on overheating and cooling rate of the melt are stated.

  5. Microstructure Formations in the Two-Phase Region of the Binary Peritectic Organic System TRIS-NPG

    Science.gov (United States)

    Mogeritsch, Johann; Ludwig, Andreas

    2012-01-01

    In order to prepare for an onboard experiment on the International Space Station (ISS), systematic directional solidification experiments with transparent hypoperitectic alloys were carried out at different solidification rates around the critical velocity for morphological stability of both solid phases. The investigations were done in the peritectic region of the binary transparent organic TRIS-NPG system where the formation of layered structures is expected to occur. The transparent appearance of the liquid and solid phase enables real time observations of the dynamic of pattern formation during solidification. The investigations show that frequently occurring nucleation events govern the peritectic solidification morphology which occurs at the limit of morphological stability. As a consequence, banded structures lead to coupled growth even if the lateral growth is much faster compared to the growth in pulling direction.

  6. Bioethanol in Biofuels Checked by an Amperometric Organic Phase Enzyme Electrode (OPEE Working in “Substrate Antagonism” Format

    Directory of Open Access Journals (Sweden)

    Mauro Tomassetti

    2016-08-01

    Full Text Available The bioethanol content of two samples of biofuels was determined directly, after simple dilution in decane, by means of an amperometric catalase enzyme biosensor working in the organic phase, based on substrate antagonisms format. The results were good from the point of view of accuracy, and satisfactory for what concerns the recovery test by the standard addition method. Limit of detection (LOD was on the order of 2.5 × 10−5 M.

  7. The Mechanism of 2-Furaldehyde Formation from d-Xylose Dehydration in the Gas Phase. A Tandem Mass Spectrometric Study

    Science.gov (United States)

    Ricci, Andreina; Piccolella, Simona; Pepi, Federico; Garzoli, Stefania; Giacomello, Pierluigi

    2013-07-01

    The mechanism of reactions occurring in solution can be investigated also in the gas phase by suited mass spectrometric techniques, which allow to highlight fundamental mechanistic features independent of the influence of the medium and to clarifying controversial hypotheses proposed in solution studies. In this work, we report a gas-phase study performed by electrospray triple stage quadrupole mass spectrometry (ESI-TSQ/MS) on the dehydration of d-xylose, leading mainly to the formation of 2-furaldehyde (2-FA). It is generally known in carbohydrate chemistry that the thermal acid catalyzed dehydration of pentoses leads to the formation of 2-FA, but several aspects on the solution-phase mechanism are controversial. Here, gaseous reactant ions corresponding to protonated xylose molecules obtained from ESI of a solution containing d-xylose and ammonium acetate as protonating reagent were allowed to undergo collisionally activated decomposition (CAD) into the triple stage quadrupole analyzer. The product ion mass spectra of protonated xylose are characterized by the presence of ionic intermediates arising from xylose dehydration, which were structurally characterized by their fragmentation patterns. As expected, the xylose triple dehydration leads to the formation of the ion at m/z 97, corresponding to protonated 2-FA. On the basis of mass spectrometric evidences, we demonstrated that in the gas phase, the formation of 2-FA involves protonation at the OH group bound to the C1 atom of the sugar, the first ionic intermediate being characterized by a cyclic structure. Finally, energy resolved product ion mass spectra allowed to obtain information on the energetic features of the d-xylose→2-FA conversion.

  8. Ageing behaviour of unary hydroxides in trivalent metal salt solutions: Formation of layered double hydroxide (LDH)-like phases

    Indian Academy of Sciences (India)

    Michael Rajamathi; P Vishnu Kamath

    2000-10-01

    The hydroxides of Mg, Ni, Cu and Zn transform into layered double hydroxide (LDH)-like phases on ageing in solutions of Al or Cr salts. This reaction is similar to acid leaching and proceeds by a dissolution–reprecipitation mechanism offering a simple method of LDH synthesis, with implications for the accepted theories of formation of LDH minerals in the earth’s crust.

  9. Superconductivity optimization and phase formation kinetics study of internal-Sn Nb{sub 3}Sn superconducting wires

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Chaowu

    2007-07-15

    Superconductors Nb{sub 3}Sn wires are one of the most applicable cryogenic superconducting materials and the best choice for high-field magnets exceeding 10 T. One of the most significant utilization is the ITER project which is regarded as the hope of future energy source. The high-Cu composite designs with smaller number of sub-element and non-reactive diffusion barrier, and the RRP (Restacked Rod Process) internal-Sn technology are usually applied for the wire manufacturing. Such designed and processed wires were supplied by MSA/Alstom and WST/NIN in this research. The systematic investigation on internal-Sn superconducting wires includes the optimization of heat treatment (HT) conditions, phase formation and its relation with superconductivity, microstructure analysis, and the phase formation kinetics. Because of the anfractuosity of the configuration design and metallurgical processing, the MF wires are not sufficient for studying a sole factor effect on superconductivity. Therefore, four sets of mono-element (ME) wires with different Sn ratios and different third-element addition were designed and fabricated in order to explore the relationship between phase formation and superconducting performances, particularly the A15 layer growth kinetics. Different characterization technic have been used (magnetization measurements, neutron diffraction and SEM/TEM/EDX analysis). The A15 layer thicknesses of various ME samples were measured and carried out linear and non-linear fits by means of two model equations. The results have clearly demonstrated that the phase formation kinetics of Nb{sub 3}Sn solid-state reaction is in accordance with an n power relation and the n value is increased with the increase of HT temperature and the Sn ratio in the wire composite. (author)

  10. High-temperature- and high-pressure-induced formation of the Laves-phase compound XeS2

    Science.gov (United States)

    Yan, Xiaozhen; Chen, Yangmei; Xiang, Shikai; Kuang, Xiaoyu; Bi, Yan; Chen, Haiyan

    2016-06-01

    We explore the reactivity of xenon with sulfur under high pressure, using unbiased structure searching techniques combined with first-principles calculations, which identify a stable XeS2 compound crystallized in a Laves phase with hypercoordinated (16-fold) Xe at 191 GPa and 0 K. Taking the thermal effects into account, we find that increasing the temperature could further stabilize it. The formation of XeS2 is a consequence of pressure-induced charge transfer from Xe to S atoms and the delocalization of Xe 5 p and S 3 p electrons. Meanwhile, the stabilization into a Laves phase of XeS2 is the result of delocalized chemical bonding and the need for optimum structure packing. The present discussion of the formation mechanism in XeS2 is general, and conclusions can be used to understand the formation of other Laves-phase compounds and the Xe chemistry that allows closed-shell Xe to participate in chemical reactions.

  11. The α-Effect and Competing Mechanisms: The Gas-Phase Reactions of Microsolvated Anions with Methyl Formate

    Science.gov (United States)

    Thomsen, Ditte L.; Nichols, Charles M.; Reece, Jennifer N.; Hammerum, Steen; Bierbaum, Veronica M.

    2013-12-01

    The enhanced reactivity of α-nucleophiles, which contain an electron lone pair adjacent to the reactive site, has been demonstrated in solution and in the gas phase and, recently, for the gas-phase SN2 reactions of the microsolvated HOO-(H2O) ion with methyl chloride. In the present work, we continue to explore the significance of microsolvation on the α-effect as we compare the gas-phase reactivity of the microsolvated α-nucleophile HOO-(H2O) with that of microsolvated normal alkoxy nucleophiles, RO-(H2O), in reactions with methyl formate, where three competing reactions are possible. The results reveal enhanced reactivity of HOO-(H2O) towards methyl formate, and clearly demonstrate the presence of an overall α-effect for the reactions of the microsolvated α-nucleophile. The association of the nucleophiles with a single water molecule significantly lowers the degree of proton abstraction and increases the SN2 and BAC2 reactivity compared with the unsolvated analogs. HOO-(H2O) reacts with methyl formate exclusively via the BAC2 channel. While microsolvation lowers the overall reaction efficiency, it enhances the BAC2 reaction efficiency for all anions compared with the unsolvated analogs. This may be explained by participation of the solvent water molecule in the BAC2 reaction in a way that continuously stabilizes the negative charge throughout the reaction.

  12. Structure transition of multiferroic hexagonal TmMnO3 compound under high pressure

    Science.gov (United States)

    Wang, L. J.; Feng, S. M.; Zhu, J. L.; Liu, Q. Q.; Li, Y. C.; Li, X. D.; Liu, J.; Jin, C. Q.

    2010-06-01

    The high-pressure-induced structure transition in multiferroic hexagonal TmMnO3 (h-TmMnO3) has been investigated using an in situ angle-dispersive synchrotron X-ray diffraction technique in a diamond anvil cell. The experimental results show that the phase transition from ambient hexagonal to orthorhombic structure with space group Pbnm begins around 10.2 GPa. The Rietveld refinement method was used to determine the lattice parameters and lattice compressibility of the h-TmMnO3 compound from 0.8 to 28.6 GPa. The pressure evolution of average bond distances and bond angles between the Mn and O atoms in the ab-plane was obtained. The magnetic properties under different pressures as well as their effect on multiferroic properties are discussed using extrapolations from the empirical relation of magnetic order versus rare-earth ionic radius.

  13. A tri-continuous mesoporous material with a silica pore wall following a hexagonal minimal surface

    KAUST Repository

    Han, Yu

    2009-04-06

    Ordered porous materials with unique pore structures and pore sizes in the mesoporous range (2-50nm) have many applications in catalysis, separation and drug delivery. Extensive research has resulted in mesoporous materials with one-dimensional, cage-like and bi-continuous pore structures. Three families of bi-continuous mesoporous materials have been made, with two interwoven but unconnected channels, corresponding to the liquid crystal phases used as templates. Here we report a three-dimensional hexagonal mesoporous silica, IBN-9, with a tri-continuous pore structure that is synthesized using a specially designed cationic surfactant template. IBN-9 consists of three identical continuous interpenetrating channels, which are separated by a silica wall that follows a hexagonal minimal surface. Such a tri-continuous mesostructure was predicted mathematically, but until now has not been observed in real materials. © 2009 Macmillan Publishers Limited. All rights reserved.

  14. Giant exchange bias in Mn2FeGa with hexagonal structure

    Science.gov (United States)

    Liu, Z. H.; Zhang, Y. J.; Zhang, H. G.; Zhang, X. J.; Ma, X. Q.

    2016-07-01

    In this study, we present the experimental observation that polycrystalline Mn2+xFe1-xGa (x = -0.2, 0, 0.2, 0.4) compounds can be synthesized to be D019-type (Ni3Sn-type) hexagonal structure with space group P63/mmc. A giant exchange bias field up to 1.32 kOe was achieved in hexagonal Mn2FeGa alloy at 5 K. A cluster glass state is confirmed by ac susceptibility measurement under different driving frequencies. Interestingly, robust horizontal and vertical shifts in magnetic hysteresis loop were simultaneously observed at 5 K under high cooling field up to 90 kOe. The large exchange bias is originated from the large exchange anisotropy between cluster glass phase and ferrimagnetic matrix. The vertical shift is thought to be attributed to the incomplete reversal of frozen cluster spins.

  15. Immiscibility of Fluid Phases at Magmatic-hydrothermal Transition: Formation of Various PGE-sulfide Mineralization for Layered Basic Intrusions

    Science.gov (United States)

    Zhitova, L.; Borisenko, A.; Morgunov, K.; Zhukova, I.

    2007-12-01

    Fluid inclusions in quartz of the Merensky Reef (Bushveld Complex, South Africa) and the Chineisky Pluton (Transbaikal Region, Russia) were studied using cryometry, microthermometry, Raman-spectroscopy, LA ICP- MS, scanning electronic microscopy, gas-chromatography and isotopic methods. This allowed us to document some examples of fluid phase separation resulting in formation of different types of PGE-sulfide mineralization for layered basic intrusions. The results obtained show at least three generations of fluid separated from boiling residual alumosilicate intercumulus liquid of the Merensky Reef. The earliest fluid phase composed of homogenous high-dense methane and nitrogen gas mixture was identified in primary gas and co-existing anomalous fluid inclusions from symplectitic quartz. The next generation, heterophase fluid, composed of brines containing a free low-dense (mostly of carbon dioxide) gas phase, was observed in primary multiphase and coexisting gas-rich inclusions of miarolitic quartz crystals. The latest generation was also a heterophase fluid (low salinity water-salt solution and free low-dense methane gas phase) found in primary water-salt and syngenetic gas inclusions from peripheral zones of miarolitic quartz crystals. For the Chineisky Pluton reduced endocontact magmatogene fluids changed to oxidized low salinity hydrothermal fluids in exocontact zone. This resulted in formation of sulfide-PGE enrichment marginal zones of intrusion. The results obtained give us a possibility to suggest that: 1) Fluid phase separation is a typical feature of magmatogene fluids for layered basic intrusions. 2) Reduced fluids can extract and transport substantial PGE and sulfide concentrations. 3) Oxidation of reduced fluids is one of the most important geochemical barriers causing abundant PGE minerals and sulfides precipitation. This in turn results in both formation of PGE reefs or enriched contact zones of layered basic intrusions. This work was supported by

  16. Phase selection enabled formation of abrupt axial heterojunctions in branched oxide nanowires.

    Science.gov (United States)

    Gao, Jing; Lebedev, Oleg I; Turner, Stuart; Li, Yong Feng; Lu, Yun Hao; Feng, Yuan Ping; Boullay, Philippe; Prellier, Wilfrid; van Tendeloo, Gustaaf; Wu, Tom

    2012-01-11

    Rational synthesis of nanowires via the vapor-liquid-solid (VLS) mechanism with compositional and structural controls is vitally important for fabricating functional nanodevices from bottom up. Here, we show that branched indium tin oxide nanowires can be in situ seeded in vapor transport growth using tailored Au-Cu alloys as catalyst. Furthermore, we demonstrate that VLS synthesis gives unprecedented freedom to navigate the ternary In-Sn-O phase diagram, and a rare and bulk-unstable cubic phase can be selectively stabilized in nanowires. The stabilized cubic fluorite phase possesses an unusual almost equimolar concentration of In and Sn, forming a defect-free epitaxial interface with the conventional bixbyite phase of tin-doped indium oxide that is the most employed transparent conducting oxide. This rational methodology of selecting phases and making abrupt axial heterojunctions in nanowires presents advantages over the conventional synthesis routes, promising novel composition-modulated nanomaterials.

  17. The mechanism of porosity formation during solvent-mediated phase transformations

    CERN Document Server

    Raufaste, Christophe; John, Timm; Meakin, Paul; Dysthe, Dag Kristian

    2010-01-01

    Solvent-mediated phase transformations often produce a porous product phase. We have studied replacement processes in the KBr-KCl-H2O system using both in situ and ex situ experiments. The replacement of a KBr crystal by a K(Br,Cl) solid solution in the presence of an aqueous solution is facilitated by the generation of a surprisingly stable, highly anisotropic and connected pore structure throughout the product phase. This pore structure ensures efficient transport from the bulk solution to the reacting KBr surface. The compositional profile of the K(Br,Cl) solid solution exhibits striking discontinuities across disc-like cavities in the product phase. Similar transformation mechanisms are probably important in controlling the rates of phase transformations in a variety of natural and man-made systems, on scales much larger than that of the crystals themselves.

  18. Gas-phase enthalpies of formation and enthalpies of sublimation of amino acids based on isodesmic reaction calculations.

    Science.gov (United States)

    Dorofeeva, Olga V; Ryzhova, Oxana N

    2014-05-15

    Accurate gas-phase enthalpies of formation (ΔfH298°) of 20 common α-amino acids, seven uncommon amino acids, and three small peptides were calculated by combining G4 theory calculations with an isodesmic reaction approach. The internal consistency over a set of ΔfH298°(g) values was achieved by sequential adjustment of their values through the isodesmic reactions. Four amino acids, alanine, β-alanine, sarcosine, and glycine, with reliable internally self-consistent experimental data, were chosen as the key reference compounds. These amino acids together with about 100 compounds with reliable experimental data (their accuracy was supported by G4 calculations) were used to estimate the enthalpies of formation of remaining amino acids. All of the amino acids with the previously established enthalpies of formation were later used as the reference species in the isodesmic reactions for the other amino acids. A systematic comparison was made of 14 experimentally determined enthalpies of formation with the results of calculations. The experimental enthalpies of formation for 10 amino acids were reproduced with good accuracy, but the experimental and calculated values for 4 compounds differed by 11–21 kJ/mol. For these species, the theoretical ΔfH298°(g) values were suggested as more reliable than the experimental values. On the basis of theoretical results, the recommended values for the gas-phase enthalpies of formation were also provided for amino acids for which the experimental ΔfH298°(g) were not available. The enthalpies of sublimation were evaluated for all compounds by taking into account the literature data on the solid-phase enthalpies of formation and the ΔfH298°(g) values recommended in our work. A special attention was paid to the accurate prediction of enthalpies of formation of amino acids from the atomization reactions. The problems associated with conformational flexibility of these compounds and harmonic treatment of low frequency torsional

  19. Massive Galaxies at High-z: Assembly Patterns, Structure & Dynamics in the Fast Phase of Galaxy Formation

    CERN Document Server

    Oñorbe, J; Domínguez-Tenreiro, R; Knebe, A; Serna, A

    2011-01-01

    Relaxed, massive galactic objects have been identified at redshifts z = 4;5; and 6 in hydrodynamical simulations run in a large cosmological volume. This allowed us to analyze the assembly patterns of the high mass end of the galaxy distribution at these high zs, by focusing on their structural and dynamical properties. Our simulations indicate that massive objects at high redshift already follow certain scaling relations. These relations define virial planes at the halo scale, whereas at the galactic scale they define intrinsic dynamical planes that are, however, tilted relative to the virial plane. Therefore, we predict that massive galaxies must lie on fundamental planes from their formation. We briefly discuss the physical origin of the tilt in terms the physical processes underlying massive galaxy formation at high z, in the context of a two-phase galaxy formation scenario. Specifically, we have found that it lies on the different behavior of the gravitationally heated gas as compared with cold gas previ...

  20. Formation of Mg$_2$C$_3$ phase in N220 nanocarbon containing low carbon MgO-C composition

    Indian Academy of Sciences (India)

    SATYANANDA BEHERA; RITWIK SARKAR

    2017-09-01

    This paper reports a non-conventional microstructurewith sequicarbide (Mg$_2$C$_3$) formation in N220 nanocarboncontaining low carbon magnesia carbon composition having magnesium metal powder as antioxidant. 5 wt% graphitecontaining MgO-C refractory with and without 1 wt% N220 nanocarbon is studied and 2 wt% magnesium metal powder isused as the lone antioxidant. The compositions were mixed with powder and liquid resin binder, pressed uniaxially at 150MPa and cured at 220$^{\\circ}$C. Cured samples were coked at 1000$^{\\circ}$C for 2 h. Matrix of the coked samples was studied in detail for microstructural analysis phase content and formation of nail-shaped sequicarbide was found in the nanocarbon containing compositions. The in-situ sequicarbide formation has resulted in the strength of the batch.

  1. Role of Fe substitution and quenching rate on the formation of various quasicrystalline and related phases

    Indian Academy of Sciences (India)

    Varsha Khare; R S Tiwari; O N Srivastava

    2001-06-01

    We have investigated Fe substituted versions of the quasicrystalline (qc) alloy corresponding to Al65Cu20(Cr, Fe)15 with special reference to the possible occurrence of various quasicrystalline and related phases. Based on the explorations of various compositions it has been found that alloy compositions Al65Cu20Cr12Fe3 and Al65Cu20Cr9Fe6 exhibit interesting structural phases and features at different quenching rates. At higher quenching rates (wheel speed ∼ 25 m/sec) all the alloys exhibit icosahedral phase. For Al65Cu20Cr12Fe3 alloy, however, both the icosahedral and even the decagonal phases get formed at higher quenching rates. At higher quenching rate, alloy having Fe 3 at% exhibits two bcc phases, bccI ( = 8.9 Å) and bccII ( = 15.45 Å). The orientation relationships between icosahedral and crystalline phases are: Mirror plane ∥[001]bcc I and [351]bcc II, 5-fold ∥ [113]bcc II and 3-fold ∥ [110]bcc II. At lower quenching rate, the alloy having Fe 6 at% exhibits orthorhombic phase ( = 23.6 Å, = 12.4 Å, = 20.1 Å). Some prominent orientation relationships of the orthorhombic phase with decagonal phase have also been reported. At lower quenching rate (∼ 10 m/sec), the alloy (Al65Cu22Cr9Fe6) shows the presence of diffuse scattering of intensities along quasiperiodic direction of the decagonal phase. For making the occurrence of the sheets of intensities intelligible, a model based on the rotation and shift of icosahedra has been put forward.

  2. Perfusion and diffusion MRI study detecting CBF disturbance and edema formation in the acute phase of cerebral contusion

    Energy Technology Data Exchange (ETDEWEB)

    Kawamata, Tatsuro; Aoyama, Naoki; Mori, Tatsuro; Maeda, Takeshi; Katayama, Yoichi [Nihon Univ., Tokyo (Japan). School of Medicine

    1998-12-01

    In order to clarify the mechanisms underlying cerebral contusion-induced CBF disturbance and edema formation, echoplanar diffusion and perfusion images were obtained in the patients with cerebral contusion. In the acute phase within 48 hours post-trauma, the apparent diffusion coefficient (ADC) showed various levels with a tendency to increase in the central area of contusion (ADC ratio=1.06{+-}0.21). In contrast, the ADC was significantly reduced in the peripheral area of contusion (ADC ratio=0.87{+-}0.16). The ADC at 2 weeks post-trauma increased both in the central (ADC ratio=1.16{+-}0.26) and the peripheral area of contusion (ADC ratio=1.10{+-}0.26, p<0.05), as compared to those within 48 hours post-trauma. The perfusion images showed a wide spread CBF depression extending beyond the area of contusion observed on the T1 and T2 weighted images. These results indicate that; in the early phase of contusion-induced edema formation, cytotoxic edema is predominant, especially in the peripheral area of contusion, and vasogenic edema appears thereafter. The CBF depression may contribute such cytotoxic edema formation in the surrounding area of cerebral contusion. It is concluded that echo-planar diffusion and perfusion images are excellent technique to investigate the evolution of CBF disturbance and edema formation following traumatic brain injury. (author)

  3. Satellite Formation Flight Results from Phase 1 of the Magnetospheric Multiscale Mission

    Science.gov (United States)

    Williams, Trevor; Ottenstein, Neil; Palmer, Eric; Godine, Dominic

    2017-01-01

    This paper describes the underlying dynamics of formation flying in a high-eccentricity orbit such as that of the Magnetospheric Multiscale mission. The GPS-based results used for MMS navigation are summarized, as well as the procedures that are used to design the maneuvers used to place the spacecraft into a tetrahedron formation and then maintain it. The details of how to carry out these maneuvers are then discussed. Finally, the numerical results that have been obtained concerning formation flying for the MMS mission to date (e.g. tetrahedron sizes flown, maneuver execution error, fuel usage, etc.) are presented in detail.

  4. Bootstrapping the Three-Loop Hexagon

    Energy Technology Data Exchange (ETDEWEB)

    Dixon, Lance J.; /CERN /SLAC; Drummond, James M.; /CERN /Annecy, LAPTH; Henn, Johannes M.; /Humboldt U., Berlin /Santa Barbara, KITP

    2011-11-08

    We consider the hexagonal Wilson loop dual to the six-point MHV amplitude in planar N = 4 super Yang-Mills theory. We apply constraints from the operator product expansion in the near-collinear limit to the symbol of the remainder function at three loops. Using these constraints, and assuming a natural ansatz for the symbol's entries, we determine the symbol up to just two undetermined constants. In the multi-Regge limit, both constants drop out from the symbol, enabling us to make a non-trivial confirmation of the BFKL prediction for the leading-log approximation. This result provides a strong consistency check of both our ansatz for the symbol and the duality between Wilson loops and MHV amplitudes. Furthermore, we predict the form of the full three-loop remainder function in the multi-Regge limit, beyond the leading-log approximation, up to a few constants representing terms not detected by the symbol. Our results confirm an all-loop prediction for the real part of the remainder function in multi-Regge 3 {yields} 3 scattering. In the multi-Regge limit, our result for the remainder function can be expressed entirely in terms of classical polylogarithms. For generic six-point kinematics other functions are required.

  5. Hyperbolic phonon polaritons in hexagonal boron nitride

    Science.gov (United States)

    Dai, Siyuan

    2015-03-01

    Uniaxial materials whose axial and tangential permittivities have opposite signs are referred to as indefinite or hyperbolic media. While hyperbolic responses are normally achieved with metamaterials, hexagonal boron nitride (hBN) naturally possesses this property due to the anisotropic phonons in the mid-infrared. Using scattering-type scanning near-field optical microscopy, we studied polaritonic phenomena in hBN. We performed infrared nano-imaging of highly confined and low-loss hyperbolic phonon polaritons in hBN. The polariton wavelength was shown to be governed by the hBN thickness according to a linear law persisting down to few atomic layers [Science, 343, 1125-1129 (2014)]. Additionally, we carried out the modification of hyperbolic response in heterostructures comprised of a mononlayer graphene deposited on hBN. Electrostatic gating of the top graphene layer allows for the modification of wavelength and intensity of hyperbolic phonon polaritons in bulk hBN. The physics of the modification originates from the plasmon-phonon coupling in the hyperbolic medium. Furthermore, we demonstrated the ``hyperlens'' for subdiffractional imaging and focusing using a slab of hBN.

  6. Performance of the ARIANNA Hexagonal Radio Array

    CERN Document Server

    Barwick, S W; Besson, D Z; Binder, G; Binns, W R; Boersma, D; Bose, R G; Braun, D L; Buckley, J H; Bugaev, V; Buitink, S; Dookayka, K; Dowkontt, P F; Duffin, T; Euler, S; Gerhardt, L; Gustafsson, L; Hallgren, A; Hanson, J C; Israel, M H; Kiryluk, J; Klein, S; Kleinfelder, S; Nelles, A; Niederhausen, H; Olevitch, M A; Persichelli, C; Ratzlaff, K; Rauch, B F; Reed, C; Roumi, M; Samanta, A; Simburger, G E; Stezelberger, T; Tatar, J; Uggerhoj, U; Walker, J; Young, R

    2015-01-01

    Installation of the ARIANNA Hexagonal Radio Array (HRA) on the Ross Ice Shelf of Antarctica has been completed. This detector serves as a pilot program to the ARIANNA neutrino telescope, which aims to measure the diffuse flux of very high energy neutrinos by observing the radio pulse generated by neutrino-induced charged particle showers in the ice. All HRA stations ran reliably and took data during the entire 2014-2015 austral summer season. A new radio signal direction reconstruction procedure is described, and is observed to have a resolution better than a degree. The reconstruction is used in a preliminary search for potential neutrino candidate events in the data from one of the newly installed detector stations. Three cuts are used to separate radio backgrounds from neutrino signals. The cuts are found to filter out all data recorded by the station during the season while preserving 85.4% of simulated neutrino events that trigger the station. This efficiency is similar to that found in analyses of previ...

  7. Coherent acoustic phonons in hexagonal manganite LuMnO3

    Science.gov (United States)

    Lim, D.; Averitt, R. D.; Demsar, J.; Taylor, A. J.; Hur, N.; Cheong, S. W.

    2003-12-01

    We have observed coherent acoustic phonons in the hexagonal manganite LuMnO3 using two-color femtosecond optical pump-probe spectroscopy. The dependence of the oscillatory component of the photoinduced reflectivity on the probe wavelength and incident angle is consistent with a propagating strain pulse. Moreover, the frequency, dephasing, and phase of the oscillation are found to be temperature dependent. In particular, a large phase shift occurs in the vicinity of the Néel temperature (TN), which we relate to the temperature-dependent on-site Mn d-d transition that is coupled to antiferromagnetic ordering, as recently observed in optical conductivity measurements.

  8. Self-formation of microporous polysulfone hollow fiber using a single nozzle spinneret and reduction of phase-inversion speed

    Science.gov (United States)

    Kim, Hyung Jin; Jang, Chang Sik; Kim, Byeong Hee; Seo, Young Ho

    2016-06-01

    This study proposed a simple fabrication technique for microporous hollow fibers whose inner channel was naturally formed because of a slow phase inversion speed. Conventionally, microporous hollow fibers have been fabricated by extruding a polymer solution through the outer nozzle and a bore liquid through the inner nozzle of a dual nozzle spinneret. Injecting a bore liquid played a key role for the formation of a hollow structure. In this study, the self-formation of a hollow structure of microporous fiber was developed using a single nozzle spinneret without a bore liquid. A sharp tip single nozzle spinneret of 200 µm in diameter was fabricated by the wetting effect of a liquid pre-polymer of polydimethylsiloxane, and polysulfone solution was extruded through the prepared single nozzle spinneret. The temperature of the coagulant bath was controlled in order to reduce the speed of phase change, because the phase-change speed depended on the temperature of the coagulant solution. An inner channel in the microporous fiber was successfully fabricated by reducing the phase-change speed and by increasing the solidification speed. The inner diameter of the microporous hollow fiber was decreased as the temperature of the coagulant bath was increased, and eventually the inner channel was not formed at the higher bath temperature rather than 25 °C.

  9. Influence of Homogenization and Micro/Nano Source of Starting Powders on Format Ion of the Single YAP Phase

    Directory of Open Access Journals (Sweden)

    Michalik D.

    2016-12-01

    Full Text Available Manufacturing high purity polycrystalline YAlO3 (YAP ceramics could replace monocrystalline YAP thus recently it is an interesting task for low cost producers of scintillators. The paper presents influence of different source of initial oxide powders (micro/nano powders of Y2O3 and Al2O3 and the method of their homogenization on the formation of a YAP phase. The solid state reaction method was used to prepare YAP powder or ceramic pellets. After preheating, all samples in the form of powders and pellets were heat-treated in the temperature range of 1050-1650 °C. DTA method was applied for examination of the phase crystallization in the tested system. X-ray diffraction method (XRD was used for characterization of the phase composition. X-ray microanalysis (EDS was used to control homogeneity in the small areas. Morphology of the resultant samples are presented on SEM pictures. The results show a significant influence of the starting powders on the homogeneity, purity and temperature of formation of the main phase.

  10. Complex magnetism of Ho-Dy-Y-Gd-Tb hexagonal high-entropy alloy

    Science.gov (United States)

    Lužnik, J.; Koželj, P.; Vrtnik, S.; Jelen, A.; Jagličić, Z.; Meden, A.; Feuerbacher, M.; Dolinšek, J.

    2015-12-01

    Rare earth based equimolar Ho-Dy-Y-Gd-Tb hexagonal high-entropy alloy (HEA) is a prototype of an ideal HEA, stabilized by the entropy of mixing at any temperature with random mixing of elements on the hexagonal close-packed lattice. In order to determine intrinsic properties of an ideal HEA characterized by the enormous chemical (substitutional) disorder on a weakly distorted simple lattice, we have performed measurements of its magnetic and electrical response and the specific heat. The results show that the Ho-Dy-Y-Gd-Tb hexagonal HEA exhibits a rich and complex magnetic field-temperature (H ,T ) phase diagram, as a result of competition among the periodic potential arising from the electronic band structure that favors periodic magnetic ordering, the disorder-induced local random potential that favors spin glass-type spin freezing in random directions, the Zeeman interaction with the external field that favors spin alignment along the field direction, and the thermal agitation that opposes any spin ordering. Three characteristic temperature regions were identified in the (H ,T ) phase diagram between room temperature and 2 K. Within the upper temperature region I (roughly between 300 and 75 K), thermal fluctuations average out the effect of local random pinning potential and the spin system behaves as a pure system of compositionally averaged spins, undergoing a thermodynamic phase transition to a long-range ordered helical antiferromagnetic state at the Néel temperature TN=180 K that is a compositional average of the Néel temperatures of pure Tb, Dy, and Ho metals. Region II (between 75 and 20 K) is an intermediate region where the long-range periodic spin order "melts" and the random ordering of spins in the local random potential starts to prevail. Within the low-temperature region III (below 20 K), the spins gradually freeze in a spin glass configuration. The spin glass phase appears to be specific to the rare earths containing hexagonal HEAs, sharing

  11. Phase-shift effect of amplitude spread function on spectrum and image formation in coherent Raman scattering microspectroscopy.

    Science.gov (United States)

    Fukutake, Naoki

    2016-03-01

    Coherent Raman scattering microspectroscopy, which includes coherent anti-Stokes Raman scattering (CARS) and stimulated Raman scattering (SRS) microspectroscopy, permits label-free hyperspectral imaging. We report the theoretical study of the phase-shift effect of the impulse response function on the spectral and image-forming properties of coherent Raman scattering microspectroscopy. We show that the spectrum and image are influenced by not only the NA of objective for excitation (NA(ex)) but also that for signal collection (NA(col)), in association with the phase-shift effect. We discuss that, under the condition NA(ex)≠NA(col), both the spectrum and the image become deformed by the phase-shift effect, which can be applied to the direct measurement of the imaginary part of the nonlinear susceptibility in CARS spectroscopy. We point out that, even in SRS microscopy, the nonresonant background can contribute to the image formation and cause the artifact in the image.

  12. Autofocus Correction of Azimuth Phase Error and Residual Range Cell Migration in Spotlight SAR Polar Format Imagery

    CERN Document Server

    Mao, Xinhua; Zhu, Zhaoda

    2012-01-01

    Synthetic aperture radar (SAR) images are often blurred by phase perturbations induced by uncompensated sensor motion and /or unknown propagation effects caused by turbulent media. To get refocused images, autofocus proves to be useful post-processing technique applied to estimate and compensate the unknown phase errors. However, a severe drawback of the conventional autofocus algorithms is that they are only capable of removing one-dimensional azimuth phase errors (APE). As the resolution becomes finer, residual range cell migration (RCM), which makes the defocus inherently two-dimensional, becomes a new challenge. In this paper, correction of APE and residual RCM are presented in the framework of polar format algorithm (PFA). First, an insight into the underlying mathematical mechanism of polar reformatting is presented. Then based on this new formulation, the effect of polar reformatting on the uncompensated APE and residual RCM is investigated in detail. By using the derived analytical relationship betwee...

  13. On the formation of molecules and solid-state compounds from the AGB to the PN phases

    CERN Document Server

    Garcia-Hernandez, D A

    2016-01-01

    During the asymptoyic giant branch (AGB) phase, different elements are dredge-up to the stellar surface depending on progenitor mass and metallicity. When the mass loss increases at the end of the AGB, a circumstellar dust shell is formed, where different (C-rich or O-rich) molecules and solid-state compounds are formed. These are further processed in the transition phase between AGB stars and planetary nebulae (PNe) to create more complex organic molecules and inorganic solid-state compounds (e.g., polycyclic aromatic hydrocarbons, fullerenes, and graphene precursors in C-rich environments and oxides and crystalline silicates in O-rich ones). We present an observational review of the different molecules and solid-state materials that are formed from the AGB to the PN phases. We focus on the formation routes of complex fullerene (and fullerene-based) molecules as well as on the level of dust processing depending on metallicity.

  14. On the formation of molecules and solid-state compounds from the AGB to the PN phases

    Science.gov (United States)

    García-Hernández, D. A.; Manchado, A.

    2016-07-01

    During the asymptoyic giant branch (AGB) phase, different elements are dredge- up to the stellar surface depending on progenitor mass and metallicity. When the mass loss increases at the end of the AGB, a circumstellar dust shell is formed, where different (C-rich or O-rich) molecules and solid-state compounds are formed. These are further processed in the transition phase between AGB stars and planetary nebulae (PNe) to create more complex organic molecules and inorganic solid-state compounds (e.g., polycyclic aromatic hydrocarbons, fullerenes, and graphene precursors in C-rich environments and oxides and crystalline silicates in O-rich ones). We present an observational review of the different molecules and solid-state materials that are formed from the AGB to the PN phases. We focus on the formation routes of complex fullerene (and fullerene-based) molecules as well as on the level of dust processing depending on metallicity.

  15. Study the Postbuckling of Hexagonal Piezoelectric Nanowires with Surface Effect

    Directory of Open Access Journals (Sweden)

    O. Rahmani

    2014-04-01

    Full Text Available Piezoelectric nanobeams having circular, rectangular and hexagonal cross-sections are synthesized and used in various Nano structures; however, piezoelectric nanobeams with hexagonal cross-sections have not been studied in detail. In particular, the physical mechanisms of the surface effect and the role of surface stress, surface elasticity and surface piezoelectricity have not been discussed thoroughly. The present study investigated post-buckling behavior of piezoelectric nanobeams by examining surface effects. The energy method was applied to post-buckling of hexagonal nanobeams and the critical buckling voltage and amplitude are derived analytically from bulk and surface material properties and geometric factors.

  16. Whole Core Transport Calculation Methodology for a Hexagonal Core

    Energy Technology Data Exchange (ETDEWEB)

    Cho, J. Y.; Kim, K. S.; Lee, C. C.; Zee, S. Q.; Joo, H. G

    2007-07-15

    This report discusses the hexagonal module implemented to the DeCART code and the performance of them. The implemented hexagonal module includes the hexagonal ray tracing and the CMFD acceleration modules. The performance of the implemented hexagonal module is examined for 4 tests of: (1) CMFD acceleration test, (2) the accuracy test of the hexagonal module, (3) the performance test for 2-D NGNP problem and (4) the applicability test for 3-D NGNP problem. The features of the implemented hexagonal modules are: (1) The Modular ray tracing scheme based on a hexagonal assembly and a path linking scheme between the modular rays. (2) Segment generation based on the structure unit. (3) Cell ray approximation: This feature is developed to reduce the memory required to store the segment information. (4) Modified cycle ray scheme that begins the ray tracing at a given surface and finishes if the reflected ray meets the starting surface. This feature is developed to reduce the memory required for the angular flux at the core boundary. (5) Fixed assembly geometry. The pin geometry of the single pin per assembly problem is different from that of the multi-pin problem. The core geometry of a single assembly problem is also different from that of the multi-assembly problem. (6) CMFD module based on unstructured cell. This feature is to deal with the irregular gap cells that are positioned at the assembly boundaries. The examination results of the 4 tests can be summarized as: (1) The CMFD acceleration test shows that the CMFD module speedups about greater than 200 for the core problem. (2) The accuracy test shows that the hexagonal MOC module produces an accurate solution of less than 60 pcm of eigenvalue and less than 2 % of local pin power errors. (3) The performance test for 2-D NGNP problem shows that the implemented hexagonal module works soundly and produces a reasonable solution by cooperating with the existing DeCART library and the other modules. (4) The applicability

  17. Synthesis of ultrathin face-centered-cubic Au@Pt and Au@Pd core-shell nanoplates from hexagonal-close-packed Au square sheets

    KAUST Repository

    Fan, Zhanxi

    2015-03-17

    The synthesis of ultrathin face-centered-cubic (fcc) Au@Pt rhombic nanoplates is reported through the epitaxial growth of Pt on hexagonal-close-packed (hcp) Au square sheets (AuSSs). The Pt-layer growth results in a hcp-to-fcc phase transformation of the AuSSs under ambient conditions. Interestingly, the obtained fcc Au@Pt rhombic nanoplates demonstrate a unique (101)f orientation with the same atomic arrangement extending from the Au core to the Pt shell. Importantly, this method can be extended to the epitaxial growth of Pd on hcp AuSSs, resulting in the unprecedented formation of fcc Au@Pd rhombic nanoplates with (101)f orientation. Additionally, a small amount of fcc (100)f-oriented Au@Pt and Au@Pd square nanoplates are obtained with the Au@Pt and Au@Pd rhombic nanoplates, respectively. We believe that these findings will shed new light on the synthesis of novel noble bimetallic nanostructures. Phase change: Ultrathin Au@Pt and Au@Pd core-shell nanoplates were prepared from Au square sheets. A phase transformation from hexagonal close-packed (hcp) to face-centered cubic (fcc) is observed upon coating the hcp Au square sheets with Pt or Pd under ambient conditions. The prepared fcc Au@Pt and Au@Pd rhombic nanoplates demonstrate unique (101)f orientation (picture shows a typical fcc Au@Pt rhombic nanoplate). © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  18. New Pathways for the Formation of Complex Organics and Prebiotic Synthesis in the Gas Phase

    Science.gov (United States)

    El-Shall, M. S.

    2010-04-01

    We study the formation mechanisms of complex organics that are present in interstellar clouds. The reaction of acetylene ion with water produces vinyl alcohol while the reaction of benzene ion with acetylene produces naphthalene-type ion.

  19. Formation mechanism of primary phases and eutectic structures within undercooled Pb-Sb-Sn ternary alloys

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    The solidification characteristics of three types of Pb-Sb-Sn ternary alloys with different primary phases were studied under substantial undercooling conditions. The experimental results show that primary (Pb) and SbSn phases grow in the dendritic mode, whereas primary (Sb) phase exhibits faceted growth in the form of polygonal blocks and long strips. (Pb) solid solution phase displays strong affinity with SbSn intermetallic compound so that they produce various morphologies of pseudobinary eutectics, but it can only grow in the divorced eutectic mode together with (Sb) phase. Although (Sb) solid solution phase and SbSn intermetallic com- pound may grow cooperatively within ternary eutectic microstructures, they sel- dom form pseudobinary eutectics independently. The (Pb)+(Sb)+SbSn ternary eutectic structure usually shows lamellar morphology, but appears as anomalous eutectic when its volume fraction becomes small. EDS analyses reveal that all of the three primary (Pb), (Sb) and SbSn phases exhibit conspicuous solute trapping effect during rapid solidification, which results in the remarkable extension of sol- ute solubility.

  20. Formation mechanism of primary phases and eutectic structures within undercooled Pb-Sb-Sn ternary alloys

    Institute of Scientific and Technical Information of China (English)

    WANG WeiLi; DAI FuPing; WEI BingBo

    2007-01-01

    The solidification characteristics of three types of Pb-Sb-Sn ternary alloys with different primary phases were studied under substantial undercooling conditions. The experimental results show that primary (Pb) and SbSn phases grow in the dendritic mode, whereas primary (Sb) phase exhibits faceted growth in the form of polygonal blocks and long strips. (Pb) solid solution phase displays strong affinity with SbSn intermetallic compound so that they produce various morphologies of pseudobinary eutectics, but it can only grow in the divorced eutectic mode together with (Sb) phase. Although (Sb) solid solution phase and SbSn intermetallic compound may grow cooperatively within ternary eutectic microstructures, they seldom form pseudobinary eutectics independently. The (Pb)+(Sb)+SbSn ternary eutectic structure usually shows lamellar morphology, but appears as anomalous eutectic when its volume fraction becomes small. EDS analyses reveal that all of the three primary (Pb), (Sb) and SbSn phases exhibit conspicuous solute trapping effect during rapid solidification, which results in the remarkable extension of solute solubility.